*HEADER    STRUCTURAL GENOMICS, UNKNOWN FUNCTION   26-JUN-06   2HG7              
*TITLE     SOLUTION NMR STRUCTURE OF PHAGE-LIKE ELEMENT PBSX PROTEIN             
*TITLE    2 XKDW, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM TARGET SR355          
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PHAGE-LIKE ELEMENT PBSX PROTEIN XKDW;                      
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS;                              
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 GENE: XKDW;                                                          
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BC21(DE3)+MAGIC;                           
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PLASMID;                                   
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: SR355-21.2                                
*KEYWDS    PHAGE-LIKE ELEMENT PBSX PROTEIN XKDW, DIMER, GFT NMR,                 
*KEYWDS   2 STRUCTURAL GENOMICS, PSI, PROTEIN STRUCTURE INITIATIVE,              
*KEYWDS   3 NORTHEAST STRUCTURAL GENOMICS CONSORTIUM, NESG                       
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    G.LIU, D.PARISH, D.XU, H.ATREYA, D.SUKUMARAN, C.K.HO,                 
*AUTHOR   2 M.JIANG, K.CUNNINGHAM, L.-C.MA, R.XIAO, J.LIU, M.BARAN,              
*AUTHOR   3 G.V.SWAPNA, T.B.ACTON, B.ROST, G.T.MONTELIONE, T.SZYPERSKI,          
*AUTHOR   4 NORTHEAST STRUCTURAL GENOMICS CONSORTIUM (NESG)                      
*REVDAT   1   22-AUG-06 2HG7    0                                                


assign ( resid    2 and name HA   )   ( resid    3 and name HN   )   2.22  0.42  0.42
assign ( resid    2 and name HB   )   ( resid    3 and name HN   )   2.98  1.19  1.19
assign ( resid    3 and name HN   )   ( resid    3 and name HB2  )   2.37  0.57  0.57
assign ( resid    3 and name HN   )   ( resid    3 and name HB1  )   2.45  0.66  0.66
assign ( resid    3 and name HN   )   ( resid    4 and name HN   )   2.83  1.03  1.03
assign ( resid    3 and name HB2  )   ( resid    4 and name HN   )   2.71  0.91  0.91
assign ( resid    3 and name HB1  )   ( resid    4 and name HN   )   2.51  0.71  0.71
assign ( resid    4 and name HN   )   ( resid    4 and name HB1  )   2.44  0.64  0.64
assign ( resid    4 and name HN   )   ( resid    4 and name HB2  )   2.40  0.61  0.61
assign ( resid    4 and name HN   )   ( resid    5 and name HN   )   2.71  0.91  0.91
assign ( resid    4 and name HB1  )   ( resid    5 and name HN   )   2.66  0.86  0.86
assign ( resid    4 and name HB2  )   ( resid    5 and name HN   )   2.93  1.14  1.14
assign ( resid    5 and name HN   )   ( resid    5 and name HB1  )   2.66  0.86  0.86
assign ( resid    5 and name HN   )   ( resid    5 and name HB2  )   2.49  0.69  0.69
assign ( resid    5 and name HN   )   ( resid    6 and name HN   )   2.40  0.61  0.61
assign ( resid    5 and name HB1  )   ( resid    6 and name HN   )   2.52  0.73  0.73
assign ( resid    5 and name HB2  )   ( resid    6 and name HN   )   2.85  1.05  1.05
assign ( resid    6 and name HN   )   ( resid    7 and name HN   )   2.68  0.88  0.88
assign ( resid    7 and name HN   )   ( resid    7 and name HB   )   2.35  0.56  0.56
assign ( resid    7 and name HN   )   ( resid    8 and name HN   )   2.49  0.69  0.69
assign ( resid    7 and name HB   )   ( resid    8 and name HN   )   2.37  0.57  0.57
assign ( resid    8 and name HN   )   ( resid    8 and name HA   )   2.35  0.56  0.56
assign ( resid    8 and name HN   )   ( resid    9 and name HN   )   2.37  0.57  0.57
assign ( resid    8 and name HB*  )   ( resid    9 and name HN   )   3.10  1.30  1.30
assign ( resid    9 and name HN   )   ( resid    9 and name HA   )   2.34  0.54  0.54
assign ( resid    9 and name HN   )   ( resid    9 and name HB*  )   2.69  0.90  0.90
assign ( resid    9 and name HN   )   ( resid   10 and name HN   )   2.42  0.63  0.63
assign ( resid    9 and name HB*  )   ( resid   10 and name HN   )   3.06  1.27  1.27
assign ( resid   10 and name HN   )   ( resid   10 and name HB2  )   2.45  0.66  0.66
assign ( resid   10 and name HN   )   ( resid   10 and name HB1  )   2.49  0.69  0.69
assign ( resid   10 and name HN   )   ( resid   11 and name HN   )   2.39  0.59  0.59
assign ( resid   10 and name HA   )   ( resid   11 and name HN   )   2.66  0.86  0.86
assign ( resid   10 and name HB2  )   ( resid   11 and name HN   )   3.07  1.27  1.27
assign ( resid   10 and name HB1  )   ( resid   11 and name HN   )   2.57  0.78  0.78
assign ( resid   11 and name HN   )   ( resid   11 and name HB2  )   2.47  0.68  0.68
assign ( resid   11 and name HN   )   ( resid   11 and name HB1  )   2.78  0.98  0.98
assign ( resid   12 and name HB2  )   ( resid   13 and name HN   )   2.71  0.91  0.91
assign ( resid   12 and name HB1  )   ( resid   13 and name HN   )   2.98  1.19  1.19
assign ( resid   13 and name HN   )   ( resid   13 and name HB2  )   2.37  0.57  0.57
assign ( resid   13 and name HN   )   ( resid   13 and name HB1  )   2.64  0.85  0.85
assign ( resid   13 and name HN   )   ( resid   14 and name HN   )   2.25  0.46  0.46
assign ( resid   13 and name HB2  )   ( resid   14 and name HN   )   2.98  1.19  1.19
assign ( resid   14 and name HN   )   ( resid   15 and name HN   )   3.71  1.92  1.92
assign ( resid   15 and name HN   )   ( resid   15 and name HB   )   2.74  0.95  0.95
assign ( resid   15 and name HA   )   ( resid   16 and name HN   )   2.15  0.35  0.35
assign ( resid   16 and name HN   )   ( resid   16 and name HB2  )   2.74  0.95  0.95
assign ( resid   16 and name HA   )   ( resid   17 and name HN   )   2.15  0.35  0.35
assign ( resid   16 and name HB2  )   ( resid   17 and name HN   )   3.37  1.58  1.58
assign ( resid   16 and name HB1  )   ( resid   17 and name HN   )   3.37  1.58  1.58
assign ( resid   17 and name HN   )   ( resid   17 and name HA   )   2.23  0.44  0.44
assign ( resid   17 and name HN   )   ( resid   17 and name HB2  )   2.81  1.02  1.02
assign ( resid   17 and name HN   )   ( resid   17 and name HB1  )   2.98  1.19  1.19
assign ( resid   17 and name HN   )   ( resid   18 and name HN   )   2.45  0.66  0.66
assign ( resid   17 and name HB2  )   ( resid   18 and name HN   )   3.07  1.27  1.27
assign ( resid   17 and name HB1  )   ( resid   18 and name HN   )   3.13  1.34  1.34
assign ( resid   18 and name HN   )   ( resid   18 and name HA   )   2.37  0.57  0.57
assign ( resid   18 and name HN   )   ( resid   18 and name HB1  )   2.66  0.86  0.86
assign ( resid   18 and name HN   )   ( resid   18 and name HB2  )   2.66  0.86  0.86
assign ( resid   18 and name HN   )   ( resid   19 and name HN   )   2.20  0.40  0.40
assign ( resid   18 and name HB1  )   ( resid   19 and name HN   )   2.81  1.02  1.02
assign ( resid   19 and name HN   )   ( resid   20 and name HN   )   2.42  0.63  0.63
assign ( resid   20 and name HA   )   ( resid   21 and name HN   )   2.20  0.40  0.40
assign ( resid   20 and name HB2  )   ( resid   21 and name HN   )   3.02  1.22  1.22
assign ( resid   20 and name HB1  )   ( resid   21 and name HN   )   3.02  1.22  1.22
assign ( resid   21 and name HN   )   ( resid   21 and name HB2  )   2.68  0.88  0.88
assign ( resid   21 and name HN   )   ( resid   21 and name HB1  )   2.68  0.88  0.88
assign ( resid   21 and name HN   )   ( resid   22 and name HN   )   3.36  1.56  1.56
assign ( resid   21 and name HA   )   ( resid   22 and name HN   )   2.18  0.39  0.39
assign ( resid   21 and name HB2  )   ( resid   22 and name HN   )   3.00  1.20  1.20
assign ( resid   21 and name HB1  )   ( resid   22 and name HN   )   3.00  1.20  1.20
assign ( resid   22 and name HN   )   ( resid   22 and name HB1  )   2.95  1.15  1.15
assign ( resid   22 and name HN   )   ( resid   22 and name HB2  )   2.68  0.88  0.88
assign ( resid   22 and name HN   )   ( resid   23 and name HN   )   3.73  1.93  1.93
assign ( resid   22 and name HA   )   ( resid   23 and name HN   )   2.22  0.42  0.42
assign ( resid   22 and name HB1  )   ( resid   23 and name HN   )   2.62  0.83  0.83
assign ( resid   22 and name HB2  )   ( resid   23 and name HN   )   2.71  0.91  0.91
assign ( resid   23 and name HN   )   ( resid   24 and name HN   )   3.32  1.53  1.53
assign ( resid   23 and name HA   )   ( resid   24 and name HN   )   2.10  0.30  0.30
assign ( resid   23 and name HB*  )   ( resid   24 and name HN   )   2.98  1.18  1.18
assign ( resid   24 and name HN   )   ( resid   24 and name HB1  )   2.54  0.74  0.74
assign ( resid   24 and name HN   )   ( resid   24 and name HB2  )   2.37  0.57  0.57
assign ( resid   24 and name HN   )   ( resid   25 and name HN   )   3.20  1.41  1.41
assign ( resid   24 and name HA   )   ( resid   25 and name HN   )   2.18  0.39  0.39
assign ( resid   24 and name HB1  )   ( resid   25 and name HN   )   3.13  1.34  1.34
assign ( resid   24 and name HB2  )   ( resid   25 and name HN   )   3.13  1.34  1.34
assign ( resid   25 and name HN   )   ( resid   25 and name HB2  )   2.68  0.88  0.88
assign ( resid   25 and name HN   )   ( resid   25 and name HB1  )   2.68  0.88  0.88
assign ( resid   25 and name HN   )   ( resid   26 and name HN   )   2.93  1.14  1.14
assign ( resid   25 and name HB2  )   ( resid   26 and name HN   )   3.41  1.61  1.61
assign ( resid   25 and name HB1  )   ( resid   26 and name HN   )   3.41  1.61  1.61
assign ( resid   26 and name HN   )   ( resid   27 and name HN   )   3.00  1.20  1.20
assign ( resid   27 and name HN   )   ( resid   27 and name HB2  )   2.71  0.91  0.91
assign ( resid   27 and name HN   )   ( resid   27 and name HB1  )   2.71  0.91  0.91
assign ( resid   27 and name HN   )   ( resid   28 and name HN   )   2.40  0.61  0.61
assign ( resid   27 and name HA   )   ( resid   28 and name HN   )   2.51  0.71  0.71
assign ( resid   27 and name HB2  )   ( resid   28 and name HN   )   3.19  1.39  1.39
assign ( resid   27 and name HB1  )   ( resid   28 and name HN   )   3.19  1.39  1.39
assign ( resid   28 and name HN   )   ( resid   28 and name HA2  )   2.32  0.52  0.52
assign ( resid   28 and name HN   )   ( resid   29 and name HN   )   3.12  1.32  1.32
assign ( resid   28 and name HA1  )   ( resid   29 and name HN   )   2.35  0.56  0.56
assign ( resid   28 and name HA2  )   ( resid   29 and name HN   )   2.27  0.47  0.47
assign ( resid   29 and name HN   )   ( resid   29 and name HB*  )   2.79  1.00  1.00
assign ( resid   29 and name HN   )   ( resid   30 and name HN   )   3.22  1.42  1.42
assign ( resid   29 and name HA   )   ( resid   30 and name HN   )   2.17  0.37  0.37
assign ( resid   30 and name HN   )   ( resid   31 and name HN   )   3.47  1.68  1.68
assign ( resid   30 and name HA   )   ( resid   31 and name HN   )   2.28  0.49  0.49
assign ( resid   30 and name HB2  )   ( resid   31 and name HN   )   2.71  0.91  0.91
assign ( resid   30 and name HB1  )   ( resid   31 and name HN   )   2.71  0.91  0.91
assign ( resid   31 and name HN   )   ( resid   31 and name HB   )   2.39  0.59  0.59
assign ( resid   31 and name HN   )   ( resid   32 and name HN   )   3.68  1.88  1.88
assign ( resid   31 and name HA   )   ( resid   32 and name HN   )   2.27  0.47  0.47
assign ( resid   32 and name HN   )   ( resid   33 and name HN   )   2.35  0.56  0.56
assign ( resid   33 and name HN   )   ( resid   34 and name HN   )   3.32  1.53  1.53
assign ( resid   33 and name HA   )   ( resid   34 and name HN   )   2.15  0.35  0.35
assign ( resid   34 and name HN   )   ( resid   34 and name HB2  )   2.54  0.74  0.74
assign ( resid   34 and name HN   )   ( resid   34 and name HB1  )   2.59  0.80  0.80
assign ( resid   34 and name HN   )   ( resid   35 and name HN   )   3.39  1.59  1.59
assign ( resid   34 and name HA   )   ( resid   35 and name HN   )   2.17  0.37  0.37
assign ( resid   34 and name HB2  )   ( resid   35 and name HN   )   3.61  1.82  1.82
assign ( resid   34 and name HB1  )   ( resid   35 and name HN   )   3.80  2.00  2.00
assign ( resid   35 and name HN   )   ( resid   35 and name HB2  )   2.52  0.73  0.73
assign ( resid   35 and name HN   )   ( resid   35 and name HB1  )   2.74  0.95  0.95
assign ( resid   35 and name HN   )   ( resid   36 and name HN   )   2.34  0.54  0.54
assign ( resid   35 and name HA   )   ( resid   36 and name HN   )   2.49  0.69  0.69
assign ( resid   35 and name HB2  )   ( resid   36 and name HN   )   3.19  1.39  1.39
assign ( resid   35 and name HB1  )   ( resid   36 and name HN   )   3.53  1.73  1.73
assign ( resid   36 and name HN   )   ( resid   36 and name HB2  )   2.47  0.68  0.68
assign ( resid   36 and name HN   )   ( resid   36 and name HB1  )   2.73  0.93  0.93
assign ( resid   36 and name HN   )   ( resid   37 and name HN   )   3.71  1.92  1.92
assign ( resid   36 and name HA   )   ( resid   37 and name HN   )   2.35  0.56  0.56
assign ( resid   36 and name HB2  )   ( resid   37 and name HN   )   2.95  1.15  1.15
assign ( resid   36 and name HB1  )   ( resid   37 and name HN   )   2.57  0.78  0.78
assign ( resid   37 and name HN   )   ( resid   37 and name HB2  )   2.45  0.66  0.66
assign ( resid   37 and name HN   )   ( resid   37 and name HB1  )   2.74  0.95  0.95
assign ( resid   37 and name HN   )   ( resid   38 and name HN   )   2.74  0.95  0.95
assign ( resid   37 and name HA   )   ( resid   38 and name HN   )   2.23  0.44  0.44
assign ( resid   37 and name HB2  )   ( resid   38 and name HN   )   3.13  1.34  1.34
assign ( resid   37 and name HB1  )   ( resid   38 and name HN   )   3.13  1.34  1.34
assign ( resid   39 and name HA   )   ( resid   40 and name HN   )   2.11  0.32  0.32
assign ( resid   39 and name HB1  )   ( resid   40 and name HN   )   2.79  1.00  1.00
assign ( resid   40 and name HN   )   ( resid   40 and name HB1  )   2.59  0.80  0.80
assign ( resid   40 and name HN   )   ( resid   40 and name HB2  )   2.32  0.52  0.52
assign ( resid   41 and name HA   )   ( resid   42 and name HN   )   2.13  0.34  0.34
assign ( resid   41 and name HB2  )   ( resid   42 and name HN   )   2.54  0.74  0.74
assign ( resid   41 and name HB1  )   ( resid   42 and name HN   )   2.64  0.85  0.85
assign ( resid   42 and name HN   )   ( resid   42 and name HB   )   2.93  1.14  1.14
assign ( resid   42 and name HN   )   ( resid   43 and name HN   )   3.80  2.00  2.00
assign ( resid   42 and name HA   )   ( resid   43 and name HN   )   2.23  0.44  0.44
assign ( resid   42 and name HB   )   ( resid   43 and name HN   )   2.34  0.54  0.54
assign ( resid   43 and name HN   )   ( resid   43 and name HB1  )   2.44  0.64  0.64
assign ( resid   43 and name HN   )   ( resid   43 and name HB2  )   2.35  0.56  0.56
assign ( resid   43 and name HN   )   ( resid   44 and name HN   )   2.51  0.71  0.71
assign ( resid   43 and name HB1  )   ( resid   44 and name HN   )   2.54  0.74  0.74
assign ( resid   43 and name HB2  )   ( resid   44 and name HN   )   2.64  0.85  0.85
assign ( resid   44 and name HN   )   ( resid   44 and name HA   )   2.34  0.54  0.54
assign ( resid   44 and name HN   )   ( resid   45 and name HN   )   2.49  0.69  0.69
assign ( resid   45 and name HN   )   ( resid   45 and name HB1  )   2.71  0.91  0.91
assign ( resid   45 and name HN   )   ( resid   45 and name HB2  )   2.37  0.57  0.57
assign ( resid   45 and name HN   )   ( resid   46 and name HN   )   2.49  0.69  0.69
assign ( resid   45 and name HB1  )   ( resid   46 and name HN   )   2.66  0.86  0.86
assign ( resid   45 and name HB2  )   ( resid   46 and name HN   )   2.66  0.86  0.86
assign ( resid   46 and name HN   )   ( resid   46 and name HB1  )   2.62  0.83  0.83
assign ( resid   46 and name HN   )   ( resid   46 and name HB2  )   2.40  0.61  0.61
assign ( resid   46 and name HN   )   ( resid   47 and name HN   )   2.47  0.68  0.68
assign ( resid   46 and name HB1  )   ( resid   47 and name HN   )   2.76  0.97  0.97
assign ( resid   46 and name HB2  )   ( resid   47 and name HN   )   2.54  0.74  0.74
assign ( resid   47 and name HN   )   ( resid   47 and name HA   )   2.30  0.51  0.51
assign ( resid   47 and name HN   )   ( resid   47 and name HB*  )   2.79  1.00  1.00
assign ( resid   47 and name HN   )   ( resid   48 and name HN   )   2.28  0.49  0.49
assign ( resid   47 and name HB*  )   ( resid   48 and name HN   )   3.01  1.22  1.22
assign ( resid   48 and name HN   )   ( resid   48 and name HA   )   2.34  0.54  0.54
assign ( resid   48 and name HN   )   ( resid   48 and name HB   )   2.27  0.47  0.47
assign ( resid   48 and name HN   )   ( resid   49 and name HN   )   2.42  0.63  0.63
assign ( resid   48 and name HB   )   ( resid   49 and name HN   )   2.49  0.69  0.69
assign ( resid   49 and name HN   )   ( resid   50 and name HN   )   2.68  0.88  0.88
assign ( resid   49 and name HB*  )   ( resid   50 and name HN   )   2.96  1.17  1.17
assign ( resid   50 and name HN   )   ( resid   50 and name HB2  )   2.47  0.68  0.68
assign ( resid   50 and name HN   )   ( resid   50 and name HB1  )   2.47  0.68  0.68
assign ( resid   50 and name HN   )   ( resid   51 and name HN   )   2.49  0.69  0.69
assign ( resid   50 and name HB2  )   ( resid   51 and name HN   )   2.83  1.03  1.03
assign ( resid   50 and name HB1  )   ( resid   51 and name HN   )   2.83  1.03  1.03
assign ( resid   51 and name HN   )   ( resid   51 and name HB1  )   2.56  0.76  0.76
assign ( resid   51 and name HN   )   ( resid   51 and name HB2  )   2.35  0.56  0.56
assign ( resid   51 and name HN   )   ( resid   52 and name HN   )   2.49  0.69  0.69
assign ( resid   52 and name HN   )   ( resid   52 and name HA   )   2.35  0.56  0.56
assign ( resid   52 and name HN   )   ( resid   52 and name HB1  )   2.69  0.90  0.90
assign ( resid   52 and name HN   )   ( resid   52 and name HB2  )   2.42  0.63  0.63
assign ( resid   52 and name HN   )   ( resid   53 and name HN   )   2.37  0.57  0.57
assign ( resid   52 and name HA   )   ( resid   53 and name HN   )   2.68  0.88  0.88
assign ( resid   52 and name HB1  )   ( resid   53 and name HN   )   2.85  1.05  1.05
assign ( resid   52 and name HB2  )   ( resid   53 and name HN   )   2.56  0.76  0.76
assign ( resid   53 and name HN   )   ( resid   53 and name HB2  )   2.34  0.54  0.54
assign ( resid   53 and name HN   )   ( resid   53 and name HB1  )   2.23  0.44  0.44
assign ( resid   53 and name HN   )   ( resid   54 and name HN   )   2.39  0.59  0.59
assign ( resid   53 and name HB2  )   ( resid   54 and name HN   )   3.05  1.25  1.25
assign ( resid   53 and name HB1  )   ( resid   54 and name HN   )   2.57  0.78  0.78
assign ( resid   54 and name HN   )   ( resid   54 and name HB2  )   2.42  0.63  0.63
assign ( resid   54 and name HN   )   ( resid   54 and name HB1  )   2.59  0.80  0.80
assign ( resid   54 and name HN   )   ( resid   55 and name HN   )   2.32  0.52  0.52
assign ( resid   54 and name HB1  )   ( resid   55 and name HN   )   2.78  0.98  0.98
assign ( resid   55 and name HN   )   ( resid   55 and name HA   )   2.37  0.57  0.57
assign ( resid   55 and name HN   )   ( resid   55 and name HB2  )   2.44  0.64  0.64
assign ( resid   55 and name HN   )   ( resid   56 and name HN   )   2.27  0.47  0.47
assign ( resid   55 and name HB2  )   ( resid   56 and name HN   )   3.12  1.32  1.32
assign ( resid   55 and name HB1  )   ( resid   56 and name HN   )   2.81  1.02  1.02
assign ( resid   56 and name HN   )   ( resid   56 and name HB2  )   2.74  0.95  0.95
assign ( resid   56 and name HN   )   ( resid   56 and name HB1  )   2.74  0.95  0.95
assign ( resid   58 and name HA   )   ( resid   59 and name HN   )   2.10  0.30  0.30
assign ( resid   58 and name HB2  )   ( resid   59 and name HN   )   2.66  0.86  0.86
assign ( resid   58 and name HB1  )   ( resid   59 and name HN   )   2.66  0.86  0.86
assign ( resid   59 and name HN   )   ( resid   59 and name HB2  )   2.32  0.52  0.52
assign ( resid   59 and name HN   )   ( resid   59 and name HB1  )   2.32  0.52  0.52
assign ( resid   59 and name HN   )   ( resid   60 and name HN   )   3.61  1.82  1.82
assign ( resid   59 and name HB1  )   ( resid   60 and name HN   )   3.08  1.29  1.29
assign ( resid   60 and name HN   )   ( resid   60 and name HB2  )   2.66  0.86  0.86
assign ( resid    3 and name HN   )   ( resid    5 and name HN   )   3.25  1.46  1.46
assign ( resid    3 and name HA   )   ( resid    6 and name HN   )   2.71  0.91  0.91
assign ( resid    7 and name HA   )   ( resid    9 and name HN   )   3.53  1.73  1.73
assign ( resid    8 and name HA   )   ( resid   11 and name HN   )   3.13  1.34  1.34
assign ( resid   15 and name HN   )   ( resid   19 and name HN   )   3.64  1.85  1.85
assign ( resid   15 and name HN   )   ( resid   19 and name HB*  )   3.54  1.75  1.75
assign ( resid   17 and name HN   )   ( resid   20 and name HN   )   3.12  1.32  1.32
assign ( resid   18 and name HN   )   ( resid   20 and name HN   )   2.91  1.12  1.12
assign ( resid   18 and name HA   )   ( resid   20 and name HN   )   3.58  1.78  1.78
assign ( resid   23 and name HN   )   ( resid   32 and name HN   )   2.85  1.05  1.05
assign ( resid   25 and name HN   )   ( resid   29 and name HA   )   2.98  1.19  1.19
assign ( resid   23 and name HN   )   ( resid   30 and name HN   )   2.47  0.68  0.68
assign ( resid   24 and name HA   )   ( resid   29 and name HN   )   3.46  1.66  1.66
assign ( resid   21 and name HN   )   ( resid   33 and name HN   )   2.51  0.71  0.71
assign ( resid   19 and name HA   )   ( resid   35 and name HN   )   3.42  1.63  1.63
assign ( resid   34 and name HA   )   ( resid   36 and name HN   )   2.76  0.97  0.97
assign ( resid   36 and name HB1  )   ( resid   38 and name HN   )   2.59  0.80  0.80
assign ( resid   36 and name HB2  )   ( resid   38 and name HN   )   2.76  0.97  0.97
assign ( resid   42 and name HN   )   ( resid   45 and name HB2  )   2.28  0.49  0.49
assign ( resid   42 and name HN   )   ( resid   45 and name HB1  )   2.51  0.71  0.71
assign ( resid   42 and name HA   )   ( resid   44 and name HN   )   3.51  1.71  1.71
assign ( resid   42 and name HB   )   ( resid   44 and name HN   )   2.52  0.73  0.73
assign ( resid   42 and name HB   )   ( resid   45 and name HN   )   3.17  1.37  1.37
assign ( resid   43 and name HA   )   ( resid   46 and name HN   )   3.00  1.20  1.20
assign ( resid   45 and name HA   )   ( resid   48 and name HN   )   2.66  0.86  0.86
assign ( resid   46 and name HA   )   ( resid   49 and name HN   )   2.88  1.08  1.08
assign ( resid   47 and name HA   )   ( resid   50 and name HN   )   2.78  0.98  0.98
assign ( resid   48 and name HA   )   ( resid   51 and name HN   )   2.73  0.93  0.93
assign ( resid   48 and name HA   )   ( resid   52 and name HN   )   3.05  1.25  1.25
assign ( resid   49 and name HA   )   ( resid   52 and name HN   )   3.08  1.29  1.29
assign ( resid   50 and name HA   )   ( resid   53 and name HN   )   3.17  1.37  1.37
assign ( resid   52 and name HA   )   ( resid   55 and name HN   )   2.88  1.08  1.08
assign ( resid   20 and name HA   )   ( resid   35 and name HN   )   2.69  0.90  0.90
assign ( resid   24 and name HA   )   ( resid   30 and name HN   )   3.10  1.31  1.31
assign ( resid   43 and name HA   )   ( resid   47 and name HN   )   3.29  1.49  1.49
assign ( resid   17 and name HA   )   ( resid   20 and name HN   )   3.63  1.83  1.83
assign ( resid   16 and name HA   )   ( resid   20 and name HN   )   3.49  1.70  1.70
assign ( resid   42 and name HN   )   ( resid   45 and name HN   )   3.03  1.24  1.24
assign ( resid   42 and name HN   )   ( resid   46 and name HN   )   2.93  1.14  1.14
assign ( resid   51 and name HA   )   ( resid   54 and name HN   )   2.85  1.05  1.05
assign ( resid   52 and name HA   )   ( resid   56 and name HN   )   3.80  2.00  2.00
assign ( resid   11 and name HB1  )   ( resid   14 and name HN   )   2.64  0.85  0.85
assign ( resid    3 and name HN   )   ( resid   30 and name HA   )   2.79  1.00  1.00
assign ( resid    6 and name HA   )   ( resid    9 and name HN   )   2.86  1.07  1.07
assign ( resid    5 and name HA   )   ( resid    8 and name HN   )   2.73  0.93  0.93
assign ( resid    4 and name HA   )   ( resid    8 and name HN   )   3.39  1.59  1.59
assign ( resid    5 and name HA   )   ( resid    9 and name HN   )   3.20  1.41  1.41
assign ( resid   15 and name HB   )   ( resid   19 and name HN   )   2.95  1.15  1.15
assign ( resid    7 and name HA   )   ( resid   10 and name HN   )   3.42  1.63  1.63
assign ( resid   11 and name HB2  )   ( resid   14 and name HN   )   3.25  1.46  1.46
assign ( resid   16 and name HA   )   ( resid   18 and name HN   )   3.25  1.46  1.46
assign ( resid   12 and name HA   )   ( resid   14 and name HN   )   3.59  1.80  1.80
assign ( resid   21 and name HN   )   ( resid   34 and name HA   )   2.96  1.17  1.17
assign ( resid   22 and name HA   )   ( resid   33 and name HN   )   3.41  1.61  1.61
assign ( resid   51 and name HA   )   ( resid   53 and name HN   )   3.80  2.00  2.00
assign ( resid   52 and name HA   )   ( resid   54 and name HN   )   3.47  1.68  1.68
assign ( resid   50 and name HA   )   ( resid   52 and name HN   )   3.63  1.83  1.83
assign ( resid   53 and name HA   )   ( resid   56 and name HN   )   3.73  1.93  1.93
assign ( resid   51 and name HN   )   ( resid   53 and name HN   )   3.36  1.56  1.56
assign ( resid   50 and name HN   )   ( resid   52 and name HN   )   3.27  1.48  1.48
assign ( resid   49 and name HN   )   ( resid   51 and name HN   )   3.47  1.68  1.68
assign ( resid   53 and name HN   )   ( resid   55 and name HN   )   3.37  1.58  1.58
assign ( resid   44 and name HA   )   ( resid   47 and name HN   )   2.85  1.05  1.05
assign ( resid    3 and name HN   )   ( resid    3 and name HG   )   3.39  1.59  1.59
assign ( resid    3 and name HG   )   ( resid    4 and name HN   )   3.49  1.70  1.70
assign ( resid    4 and name HD*  )   ( resid    5 and name HN   )   4.86  3.07  3.07
assign ( resid    7 and name HN   )   ( resid    7 and name HG12 )   2.66  0.86  0.86
assign ( resid    7 and name HN   )   ( resid    7 and name HG11 )   2.47  0.68  0.68
assign ( resid    7 and name HG12 )   ( resid    8 and name HN   )   3.80  2.00  2.00
assign ( resid    7 and name HG11 )   ( resid    8 and name HN   )   2.98  1.19  1.19
assign ( resid    8 and name HN   )   ( resid    8 and name HG*  )   3.46  1.66  1.66
assign ( resid    9 and name HD*  )   ( resid   10 and name HN   )   4.86  3.07  3.07
assign ( resid   10 and name HN   )   ( resid   10 and name HD2  )   3.58  1.78  1.78
assign ( resid   10 and name HN   )   ( resid   10 and name HD1  )   3.58  1.78  1.78
assign ( resid   12 and name HG2  )   ( resid   13 and name HN   )   3.80  2.00  2.00
assign ( resid   12 and name HD2  )   ( resid   13 and name HN   )   3.00  1.20  1.20
assign ( resid   13 and name HN   )   ( resid   13 and name HD21 )   3.80  2.00  2.00
assign ( resid   13 and name HA   )   ( resid   13 and name HD21 )   3.80  2.00  2.00
assign ( resid   13 and name HB2  )   ( resid   13 and name HD21 )   2.30  0.51  0.51
assign ( resid   13 and name HB2  )   ( resid   13 and name HD22 )   2.68  0.88  0.88
assign ( resid   17 and name HN   )   ( resid   17 and name HG1  )   2.85  1.05  1.05
assign ( resid   17 and name HN   )   ( resid   17 and name HG2  )   3.05  1.25  1.25
assign ( resid   17 and name HG1  )   ( resid   18 and name HN   )   3.58  1.78  1.78
assign ( resid   17 and name HG2  )   ( resid   18 and name HN   )   3.58  1.78  1.78
assign ( resid   18 and name HN   )   ( resid   18 and name HG2  )   3.80  2.00  2.00
assign ( resid   18 and name HN   )   ( resid   18 and name HG1  )   3.80  2.00  2.00
assign ( resid   18 and name HD2  )   ( resid   19 and name HN   )   3.80  2.00  2.00
assign ( resid   18 and name HD1  )   ( resid   19 and name HN   )   3.80  2.00  2.00
assign ( resid   20 and name HD*  )   ( resid   21 and name HN   )   4.86  3.07  3.07
assign ( resid   21 and name HN   )   ( resid   21 and name HG*  )   4.03  2.24  2.24
assign ( resid   23 and name HN   )   ( resid   23 and name HG2  )   3.61  1.82  1.82
assign ( resid   23 and name HN   )   ( resid   23 and name HG1  )   3.61  1.82  1.82
assign ( resid   23 and name HG2  )   ( resid   24 and name HN   )   2.78  0.98  0.98
assign ( resid   23 and name HG1  )   ( resid   24 and name HN   )   2.78  0.98  0.98
assign ( resid   23 and name HD*  )   ( resid   24 and name HN   )   4.24  2.44  2.44
assign ( resid   24 and name HN   )   ( resid   24 and name HD22 )   3.80  2.00  2.00
assign ( resid   24 and name HB1  )   ( resid   24 and name HD22 )   2.74  0.95  0.95
assign ( resid   24 and name HB1  )   ( resid   24 and name HD21 )   2.37  0.57  0.57
assign ( resid   24 and name HB2  )   ( resid   24 and name HD21 )   2.61  0.81  0.81
assign ( resid   27 and name HB2  )   ( resid   27 and name HD21 )   2.62  0.83  0.83
assign ( resid   27 and name HB1  )   ( resid   27 and name HD21 )   2.62  0.83  0.83
assign ( resid   30 and name HN   )   ( resid   30 and name HE*  )   4.86  3.07  3.07
assign ( resid   31 and name HN   )   ( resid   31 and name HG12 )   2.88  1.08  1.08
assign ( resid   31 and name HN   )   ( resid   31 and name HG11 )   2.78  0.98  0.98
assign ( resid   31 and name HG11 )   ( resid   32 and name HN   )   3.59  1.80  1.80
assign ( resid   32 and name HG*  )   ( resid   33 and name HN   )   3.42  1.63  1.63
assign ( resid   33 and name HN   )   ( resid   33 and name HG1  )   3.80  2.00  2.00
assign ( resid   33 and name HN   )   ( resid   33 and name HD1  )   3.80  2.00  2.00
assign ( resid   33 and name HG2  )   ( resid   34 and name HN   )   3.80  2.00  2.00
assign ( resid   33 and name HD2  )   ( resid   34 and name HN   )   3.80  2.00  2.00
assign ( resid   33 and name HD1  )   ( resid   34 and name HN   )   3.80  2.00  2.00
assign ( resid   35 and name HB2  )   ( resid   35 and name HD21 )   2.51  0.71  0.71
assign ( resid   35 and name HB2  )   ( resid   35 and name HD22 )   2.93  1.14  1.14
assign ( resid   36 and name HN   )   ( resid   36 and name HG   )   2.54  0.74  0.74
assign ( resid   36 and name HG   )   ( resid   37 and name HN   )   3.54  1.75  1.75
assign ( resid   37 and name HN   )   ( resid   37 and name HG2  )   3.00  1.20  1.20
assign ( resid   37 and name HN   )   ( resid   37 and name HG1  )   3.00  1.20  1.20
assign ( resid   37 and name HG2  )   ( resid   38 and name HN   )   3.80  2.00  2.00
assign ( resid   37 and name HG1  )   ( resid   38 and name HN   )   3.80  2.00  2.00
assign ( resid   40 and name HN   )   ( resid   40 and name HG   )   2.96  1.17  1.17
assign ( resid   41 and name HD1  )   ( resid   42 and name HN   )   3.63  1.83  1.83
assign ( resid   43 and name HA   )   ( resid   43 and name HE21 )   3.80  2.00  2.00
assign ( resid   43 and name HB1  )   ( resid   43 and name HE21 )   3.80  2.00  2.00
assign ( resid   43 and name HA   )   ( resid   43 and name HE22 )   3.80  2.00  2.00
assign ( resid   43 and name HB1  )   ( resid   43 and name HE22 )   3.80  2.00  2.00
assign ( resid   43 and name HG2  )   ( resid   44 and name HN   )   3.64  1.85  1.85
assign ( resid   43 and name HG1  )   ( resid   44 and name HN   )   3.64  1.85  1.85
assign ( resid   45 and name HN   )   ( resid   45 and name HG2  )   3.02  1.22  1.22
assign ( resid   45 and name HN   )   ( resid   45 and name HG1  )   3.02  1.22  1.22
assign ( resid   45 and name HG2  )   ( resid   46 and name HN   )   3.80  2.00  2.00
assign ( resid   45 and name HG1  )   ( resid   46 and name HN   )   3.80  2.00  2.00
assign ( resid   46 and name HN   )   ( resid   46 and name HG   )   2.40  0.61  0.61
assign ( resid   46 and name HG   )   ( resid   47 and name HN   )   3.24  1.44  1.44
assign ( resid   47 and name HN   )   ( resid   47 and name HG2  )   2.78  0.98  0.98
assign ( resid   47 and name HN   )   ( resid   47 and name HG1  )   2.78  0.98  0.98
assign ( resid   51 and name HN   )   ( resid   51 and name HG1  )   2.88  1.08  1.08
assign ( resid   52 and name HN   )   ( resid   52 and name HG1  )   2.95  1.15  1.15
assign ( resid   52 and name HN   )   ( resid   52 and name HG2  )   2.69  0.90  0.90
assign ( resid   53 and name HN   )   ( resid   53 and name HG   )   3.10  1.31  1.31
assign ( resid   53 and name HG   )   ( resid   54 and name HN   )   3.46  1.66  1.66
assign ( resid   54 and name HN   )   ( resid   54 and name HG*  )   3.01  1.22  1.22
assign ( resid   55 and name HN   )   ( resid   55 and name HG2  )   3.17  1.37  1.37
assign ( resid   55 and name HN   )   ( resid   55 and name HG1  )   3.17  1.37  1.37
assign ( resid   56 and name HA   )   ( resid   56 and name HD21 )   3.80  2.00  2.00
assign ( resid   56 and name HB1  )   ( resid   56 and name HD21 )   2.57  0.78  0.78
assign ( resid   56 and name HB2  )   ( resid   56 and name HD22 )   2.83  1.03  1.03
assign ( resid   56 and name HB1  )   ( resid   56 and name HD22 )   2.83  1.03  1.03
assign ( resid   59 and name HD*  )   ( resid   60 and name HN   )   4.62  2.83  2.83
assign ( resid    6 and name HN   )   ( resid   50 and name HE3  )   3.20  1.41  1.41
assign ( resid   11 and name HN   )   ( resid   12 and name HD1  )   3.59  1.80  1.80
assign ( resid   11 and name HN   )   ( resid   12 and name HD2  )   3.80  2.00  2.00
assign ( resid   21 and name HN   )   ( resid   33 and name HB*  )   3.22  1.42  1.42
assign ( resid   23 and name HN   )   ( resid   32 and name HB*  )   3.80  2.00  2.00
assign ( resid   24 and name HA   )   ( resid   24 and name HD21 )   3.80  2.00  2.00
assign ( resid   22 and name HB1  )   ( resid   32 and name HN   )   3.80  2.00  2.00
assign ( resid   34 and name HE1  )   ( resid   40 and name HA   )   3.27  1.48  1.48
assign ( resid   34 and name HE1  )   ( resid   36 and name HB1  )   3.80  2.00  2.00
assign ( resid   34 and name HE1  )   ( resid   36 and name HB2  )   2.81  1.02  1.02
assign ( resid   19 and name HA   )   ( resid   35 and name HD21 )   3.17  1.37  1.37
assign ( resid   19 and name HA   )   ( resid   35 and name HD22 )   3.80  2.00  2.00
assign ( resid   33 and name HB*  )   ( resid   35 and name HD21 )   4.24  2.44  2.44
assign ( resid   33 and name HB*  )   ( resid   35 and name HD22 )   4.24  2.44  2.44
assign ( resid   38 and name HN   )   ( resid   39 and name HD2  )   3.80  2.00  2.00
assign ( resid   38 and name HN   )   ( resid   39 and name HD1  )   3.80  2.00  2.00
assign ( resid   34 and name HE1  )   ( resid   38 and name HN   )   3.30  1.51  1.51
assign ( resid   10 and name HE1  )   ( resid   49 and name HE1  )   3.80  2.00  2.00
assign ( resid   50 and name HD1  )   ( resid   51 and name HN   )   3.02  1.22  1.22
assign ( resid   53 and name HG   )   ( resid   54 and name HE22 )   3.80  2.00  2.00
assign ( resid   53 and name HG   )   ( resid   54 and name HE21 )   3.80  2.00  2.00
assign ( resid   56 and name HN   )   ( resid   57 and name HD*  )   3.36  1.56  1.56
assign ( resid   60 and name HN   )   ( resid   61 and name HD*  )   4.02  2.23  2.23
assign ( resid   24 and name HD22 )   ( resid   28 and name HN   )   3.80  2.00  2.00
assign ( resid   56 and name HD22 )   ( resid   57 and name HD*  )   4.14  2.34  2.34
assign ( resid   10 and name HE2  )   ( resid   49 and name HE1  )   3.80  2.00  2.00
assign ( resid   10 and name HD1  )   ( resid   49 and name HE1  )   3.80  2.00  2.00
assign ( resid   10 and name HD2  )   ( resid   49 and name HE1  )   3.80  2.00  2.00
assign ( resid   34 and name HE1  )   ( resid   40 and name HN   )   3.27  1.48  1.48
assign ( resid    3 and name HN   )   ( resid    3 and name HD1* )   4.10  2.31  2.31
assign ( resid    3 and name HN   )   ( resid    3 and name HD2* )   3.93  2.14  2.14
assign ( resid    3 and name HD1* )   ( resid    4 and name HN   )   4.31  2.51  2.51
assign ( resid    6 and name HN   )   ( resid    6 and name HB*  )   2.61  0.81  0.81
assign ( resid    6 and name HB*  )   ( resid    7 and name HN   )   2.90  1.10  1.10
assign ( resid    7 and name HN   )   ( resid    7 and name HG2* )   3.30  1.51  1.51
assign ( resid    7 and name HG2* )   ( resid    8 and name HN   )   3.34  1.54  1.54
assign ( resid    7 and name HD1* )   ( resid    8 and name HN   )   4.31  2.51  2.51
assign ( resid   15 and name HG2* )   ( resid   16 and name HN   )   3.59  1.80  1.80
assign ( resid   22 and name HN   )   ( resid   22 and name HD2* )   3.90  2.10  2.10
assign ( resid   22 and name HD2* )   ( resid   23 and name HN   )   3.71  1.92  1.92
assign ( resid   31 and name HN   )   ( resid   31 and name HD1* )   3.12  1.32  1.32
assign ( resid   31 and name HG2* )   ( resid   32 and name HN   )   3.42  1.63  1.63
assign ( resid   36 and name HN   )   ( resid   36 and name HD1* )   3.29  1.49  1.49
assign ( resid   36 and name HN   )   ( resid   36 and name HD2* )   3.78  1.98  1.98
assign ( resid   36 and name HD2* )   ( resid   37 and name HN   )   3.49  1.70  1.70
assign ( resid   42 and name HG2* )   ( resid   43 and name HN   )   3.12  1.32  1.32
assign ( resid   44 and name HB*  )   ( resid   45 and name HN   )   2.78  0.98  0.98
assign ( resid   46 and name HN   )   ( resid   46 and name HD1* )   3.51  1.71  1.71
assign ( resid   46 and name HN   )   ( resid   46 and name HD2* )   3.49  1.70  1.70
assign ( resid   46 and name HD1* )   ( resid   47 and name HN   )   3.80  2.00  2.00
assign ( resid   48 and name HN   )   ( resid   48 and name HG2* )   3.24  1.44  1.44
assign ( resid   53 and name HN   )   ( resid   53 and name HD1* )   3.90  2.10  2.10
assign ( resid   53 and name HN   )   ( resid   53 and name HD2* )   3.73  1.93  1.93
assign ( resid    4 and name HN   )   ( resid   22 and name HD1* )   3.64  1.85  1.85
assign ( resid    2 and name HG2* )   ( resid    4 and name HN   )   3.13  1.34  1.34
assign ( resid    2 and name HG2* )   ( resid    5 and name HN   )   2.86  1.07  1.07
assign ( resid    3 and name HD2* )   ( resid    6 and name HN   )   4.02  2.22  2.22
assign ( resid    6 and name HN   )   ( resid   53 and name HD2* )   3.80  2.00  2.00
assign ( resid    9 and name HN   )   ( resid   53 and name HD1* )   3.70  1.90  1.90
assign ( resid    7 and name HG2* )   ( resid   14 and name HN   )   4.31  2.51  2.51
assign ( resid   15 and name HG1* )   ( resid   17 and name HN   )   4.31  2.51  2.51
assign ( resid   15 and name HG1* )   ( resid   19 and name HN   )   3.54  1.75  1.75
assign ( resid   21 and name HN   )   ( resid   31 and name HG2* )   4.12  2.32  2.32
assign ( resid   21 and name HN   )   ( resid   22 and name HD2* )   4.31  2.51  2.51
assign ( resid   34 and name HE1  )   ( resid   38 and name HB*  )   3.30  1.51  1.51
assign ( resid   34 and name HE1  )   ( resid   40 and name HD1* )   4.02  2.22  2.22
assign ( resid   34 and name HN   )   ( resid   40 and name HD1* )   4.31  2.51  2.51
assign ( resid   36 and name HD1* )   ( resid   38 and name HN   )   4.31  2.51  2.51
assign ( resid    1 and name HE*  )   ( resid   43 and name HE21 )   3.46  1.66  1.66
assign ( resid   43 and name HE22 )   ( resid   46 and name HD1* )   4.26  2.46  2.46
assign ( resid   43 and name HN   )   ( resid   46 and name HD1* )   4.31  2.51  2.51
assign ( resid   43 and name HE21 )   ( resid   46 and name HD1* )   4.26  2.46  2.46
assign ( resid    6 and name HB*  )   ( resid   50 and name HN   )   3.25  1.46  1.46
assign ( resid   48 and name HG2* )   ( resid   49 and name HE1  )   3.47  1.68  1.68
assign ( resid   53 and name HD2* )   ( resid   54 and name HE22 )   3.83  2.04  2.04
assign ( resid   11 and name HN   )   ( resid   14 and name HB*  )   4.31  2.51  2.51
assign ( resid   22 and name HD2* )   ( resid   31 and name HN   )   4.12  2.33  2.33
assign ( resid    3 and name HA   )   ( resid    3 and name HB2  )   2.37  0.57  0.57
assign ( resid    5 and name HA   )   ( resid    5 and name HB1  )   2.30  0.51  0.51
assign ( resid    4 and name HA   )   ( resid    7 and name HB   )   3.47  1.68  1.68
assign ( resid   13 and name HA   )   ( resid   13 and name HB2  )   2.40  0.61  0.61
assign ( resid   13 and name HA   )   ( resid   13 and name HB1  )   2.32  0.52  0.52
assign ( resid   13 and name HB1  )   ( resid   14 and name HN   )   3.24  1.44  1.44
assign ( resid   14 and name HA   )   ( resid   15 and name HN   )   2.23  0.44  0.44
assign ( resid   16 and name HN   )   ( resid   16 and name HB1  )   2.74  0.95  0.95
assign ( resid   18 and name HB2  )   ( resid   19 and name HN   )   2.81  1.02  1.02
assign ( resid   24 and name HA   )   ( resid   24 and name HB2  )   2.40  0.61  0.61
assign ( resid   31 and name HB   )   ( resid   32 and name HN   )   3.12  1.32  1.32
assign ( resid   34 and name HA   )   ( resid   34 and name HB2  )   2.34  0.54  0.54
assign ( resid   37 and name HA   )   ( resid   37 and name HB1  )   2.40  0.61  0.61
assign ( resid   39 and name HB2  )   ( resid   40 and name HN   )   2.76  0.97  0.97
assign ( resid   42 and name HA   )   ( resid   42 and name HB   )   2.28  0.49  0.49
assign ( resid   43 and name HA   )   ( resid   43 and name HB2  )   2.27  0.47  0.47
assign ( resid   43 and name HA   )   ( resid   46 and name HB1  )   3.12  1.32  1.32
assign ( resid   44 and name HA   )   ( resid   47 and name HB*  )   3.22  1.42  1.42
assign ( resid   45 and name HA   )   ( resid   45 and name HB1  )   2.40  0.61  0.61
assign ( resid   43 and name HA   )   ( resid   46 and name HB2  )   2.69  0.90  0.90
assign ( resid   47 and name HA   )   ( resid   50 and name HB1  )   2.83  1.03  1.03
assign ( resid   45 and name HA   )   ( resid   48 and name HB   )   2.66  0.86  0.86
assign ( resid   46 and name HA   )   ( resid   49 and name HB*  )   3.98  2.19  2.19
assign ( resid   47 and name HA   )   ( resid   50 and name HB2  )   2.83  1.03  1.03
assign ( resid   51 and name HA   )   ( resid   51 and name HB1  )   2.37  0.57  0.57
assign ( resid   48 and name HA   )   ( resid   51 and name HB1  )   2.76  0.97  0.97
assign ( resid   51 and name HB1  )   ( resid   52 and name HN   )   2.71  0.91  0.91
assign ( resid   48 and name HA   )   ( resid   51 and name HB2  )   2.61  0.81  0.81
assign ( resid   51 and name HB2  )   ( resid   52 and name HN   )   2.88  1.08  1.08
assign ( resid   49 and name HA   )   ( resid   52 and name HB1  )   3.10  1.31  1.31
assign ( resid   49 and name HA   )   ( resid   52 and name HB2  )   2.81  1.02  1.02
assign ( resid   50 and name HA   )   ( resid   53 and name HB2  )   3.75  1.95  1.95
assign ( resid   50 and name HA   )   ( resid   53 and name HB1  )   2.79  1.00  1.00
assign ( resid   54 and name HA   )   ( resid   54 and name HB2  )   2.39  0.59  0.59
assign ( resid   54 and name HA   )   ( resid   54 and name HB1  )   2.35  0.56  0.56
assign ( resid   54 and name HB2  )   ( resid   55 and name HN   )   2.79  1.00  1.00
assign ( resid   55 and name HA   )   ( resid   55 and name HB2  )   2.37  0.57  0.57
assign ( resid   55 and name HA   )   ( resid   56 and name HN   )   2.49  0.69  0.69
assign ( resid   55 and name HN   )   ( resid   55 and name HB1  )   2.73  0.93  0.93
assign ( resid   59 and name HA   )   ( resid   60 and name HN   )   2.13  0.34  0.34
assign ( resid   59 and name HB2  )   ( resid   60 and name HN   )   3.08  1.29  1.29
assign ( resid   60 and name HN   )   ( resid   60 and name HB1  )   2.66  0.86  0.86
assign ( resid    2 and name HA   )   ( resid    5 and name HN   )   3.54  1.75  1.75
assign ( resid   22 and name HA   )   ( resid   32 and name HN   )   2.62  0.83  0.83
assign ( resid   22 and name HA   )   ( resid   31 and name HA   )   2.61  0.81  0.81
assign ( resid   31 and name HA   )   ( resid   33 and name HN   )   2.95  1.15  1.15
assign ( resid   51 and name HA   )   ( resid   55 and name HN   )   2.91  1.12  1.12
assign ( resid   24 and name HA   )   ( resid   29 and name HA   )   2.78  0.98  0.98
assign ( resid   16 and name HA   )   ( resid   17 and name HA   )   3.58  1.78  1.78
assign ( resid   51 and name HA   )   ( resid   54 and name HB2  )   2.81  1.02  1.02
assign ( resid   51 and name HA   )   ( resid   54 and name HB1  )   3.13  1.34  1.34
assign ( resid   52 and name HA   )   ( resid   55 and name HB1  )   3.53  1.73  1.73
assign ( resid    5 and name HA   )   ( resid    8 and name HB*  )   2.98  1.18  1.18
assign ( resid    6 and name HA   )   ( resid    9 and name HB*  )   3.49  1.69  1.69
assign ( resid    7 and name HA   )   ( resid   10 and name HB1  )   2.95  1.15  1.15
assign ( resid    4 and name HA   )   ( resid    7 and name HN   )   3.80  2.00  2.00
assign ( resid   20 and name HA   )   ( resid   34 and name HA   )   2.61  0.81  0.81
assign ( resid   23 and name HN   )   ( resid   31 and name HA   )   3.02  1.22  1.22
assign ( resid   52 and name HA   )   ( resid   55 and name HB2  )   3.80  2.00  2.00
assign ( resid    7 and name HA   )   ( resid    7 and name HG12 )   2.73  0.93  0.93
assign ( resid   10 and name HA   )   ( resid   10 and name HD2  )   3.59  1.80  1.80
assign ( resid   10 and name HB1  )   ( resid   10 and name HD2  )   2.74  0.95  0.95
assign ( resid   10 and name HB1  )   ( resid   10 and name HD1  )   2.74  0.95  0.95
assign ( resid   17 and name HA   )   ( resid   17 and name HG1  )   2.90  1.10  1.10
assign ( resid   17 and name HA   )   ( resid   17 and name HG2  )   2.62  0.83  0.83
assign ( resid   17 and name HB2  )   ( resid   17 and name HG1  )   2.22  0.42  0.42
assign ( resid   17 and name HB1  )   ( resid   17 and name HG2  )   2.22  0.42  0.42
assign ( resid   17 and name HN   )   ( resid   17 and name HD*  )   4.14  2.34  2.34
assign ( resid   18 and name HA   )   ( resid   18 and name HD2  )   3.46  1.66  1.66
assign ( resid   18 and name HA   )   ( resid   18 and name HD1  )   3.46  1.66  1.66
assign ( resid   18 and name HA   )   ( resid   18 and name HG2  )   2.86  1.07  1.07
assign ( resid   18 and name HG2  )   ( resid   19 and name HN   )   3.80  2.00  2.00
assign ( resid   18 and name HA   )   ( resid   18 and name HG1  )   2.86  1.07  1.07
assign ( resid   18 and name HG1  )   ( resid   19 and name HN   )   3.80  2.00  2.00
assign ( resid   18 and name HB1  )   ( resid   18 and name HE*  )   4.24  2.44  2.44
assign ( resid   18 and name HB2  )   ( resid   18 and name HE*  )   4.24  2.44  2.44
assign ( resid   21 and name HG*  )   ( resid   22 and name HN   )   3.37  1.58  1.58
assign ( resid   22 and name HN   )   ( resid   22 and name HG   )   2.76  0.97  0.97
assign ( resid   23 and name HA   )   ( resid   23 and name HD*  )   3.37  1.58  1.58
assign ( resid   27 and name HA   )   ( resid   27 and name HD21 )   3.80  2.00  2.00
assign ( resid   31 and name HA   )   ( resid   31 and name HG12 )   2.62  0.83  0.83
assign ( resid   32 and name HN   )   ( resid   32 and name HG*  )   3.78  1.98  1.98
assign ( resid   33 and name HN   )   ( resid   33 and name HG2  )   3.80  2.00  2.00
assign ( resid   33 and name HG2  )   ( resid   33 and name HD2  )   2.34  0.54  0.54
assign ( resid   33 and name HG2  )   ( resid   33 and name HD1  )   2.34  0.54  0.54
assign ( resid   33 and name HG2  )   ( resid   33 and name HE2  )   2.95  1.15  1.15
assign ( resid   33 and name HG1  )   ( resid   33 and name HD2  )   2.34  0.54  0.54
assign ( resid   33 and name HN   )   ( resid   33 and name HD2  )   3.80  2.00  2.00
assign ( resid   33 and name HG1  )   ( resid   33 and name HD1  )   2.34  0.54  0.54
assign ( resid   33 and name HG1  )   ( resid   33 and name HE2  )   2.95  1.15  1.15
assign ( resid   33 and name HG2  )   ( resid   33 and name HE1  )   2.95  1.15  1.15
assign ( resid   33 and name HG1  )   ( resid   33 and name HE1  )   2.95  1.15  1.15
assign ( resid   34 and name HA   )   ( resid   34 and name HD1  )   3.17  1.37  1.37
assign ( resid   36 and name HA   )   ( resid   36 and name HG   )   2.69  0.90  0.90
assign ( resid   36 and name HB1  )   ( resid   36 and name HG   )   2.37  0.57  0.57
assign ( resid   37 and name HA   )   ( resid   37 and name HG1  )   2.62  0.83  0.83
assign ( resid   37 and name HA   )   ( resid   37 and name HG2  )   2.62  0.83  0.83
assign ( resid   37 and name HA   )   ( resid   37 and name HD*  )   3.69  1.90  1.90
assign ( resid   38 and name HA   )   ( resid   39 and name HD2  )   2.22  0.42  0.42
assign ( resid   38 and name HA   )   ( resid   39 and name HD1  )   2.22  0.42  0.42
assign ( resid   40 and name HA   )   ( resid   41 and name HD2  )   2.73  0.93  0.93
assign ( resid   40 and name HA   )   ( resid   41 and name HD1  )   2.42  0.63  0.63
assign ( resid   43 and name HN   )   ( resid   43 and name HG2  )   3.32  1.53  1.53
assign ( resid   43 and name HN   )   ( resid   43 and name HG1  )   3.32  1.53  1.53
assign ( resid   45 and name HA   )   ( resid   45 and name HG2  )   2.42  0.63  0.63
assign ( resid   45 and name HA   )   ( resid   45 and name HG1  )   2.42  0.63  0.63
assign ( resid   47 and name HA   )   ( resid   47 and name HG2  )   2.39  0.59  0.59
assign ( resid   47 and name HG2  )   ( resid   48 and name HN   )   3.80  2.00  2.00
assign ( resid   47 and name HA   )   ( resid   47 and name HG1  )   2.39  0.59  0.59
assign ( resid   47 and name HG1  )   ( resid   48 and name HN   )   3.80  2.00  2.00
assign ( resid   51 and name HN   )   ( resid   51 and name HG2  )   2.85  1.05  1.05
assign ( resid   51 and name HA   )   ( resid   51 and name HG2  )   2.28  0.49  0.49
assign ( resid   51 and name HB1  )   ( resid   51 and name HG2  )   2.25  0.46  0.46
assign ( resid   51 and name HG2  )   ( resid   52 and name HN   )   3.51  1.71  1.71
assign ( resid   51 and name HA   )   ( resid   51 and name HG1  )   2.54  0.74  0.74
assign ( resid   51 and name HB2  )   ( resid   51 and name HG1  )   2.25  0.46  0.46
assign ( resid   51 and name HG1  )   ( resid   52 and name HN   )   3.80  2.00  2.00
assign ( resid   52 and name HA   )   ( resid   52 and name HG1  )   2.37  0.57  0.57
assign ( resid   52 and name HB2  )   ( resid   52 and name HG1  )   2.17  0.37  0.37
assign ( resid   52 and name HA   )   ( resid   52 and name HG2  )   2.61  0.81  0.81
assign ( resid   52 and name HB1  )   ( resid   52 and name HG2  )   2.18  0.39  0.39
assign ( resid   52 and name HG2  )   ( resid   53 and name HN   )   3.80  2.00  2.00
assign ( resid   53 and name HA   )   ( resid   53 and name HG   )   3.02  1.22  1.22
assign ( resid   54 and name HA   )   ( resid   54 and name HE22 )   3.59  1.80  1.80
assign ( resid   54 and name HG*  )   ( resid   55 and name HN   )   3.54  1.75  1.75
assign ( resid   55 and name HA   )   ( resid   55 and name HG2  )   2.32  0.52  0.52
assign ( resid   55 and name HB1  )   ( resid   55 and name HG2  )   2.25  0.46  0.46
assign ( resid   55 and name HA   )   ( resid   55 and name HG1  )   2.42  0.63  0.63
assign ( resid   55 and name HB2  )   ( resid   55 and name HG1  )   2.25  0.46  0.46
assign ( resid   55 and name HA   )   ( resid   55 and name HD2  )   3.17  1.37  1.37
assign ( resid   55 and name HA   )   ( resid   55 and name HD1  )   3.17  1.37  1.37
assign ( resid   55 and name HA   )   ( resid   55 and name HE*  )   4.24  2.44  2.44
assign ( resid   55 and name HB2  )   ( resid   55 and name HE*  )   4.24  2.44  2.44
assign ( resid   55 and name HB1  )   ( resid   55 and name HE*  )   4.24  2.44  2.44
assign ( resid   56 and name HB2  )   ( resid   56 and name HD21 )   2.57  0.78  0.78
assign ( resid   57 and name HA   )   ( resid   58 and name HD2  )   2.51  0.71  0.71
assign ( resid   57 and name HA   )   ( resid   58 and name HD1  )   2.51  0.71  0.71
assign ( resid   60 and name HN   )   ( resid   60 and name HG*  )   3.18  1.39  1.39
assign ( resid   60 and name HA   )   ( resid   60 and name HG*  )   2.86  1.07  1.07
assign ( resid    2 and name HB   )   ( resid   50 and name HH2  )   3.03  1.24  1.24
assign ( resid   12 and name HG1  )   ( resid   13 and name HN   )   3.80  2.00  2.00
assign ( resid   17 and name HA   )   ( resid   21 and name HG*  )   3.42  1.63  1.63
assign ( resid   17 and name HD*  )   ( resid   21 and name HG*  )   4.68  2.88  2.88
assign ( resid   23 and name HB*  )   ( resid   32 and name HB*  )   4.63  2.83  2.83
assign ( resid   23 and name HD*  )   ( resid   32 and name HB*  )   3.96  2.17  2.17
assign ( resid   23 and name HB*  )   ( resid   32 and name HG*  )   4.37  2.58  2.58
assign ( resid   22 and name HB1  )   ( resid   32 and name HB*  )   4.24  2.44  2.44
assign ( resid   19 and name HA   )   ( resid   35 and name HB2  )   2.59  0.80  0.80
assign ( resid   19 and name HA   )   ( resid   35 and name HB1  )   3.03  1.24  1.24
assign ( resid   19 and name HB*  )   ( resid   36 and name HG   )   3.30  1.51  1.51
assign ( resid   45 and name HB1  )   ( resid   49 and name HZ2  )   3.46  1.66  1.66
assign ( resid   48 and name HA   )   ( resid   51 and name HG2  )   3.80  2.00  2.00
assign ( resid   48 and name HA   )   ( resid   51 and name HG1  )   3.80  2.00  2.00
assign ( resid   60 and name HG*  )   ( resid   61 and name HD*  )   4.56  2.77  2.77
assign ( resid   60 and name HB2  )   ( resid   61 and name HD*  )   3.60  1.80  1.80
assign ( resid   16 and name HB2  )   ( resid   20 and name HZ   )   3.80  2.00  2.00
assign ( resid   10 and name HA   )   ( resid   10 and name HD1  )   3.59  1.80  1.80
assign ( resid   23 and name HD*  )   ( resid   32 and name HG*  )   4.68  2.88  2.88
assign ( resid   33 and name HG1  )   ( resid   34 and name HN   )   3.80  2.00  2.00
assign ( resid   37 and name HN   )   ( resid   37 and name HD*  )   4.03  2.24  2.24
assign ( resid   40 and name HB2  )   ( resid   41 and name HD2  )   3.32  1.53  1.53
assign ( resid   34 and name HD1  )   ( resid   40 and name HG   )   3.80  2.00  2.00
assign ( resid   51 and name HA   )   ( resid   54 and name HG*  )   3.59  1.80  1.80
assign ( resid   56 and name HB2  )   ( resid   57 and name HD*  )   4.02  2.23  2.23
assign ( resid   56 and name HB1  )   ( resid   57 and name HD*  )   4.02  2.23  2.23
assign ( resid   44 and name HA   )   ( resid   47 and name HG2  )   3.80  2.00  2.00
assign ( resid   44 and name HA   )   ( resid   47 and name HG1  )   3.80  2.00  2.00
assign ( resid    7 and name HG11 )   ( resid   31 and name HG12 )   3.80  2.00  2.00
assign ( resid    7 and name HG12 )   ( resid   31 and name HG12 )   3.80  2.00  2.00
assign ( resid   20 and name HB2  )   ( resid   34 and name HA   )   3.80  2.00  2.00
assign ( resid   20 and name HB1  )   ( resid   34 and name HA   )   3.80  2.00  2.00
assign ( resid   57 and name HB2  )   ( resid   58 and name HD1  )   3.41  1.61  1.61
assign ( resid   57 and name HB2  )   ( resid   58 and name HD2  )   3.41  1.61  1.61
assign ( resid   57 and name HB1  )   ( resid   58 and name HD1  )   3.41  1.61  1.61
assign ( resid   57 and name HB1  )   ( resid   58 and name HD2  )   3.41  1.61  1.61
assign ( resid   60 and name HB1  )   ( resid   61 and name HD*  )   3.60  1.80  1.80
assign ( resid   61 and name HA   )   ( resid   62 and name HD2  )   2.54  0.74  0.74
assign ( resid   61 and name HA   )   ( resid   62 and name HD1  )   2.54  0.74  0.74
assign ( resid   49 and name HA   )   ( resid   52 and name HG1  )   3.80  2.00  2.00
assign ( resid   49 and name HA   )   ( resid   52 and name HG2  )   3.80  2.00  2.00
assign ( resid   34 and name HB1  )   ( resid   34 and name HD1  )   2.47  0.68  0.68
assign ( resid    4 and name HD*  )   ( resid    5 and name HA   )   4.20  2.40  2.40
assign ( resid    4 and name HD*  )   ( resid    8 and name HB*  )   5.30  3.51  3.51
assign ( resid    4 and name HE*  )   ( resid   16 and name HB1  )   4.15  2.36  2.36
assign ( resid    4 and name HE*  )   ( resid   16 and name HB2  )   4.15  2.36  2.36
assign ( resid    4 and name HE*  )   ( resid    8 and name HG*  )   5.24  3.44  3.44
assign ( resid    4 and name HE*  )   ( resid    8 and name HB*  )   5.03  3.24  3.24
assign ( resid    9 and name HD*  )   ( resid   49 and name HB*  )   5.01  3.22  3.22
assign ( resid   10 and name HB1  )   ( resid   11 and name HD*  )   4.86  3.07  3.07
assign ( resid   10 and name HB1  )   ( resid   11 and name HE*  )   4.86  3.07  3.07
assign ( resid   19 and name HB*  )   ( resid   20 and name HD*  )   5.30  3.51  3.51
assign ( resid   20 and name HD*  )   ( resid   22 and name HG   )   4.86  3.07  3.07
assign ( resid   16 and name HA   )   ( resid   20 and name HE*  )   4.86  3.07  3.07
assign ( resid   20 and name HE*  )   ( resid   22 and name HG   )   4.83  3.03  3.03
assign ( resid   20 and name HE*  )   ( resid   36 and name HB2  )   4.86  3.07  3.07
assign ( resid   16 and name HB1  )   ( resid   20 and name HZ   )   3.80  2.00  2.00
assign ( resid   25 and name HN   )   ( resid   30 and name HE*  )   4.34  2.54  2.54
assign ( resid   29 and name HA   )   ( resid   30 and name HD*  )   4.86  3.07  3.07
assign ( resid   30 and name HD*  )   ( resid   32 and name HA   )   4.86  3.07  3.07
assign ( resid   30 and name HE*  )   ( resid   32 and name HA   )   4.18  2.39  2.39
assign ( resid   23 and name HD*  )   ( resid   30 and name HE*  )   5.31  3.51  3.51
assign ( resid   25 and name HB1  )   ( resid   30 and name HE*  )   4.86  3.07  3.07
assign ( resid   30 and name HE*  )   ( resid   32 and name HG*  )   5.31  3.51  3.51
assign ( resid   30 and name HE*  )   ( resid   32 and name HB*  )   5.30  3.51  3.51
assign ( resid   23 and name HB*  )   ( resid   30 and name HE*  )   5.30  3.51  3.51
assign ( resid   30 and name HD*  )   ( resid   32 and name HB*  )   5.30  3.51  3.51
assign ( resid   23 and name HB*  )   ( resid   30 and name HD*  )   5.30  3.51  3.51
assign ( resid   34 and name HA   )   ( resid   34 and name HE3  )   3.80  2.00  2.00
assign ( resid   20 and name HB1  )   ( resid   34 and name HE3  )   3.71  1.92  1.92
assign ( resid    7 and name HG12 )   ( resid   34 and name HZ3  )   3.80  2.00  2.00
assign ( resid   50 and name HA   )   ( resid   50 and name HE3  )   2.56  0.76  0.76
assign ( resid    5 and name HB2  )   ( resid   50 and name HZ3  )   3.63  1.83  1.83
assign ( resid    5 and name HB1  )   ( resid   50 and name HZ3  )   3.56  1.76  1.76
assign ( resid    2 and name HB   )   ( resid   50 and name HZ3  )   3.61  1.82  1.82
assign ( resid   46 and name HA   )   ( resid   49 and name HE3  )   3.64  1.85  1.85
assign ( resid   11 and name HE*  )   ( resid   49 and name HH2  )   4.35  2.56  2.56
assign ( resid   41 and name HB1  )   ( resid   49 and name HZ2  )   3.30  1.51  1.51
assign ( resid   41 and name HB1  )   ( resid   49 and name HH2  )   3.19  1.39  1.39
assign ( resid   41 and name HG1  )   ( resid   49 and name HH2  )   3.78  1.99  1.99
assign ( resid   41 and name HG2  )   ( resid   49 and name HH2  )   3.78  1.99  1.99
assign ( resid   59 and name HD*  )   ( resid   61 and name HD*  )   5.19  3.39  3.39
assign ( resid   59 and name HE*  )   ( resid   61 and name HA   )   4.86  3.07  3.07
assign ( resid   59 and name HE*  )   ( resid   61 and name HD*  )   5.31  3.51  3.51
assign ( resid   49 and name HN   )   ( resid   49 and name HD1  )   3.03  1.24  1.24
assign ( resid   49 and name HA   )   ( resid   49 and name HD1  )   2.51  0.71  0.71
assign ( resid    4 and name HE*  )   ( resid   16 and name HN   )   4.69  2.90  2.90
assign ( resid   23 and name HN   )   ( resid   30 and name HD*  )   4.86  3.07  3.07
assign ( resid   30 and name HD*  )   ( resid   31 and name HN   )   4.18  2.39  2.39
assign ( resid   24 and name HA   )   ( resid   30 and name HD*  )   4.86  3.07  3.07
assign ( resid   25 and name HB2  )   ( resid   30 and name HE*  )   4.86  3.07  3.07
assign ( resid   20 and name HB2  )   ( resid   34 and name HE3  )   3.71  1.92  1.92
assign ( resid   34 and name HD1  )   ( resid   40 and name HN   )   3.80  2.00  2.00
assign ( resid    9 and name HD*  )   ( resid   53 and name HA   )   4.86  3.07  3.07
assign ( resid   11 and name HE*  )   ( resid   49 and name HZ2  )   4.86  3.07  3.07
assign ( resid    2 and name HG2* )   ( resid    2 and name HG11 )   2.78  0.98  0.98
assign ( resid    2 and name HG2* )   ( resid    3 and name HN   )   3.18  1.39  1.39
assign ( resid    2 and name HG2* )   ( resid    2 and name HG12 )   2.78  0.98  0.98
assign ( resid    2 and name HA   )   ( resid    2 and name HD1* )   2.95  1.15  1.15
assign ( resid    2 and name HB   )   ( resid    2 and name HD1* )   2.79  1.00  1.00
assign ( resid    2 and name HD1* )   ( resid    3 and name HN   )   4.05  2.26  2.26
assign ( resid    3 and name HA   )   ( resid    3 and name HD2* )   3.90  2.10  2.10
assign ( resid    3 and name HA   )   ( resid    3 and name HD1* )   2.61  0.81  0.81
assign ( resid    3 and name HD2* )   ( resid    4 and name HN   )   4.31  2.51  2.51
assign ( resid    3 and name HA   )   ( resid    6 and name HB*  )   3.29  1.49  1.49
assign ( resid    7 and name HN   )   ( resid    7 and name HD1* )   3.13  1.34  1.34
assign ( resid    7 and name HB   )   ( resid    7 and name HD1* )   2.61  0.81  0.81
assign ( resid   14 and name HN   )   ( resid   14 and name HB*  )   2.61  0.81  0.81
assign ( resid   15 and name HG1* )   ( resid   16 and name HN   )   3.05  1.25  1.25
assign ( resid   15 and name HN   )   ( resid   15 and name HG2* )   2.71  0.91  0.91
assign ( resid   22 and name HA   )   ( resid   22 and name HD2* )   2.93  1.14  1.14
assign ( resid   22 and name HA   )   ( resid   22 and name HD1* )   3.22  1.42  1.42
assign ( resid   31 and name HD1* )   ( resid   32 and name HN   )   4.10  2.31  2.31
assign ( resid   36 and name HA   )   ( resid   36 and name HD1* )   4.02  2.22  2.22
assign ( resid   36 and name HA   )   ( resid   36 and name HD2* )   2.74  0.95  0.95
assign ( resid   40 and name HN   )   ( resid   40 and name HD1* )   3.88  2.09  2.09
assign ( resid   40 and name HA   )   ( resid   40 and name HD1* )   3.00  1.20  1.20
assign ( resid   40 and name HN   )   ( resid   40 and name HD2* )   3.90  2.10  2.10
assign ( resid   40 and name HA   )   ( resid   40 and name HD2* )   3.86  2.07  2.07
assign ( resid   42 and name HN   )   ( resid   42 and name HG2* )   2.64  0.85  0.85
assign ( resid   42 and name HA   )   ( resid   42 and name HG2* )   2.61  0.81  0.81
assign ( resid   44 and name HN   )   ( resid   44 and name HB*  )   2.61  0.81  0.81
assign ( resid   46 and name HA   )   ( resid   46 and name HD1* )   3.81  2.02  2.02
assign ( resid   46 and name HA   )   ( resid   46 and name HD2* )   2.74  0.95  0.95
assign ( resid   46 and name HD2* )   ( resid   47 and name HN   )   4.12  2.32  2.32
assign ( resid   48 and name HG2* )   ( resid   49 and name HN   )   3.39  1.59  1.59
assign ( resid   53 and name HA   )   ( resid   53 and name HD2* )   3.34  1.54  1.54
assign ( resid   53 and name HA   )   ( resid   53 and name HD1* )   2.91  1.12  1.12
assign ( resid   53 and name HD1* )   ( resid   54 and name HN   )   4.31  2.51  2.51
assign ( resid   53 and name HD2* )   ( resid   54 and name HN   )   4.09  2.29  2.29
assign ( resid    2 and name HD1* )   ( resid   50 and name HZ2  )   3.70  1.90  1.90
assign ( resid    2 and name HD1* )   ( resid   50 and name HH2  )   2.88  1.08  1.08
assign ( resid    6 and name HA   )   ( resid   53 and name HD2* )   4.00  2.21  2.21
assign ( resid    6 and name HB*  )   ( resid   53 and name HD2* )   4.82  3.02  3.02
assign ( resid    7 and name HG2* )   ( resid   11 and name HB2  )   4.31  2.51  2.51
assign ( resid    4 and name HA   )   ( resid    7 and name HD1* )   3.36  1.56  1.56
assign ( resid    7 and name HG2* )   ( resid    8 and name HA   )   4.31  2.51  2.51
assign ( resid    7 and name HD1* )   ( resid   34 and name HE3  )   4.31  2.51  2.51
assign ( resid    7 and name HD1* )   ( resid   20 and name HE*  )   5.37  3.58  3.58
assign ( resid    7 and name HD1* )   ( resid   34 and name HZ3  )   3.08  1.29  1.29
assign ( resid    7 and name HD1* )   ( resid   20 and name HD*  )   5.12  3.32  3.32
assign ( resid    7 and name HG2* )   ( resid   11 and name HD*  )   4.62  2.83  2.83
assign ( resid    7 and name HG2* )   ( resid   34 and name HH2  )   3.46  1.66  1.66
assign ( resid    7 and name HG2* )   ( resid   20 and name HD*  )   5.34  3.54  3.54
assign ( resid    7 and name HG2* )   ( resid   34 and name HZ3  )   3.10  1.30  1.30
assign ( resid   11 and name HD*  )   ( resid   36 and name HD2* )   5.01  3.22  3.22
assign ( resid   13 and name HN   )   ( resid   14 and name HB*  )   3.83  2.04  2.04
assign ( resid   14 and name HB*  )   ( resid   20 and name HE*  )   4.11  2.32  2.32
assign ( resid   14 and name HB*  )   ( resid   20 and name HD*  )   4.81  3.02  3.02
assign ( resid   14 and name HB*  )   ( resid   19 and name HB*  )   3.71  1.92  1.92
assign ( resid   11 and name HB2  )   ( resid   14 and name HB*  )   3.05  1.25  1.25
assign ( resid   11 and name HB1  )   ( resid   14 and name HB*  )   3.00  1.20  1.20
assign ( resid   15 and name HG1* )   ( resid   18 and name HN   )   3.12  1.32  1.32
assign ( resid   14 and name HB*  )   ( resid   15 and name HG2* )   4.82  3.02  3.02
assign ( resid   14 and name HB*  )   ( resid   36 and name HD1* )   3.93  2.14  2.14
assign ( resid   15 and name HG1* )   ( resid   18 and name HE*  )   4.60  2.80  2.80
assign ( resid   15 and name HG1* )   ( resid   19 and name HB*  )   4.75  2.95  2.95
assign ( resid   15 and name HG1* )   ( resid   18 and name HA   )   4.31  2.51  2.51
assign ( resid   15 and name HG1* )   ( resid   18 and name HB1  )   3.93  2.14  2.14
assign ( resid   15 and name HG1* )   ( resid   18 and name HB2  )   3.93  2.14  2.14
assign ( resid   22 and name HD2* )   ( resid   32 and name HN   )   3.42  1.63  1.63
assign ( resid   31 and name HG2* )   ( resid   40 and name HD1* )   3.80  2.00  2.00
assign ( resid   31 and name HD1* )   ( resid   41 and name HG2  )   3.53  1.73  1.73
assign ( resid   31 and name HD1* )   ( resid   41 and name HD2  )   3.03  1.24  1.24
assign ( resid   31 and name HD1* )   ( resid   41 and name HD1  )   4.05  2.26  2.26
assign ( resid   31 and name HG2* )   ( resid   34 and name HB2  )   3.27  1.47  1.47
assign ( resid   31 and name HG2* )   ( resid   34 and name HA   )   3.59  1.80  1.80
assign ( resid   31 and name HG2* )   ( resid   34 and name HB1  )   3.83  2.04  2.04
assign ( resid   23 and name HD*  )   ( resid   31 and name HG2* )   4.75  2.95  2.95
assign ( resid   31 and name HG2* )   ( resid   33 and name HN   )   3.22  1.42  1.42
assign ( resid   31 and name HG2* )   ( resid   34 and name HE3  )   2.93  1.13  1.13
assign ( resid   20 and name HD*  )   ( resid   31 and name HG2* )   5.37  3.58  3.58
assign ( resid   31 and name HD1* )   ( resid   34 and name HE3  )   3.78  1.99  1.99
assign ( resid   31 and name HD1* )   ( resid   34 and name HZ3  )   4.04  2.24  2.24
assign ( resid   31 and name HG2* )   ( resid   34 and name HN   )   3.92  2.12  2.12
assign ( resid   14 and name HB*  )   ( resid   36 and name HD2* )   4.34  2.55  2.55
assign ( resid   19 and name HB*  )   ( resid   36 and name HD2* )   3.74  1.95  1.95
assign ( resid   19 and name HB*  )   ( resid   36 and name HD1* )   4.73  2.94  2.94
assign ( resid   14 and name HA   )   ( resid   36 and name HD2* )   4.12  2.32  2.32
assign ( resid   11 and name HD*  )   ( resid   36 and name HD1* )   5.32  3.53  3.53
assign ( resid   34 and name HZ2  )   ( resid   36 and name HD1* )   3.36  1.56  1.56
assign ( resid   36 and name HD2* )   ( resid   38 and name HN   )   4.09  2.29  2.29
assign ( resid   36 and name HB1  )   ( resid   38 and name HB*  )   3.46  1.66  1.66
assign ( resid   36 and name HD2* )   ( resid   38 and name HB*  )   4.46  2.66  2.66
assign ( resid   38 and name HB*  )   ( resid   39 and name HD1  )   2.98  1.19  1.19
assign ( resid   38 and name HB*  )   ( resid   39 and name HD2  )   2.81  1.02  1.02
assign ( resid   11 and name HE*  )   ( resid   38 and name HB*  )   4.76  2.97  2.97
assign ( resid   34 and name HE3  )   ( resid   40 and name HD1* )   3.63  1.83  1.83
assign ( resid   34 and name HD1  )   ( resid   40 and name HD1* )   4.07  2.27  2.27
assign ( resid   31 and name HB   )   ( resid   40 and name HD1* )   3.07  1.27  1.27
assign ( resid   40 and name HD1* )   ( resid   41 and name HD2  )   2.85  1.05  1.05
assign ( resid   40 and name HD1* )   ( resid   41 and name HD1  )   3.15  1.36  1.36
assign ( resid   31 and name HB   )   ( resid   40 and name HD2* )   4.12  2.32  2.32
assign ( resid   34 and name HB2  )   ( resid   40 and name HD1* )   3.07  1.27  1.27
assign ( resid   34 and name HB1  )   ( resid   40 and name HD1* )   3.22  1.42  1.42
assign ( resid   40 and name HD2* )   ( resid   41 and name HD1  )   4.31  2.51  2.51
assign ( resid   40 and name HD2* )   ( resid   41 and name HD2  )   4.31  2.51  2.51
assign ( resid   41 and name HB2  )   ( resid   46 and name HD2* )   3.52  1.73  1.73
assign ( resid   41 and name HB2  )   ( resid   46 and name HD1* )   3.49  1.70  1.70
assign ( resid   41 and name HB1  )   ( resid   46 and name HD2* )   3.66  1.87  1.87
assign ( resid   41 and name HB1  )   ( resid   46 and name HD1* )   4.31  2.51  2.51
assign ( resid   31 and name HD1* )   ( resid   41 and name HG1  )   3.53  1.73  1.73
assign ( resid   42 and name HG2* )   ( resid   44 and name HN   )   3.58  1.78  1.78
assign ( resid   43 and name HB1  )   ( resid   46 and name HD1* )   4.10  2.31  2.31
assign ( resid   43 and name HA   )   ( resid   46 and name HD2* )   4.31  2.51  2.51
assign ( resid   43 and name HA   )   ( resid   46 and name HD1* )   3.00  1.20  1.20
assign ( resid   46 and name HD2* )   ( resid   49 and name HE3  )   3.13  1.34  1.34
assign ( resid   46 and name HD2* )   ( resid   49 and name HZ3  )   3.12  1.32  1.32
assign ( resid   48 and name HG2* )   ( resid   49 and name HD1  )   3.03  1.24  1.24
assign ( resid   45 and name HA   )   ( resid   48 and name HG2* )   3.61  1.81  1.81
assign ( resid   48 and name HG2* )   ( resid   52 and name HG2  )   3.59  1.80  1.80
assign ( resid   48 and name HG2* )   ( resid   52 and name HG1  )   4.12  2.32  2.32
assign ( resid   48 and name HG2* )   ( resid   51 and name HB2  )   4.14  2.34  2.34
assign ( resid   48 and name HG2* )   ( resid   52 and name HB2  )   4.00  2.21  2.21
assign ( resid   50 and name HA   )   ( resid   53 and name HD2* )   3.22  1.42  1.42
assign ( resid    5 and name HB2  )   ( resid   53 and name HD2* )   3.27  1.47  1.47
assign ( resid    5 and name HB1  )   ( resid   53 and name HD2* )   3.34  1.54  1.54
assign ( resid   50 and name HZ3  )   ( resid   53 and name HD2* )   3.71  1.92  1.92
assign ( resid    7 and name HG2* )   ( resid   36 and name HD1* )   4.82  3.02  3.02
assign ( resid    4 and name HB1  )   ( resid   22 and name HD1* )   3.83  2.04  2.04
assign ( resid    4 and name HB2  )   ( resid   22 and name HD1* )   3.30  1.51  1.51
assign ( resid    4 and name HA   )   ( resid   22 and name HD1* )   3.00  1.20  1.20
assign ( resid   22 and name HN   )   ( resid   22 and name HD1* )   4.29  2.49  2.49
assign ( resid    8 and name HE*  )   ( resid   14 and name HB*  )   3.92  2.12  2.12
assign ( resid    8 and name HA   )   ( resid    8 and name HE*  )   2.88  1.08  1.08
assign ( resid    8 and name HE*  )   ( resid   12 and name HA   )   3.03  1.24  1.24
assign ( resid    8 and name HE*  )   ( resid   20 and name HE*  )   4.78  2.98  2.98
assign ( resid    8 and name HN   )   ( resid    8 and name HE*  )   3.85  2.05  2.05
assign ( resid    8 and name HE*  )   ( resid   14 and name HN   )   3.10  1.30  1.30
assign ( resid    8 and name HE*  )   ( resid   15 and name HG1* )   4.82  3.02  3.02
assign ( resid    7 and name HG2* )   ( resid    8 and name HE*  )   4.82  3.02  3.02
assign ( resid    7 and name HD1* )   ( resid   34 and name HH2  )   4.04  2.24  2.24
assign ( resid    7 and name HD1* )   ( resid   31 and name HG11 )   3.08  1.29  1.29
assign ( resid   16 and name HB1  )   ( resid   22 and name HD2* )   4.09  2.29  2.29
assign ( resid    2 and name HG2* )   ( resid    6 and name HN   )   4.02  2.22  2.22
assign ( resid    2 and name HG2* )   ( resid    4 and name HB1  )   3.34  1.54  1.54
assign ( resid   20 and name HE*  )   ( resid   22 and name HD2* )   5.25  3.46  3.46
assign ( resid   20 and name HE*  )   ( resid   22 and name HD1* )   5.20  3.41  3.41
assign ( resid   34 and name HZ2  )   ( resid   38 and name HB*  )   3.29  1.49  1.49
assign ( resid   37 and name HA   )   ( resid   38 and name HB*  )   4.09  2.29  2.29
assign ( resid    6 and name HB*  )   ( resid   50 and name HA   )   3.34  1.54  1.54
assign ( resid    6 and name HB*  )   ( resid   50 and name HZ3  )   4.31  2.51  2.51
assign ( resid    6 and name HB*  )   ( resid   53 and name HD1* )   4.82  3.02  3.02
assign ( resid   22 and name HD2* )   ( resid   23 and name HD*  )   4.75  2.95  2.95
assign ( resid    3 and name HD2* )   ( resid   29 and name HB*  )   3.86  2.07  2.07
assign ( resid   22 and name HD2* )   ( resid   31 and name HA   )   2.83  1.03  1.03
assign ( resid   31 and name HD1* )   ( resid   40 and name HD1* )   4.27  2.48  2.48
assign ( resid    7 and name HG12 )   ( resid   31 and name HG2* )   3.76  1.97  1.97
assign ( resid    7 and name HG12 )   ( resid   31 and name HD1* )   4.14  2.34  2.34
assign ( resid   36 and name HD1* )   ( resid   38 and name HB*  )   4.82  3.02  3.02
assign ( resid   41 and name HG2  )   ( resid   46 and name HD2* )   3.85  2.05  2.05
assign ( resid   31 and name HD1* )   ( resid   41 and name HB2  )   4.31  2.51  2.51
assign ( resid    1 and name HE*  )   ( resid    3 and name HA   )   3.24  1.44  1.44
assign ( resid    1 and name HE*  )   ( resid   47 and name HA   )   3.30  1.51  1.51
assign ( resid    1 and name HE*  )   ( resid   43 and name HE22 )   3.46  1.66  1.66
assign ( resid    1 and name HE*  )   ( resid   47 and name HN   )   3.20  1.41  1.41
assign ( resid    1 and name HE*  )   ( resid   43 and name HA   )   3.68  1.88  1.88
assign ( resid    1 and name HE*  )   ( resid   50 and name HB2  )   3.98  2.19  2.19
assign ( resid    1 and name HE*  )   ( resid   46 and name HD1* )   3.98  2.19  2.19
assign ( resid    6 and name HB*  )   ( resid   46 and name HD2* )   3.69  1.90  1.90
assign ( resid   41 and name HD2  )   ( resid   46 and name HD1* )   3.88  2.09  2.09
assign ( resid    1 and name HE*  )   ( resid   47 and name HG1  )   4.31  2.51  2.51
assign ( resid   36 and name HB2  )   ( resid   38 and name HB*  )   3.80  2.00  2.00
assign ( resid    7 and name HA   )   ( resid   46 and name HD2* )   4.31  2.51  2.51
assign ( resid    3 and name HD2* )   ( resid   31 and name HN   )   3.35  1.56  1.56
assign ( resid    3 and name HD1* )   ( resid   31 and name HN   )   4.10  2.31  2.31
assign ( resid    3 and name HD1* )   ( resid    7 and name HA   )   3.85  2.05  2.05
assign ( resid    3 and name HD1* )   ( resid   31 and name HB   )   4.31  2.51  2.51
assign ( resid    3 and name HD1* )   ( resid   46 and name HD1* )   4.63  2.83  2.83
assign ( resid    3 and name HD2* )   ( resid   46 and name HD1* )   4.82  3.02  3.02
assign ( resid    3 and name HD2* )   ( resid   31 and name HA   )   4.27  2.48  2.48
assign ( resid    3 and name HD1* )   ( resid   31 and name HA   )   4.31  2.51  2.51
assign ( resid    1 and name HE*  )   ( resid    3 and name HD2* )   4.15  2.36  2.36
assign ( resid    1 and name HE*  )   ( resid    3 and name HD1* )   4.15  2.36  2.36
assign ( resid    6 and name HA   )   ( resid   53 and name HD1* )   4.15  2.36  2.36
assign ( resid    1 and name HE*  )   ( resid   50 and name HB1  )   3.98  2.19  2.19
assign ( resid    1 and name HE*  )   ( resid   46 and name HB1  )   3.30  1.51  1.51
assign ( resid    3 and name HD1* )   ( resid   30 and name HA   )   3.56  1.76  1.76
assign ( resid    3 and name HD2* )   ( resid   30 and name HA   )   3.01  1.22  1.22
assign ( resid    7 and name HG2* )   ( resid   20 and name HZ   )   4.05  2.26  2.26
assign ( resid    7 and name HG11 )   ( resid   31 and name HD1* )   4.31  2.51  2.51
assign ( resid    7 and name HD1* )   ( resid   31 and name HD1* )   3.59  1.80  1.80
assign ( resid    7 and name HD1* )   ( resid   31 and name HG12 )   2.81  1.02  1.02
assign ( resid    3 and name HD1* )   ( resid   31 and name HG11 )   3.17  1.37  1.37
assign ( resid    3 and name HD1* )   ( resid   31 and name HG12 )   4.31  2.51  2.51
assign ( resid    3 and name HD2* )   ( resid   31 and name HG12 )   4.31  2.51  2.51
assign ( resid    3 and name HD2* )   ( resid   31 and name HG11 )   3.71  1.92  1.92
assign ( resid    3 and name HD1* )   ( resid   46 and name HD2* )   4.82  3.02  3.02
assign ( resid    3 and name HD2* )   ( resid   46 and name HD2* )   4.82  3.02  3.02
assign ( resid    3 and name HD2* )   ( resid   31 and name HD1* )   4.82  3.02  3.02
assign ( resid    3 and name HD1* )   ( resid   31 and name HD1* )   4.72  2.92  2.92
assign ( resid   16 and name HB2  )   ( resid   22 and name HD2* )   4.09  2.29  2.29
assign ( resid   15 and name HG1* )   ( resid   18 and name HD2  )   3.54  1.75  1.75
assign ( resid   15 and name HG1* )   ( resid   18 and name HD1  )   3.54  1.75  1.75
assign ( resid    7 and name HG2* )   ( resid   14 and name HB*  )   4.56  2.77  2.77
assign ( resid   50 and name HA   )   ( resid   53 and name HD1* )   3.71  1.92  1.92
assign ( resid   41 and name HG1  )   ( resid   46 and name HD2* )   3.85  2.05  2.05
assign ( resid    6 and name HB*  )   ( resid   49 and name HB*  )   4.19  2.39  2.39
assign ( resid   31 and name HD1* )   ( resid   46 and name HD1* )   4.82  3.02  3.02
assign ( resid   22 and name HD1* )   ( resid   23 and name HN   )   4.31  2.51  2.51
assign ( resid    1 and name HE*  )   ( resid   47 and name HG2  )   4.31  2.51  2.51
assign ( resid   53 and name HD2* )   ( resid   54 and name HE21 )   4.31  2.51  2.51
assign ( resid    3 and name HD2* )   ( resid   30 and name HB1  )   3.98  2.19  2.19
assign ( resid    3 and name HD2* )   ( resid   30 and name HB2  )   3.98  2.19  2.19
assign ( resid    4 and name HD*  )   ( resid   22 and name HD1* )   4.11  2.32  2.32
assign ( resid    4 and name HE*  )   ( resid   22 and name HD1* )   5.37  3.58  3.58
assign ( resid    4 and name HE*  )   ( resid    8 and name HE*  )   5.37  3.58  3.58
assign ( resid    9 and name HD*  )   ( resid   53 and name HD1* )   4.05  2.25  2.25
assign ( resid   20 and name HD*  )   ( resid   22 and name HD2* )   4.78  2.98  2.98
assign ( resid   20 and name HD*  )   ( resid   36 and name HD2* )   5.37  3.58  3.58
assign ( resid   20 and name HD*  )   ( resid   36 and name HD1* )   5.10  3.30  3.30
assign ( resid    7 and name HG2* )   ( resid   20 and name HE*  )   5.37  3.58  3.58
assign ( resid    3 and name HD2* )   ( resid   30 and name HD*  )   5.37  3.58  3.58
assign ( resid   34 and name HE3  )   ( resid   40 and name HD2* )   4.00  2.21  2.21
assign ( resid   34 and name HZ2  )   ( resid   36 and name HD2* )   3.98  2.19  2.19
assign ( resid   34 and name HH2  )   ( resid   36 and name HD1* )   3.70  1.90  1.90
assign ( resid    6 and name HB*  )   ( resid   50 and name HE3  )   3.71  1.92  1.92
assign ( resid   50 and name HE3  )   ( resid   53 and name HD2* )   3.15  1.36  1.36
assign ( resid    6 and name HB*  )   ( resid   49 and name HZ3  )   4.14  2.34  2.34
assign ( resid    6 and name HB*  )   ( resid   49 and name HE3  )   3.90  2.10  2.10
assign ( resid    9 and name HE*  )   ( resid   53 and name HD1* )   5.05  3.26  3.26
assign ( resid   11 and name HD*  )   ( resid   14 and name HB*  )   4.81  3.01  3.01
assign ( resid   20 and name HE*  )   ( resid   36 and name HD2* )   5.37  3.58  3.58
assign ( resid   11 and name HE*  )   ( resid   36 and name HD2* )   5.25  3.46  3.46
assign ( resid   11 and name HE*  )   ( resid   36 and name HD1* )   5.37  3.58  3.58
assign ( resid    1 and name HE*  )   ( resid   43 and name HE2* )   3.37  1.57  1.57
assign ( resid    1 and name HE*  )   ( resid   50 and name HB*  )   3.74  1.94  1.94
assign ( resid    2 and name HA   )   ( resid    2 and name HG1* )   2.74  0.94  0.94
assign ( resid    2 and name HG1* )   ( resid    3 and name HN   )   4.24  2.44  2.44
assign ( resid    2 and name HG1* )   ( resid   50 and name HZ2  )   3.98  2.19  2.19
assign ( resid    2 and name HG1* )   ( resid   50 and name HH2  )   4.08  2.29  2.29
assign ( resid    3 and name HD2* )   ( resid   30 and name HB*  )   3.81  2.01  2.01
assign ( resid    3 and name HD2* )   ( resid   43 and name HE2* )   4.74  2.94  2.94
assign ( resid    4 and name HD*  )   ( resid   16 and name HB*  )   5.30  3.51  3.51
assign ( resid    4 and name HE*  )   ( resid   16 and name HB*  )   4.06  2.27  2.27
assign ( resid    6 and name HB*  )   ( resid   50 and name HB*  )   3.44  1.64  1.64
assign ( resid   10 and name HN   )   ( resid   10 and name HG*  )   3.78  1.98  1.98
assign ( resid   10 and name HN   )   ( resid   10 and name HD*  )   3.44  1.64  1.64
assign ( resid   10 and name HA   )   ( resid   10 and name HD*  )   3.22  1.43  1.43
assign ( resid   10 and name HB2  )   ( resid   10 and name HE*  )   3.59  1.80  1.80
assign ( resid   10 and name HB1  )   ( resid   10 and name HD*  )   2.61  0.82  0.82
assign ( resid   10 and name HG*  )   ( resid   11 and name HE*  )   5.30  3.51  3.51
assign ( resid   10 and name HD*  )   ( resid   11 and name HN   )   4.24  2.44  2.44
assign ( resid   10 and name HD*  )   ( resid   49 and name HE1  )   3.65  1.86  1.86
assign ( resid   10 and name HE*  )   ( resid   11 and name HE*  )   5.30  3.51  3.51
assign ( resid   10 and name HE*  )   ( resid   49 and name HE1  )   3.60  1.80  1.80
assign ( resid   10 and name HE*  )   ( resid   49 and name HZ2  )   3.63  1.83  1.83
assign ( resid   12 and name HG*  )   ( resid   13 and name HN   )   3.44  1.64  1.64
assign ( resid   15 and name HG1* )   ( resid   18 and name HB*  )   3.66  1.87  1.87
assign ( resid   15 and name HG1* )   ( resid   18 and name HD*  )   3.19  1.39  1.39
assign ( resid   16 and name HN   )   ( resid   16 and name HB*  )   2.56  0.77  0.77
assign ( resid   16 and name HB*  )   ( resid   20 and name HZ   )   3.64  1.85  1.85
assign ( resid   16 and name HB*  )   ( resid   22 and name HD2* )   4.00  2.20  2.20
assign ( resid   17 and name HA   )   ( resid   21 and name HB*  )   3.73  1.93  1.93
assign ( resid   18 and name HN   )   ( resid   18 and name HB*  )   2.52  0.72  0.72
assign ( resid   18 and name HN   )   ( resid   18 and name HG*  )   3.64  1.84  1.84
assign ( resid   18 and name HN   )   ( resid   18 and name HD*  )   4.24  2.44  2.44
assign ( resid   18 and name HA   )   ( resid   18 and name HG*  )   2.66  0.87  0.87
assign ( resid   18 and name HA   )   ( resid   18 and name HD*  )   3.29  1.50  1.50
assign ( resid   18 and name HB*  )   ( resid   19 and name HN   )   2.65  0.86  0.86
assign ( resid   20 and name HB*  )   ( resid   21 and name HN   )   2.77  0.98  0.98
assign ( resid   21 and name HN   )   ( resid   21 and name HB*  )   2.57  0.77  0.77
assign ( resid   21 and name HN   )   ( resid   33 and name HG*  )   3.66  1.86  1.86
assign ( resid   21 and name HB*  )   ( resid   22 and name HN   )   2.88  1.09  1.09
assign ( resid   23 and name HN   )   ( resid   23 and name HG*  )   3.40  1.61  1.61
assign ( resid   23 and name HA   )   ( resid   23 and name HG*  )   2.75  0.96  0.96
assign ( resid   23 and name HG*  )   ( resid   24 and name HN   )   2.68  0.89  0.89
assign ( resid   23 and name HG*  )   ( resid   30 and name HE*  )   5.30  3.51  3.51
assign ( resid   23 and name HG*  )   ( resid   32 and name HB*  )   3.84  2.05  2.05
assign ( resid   23 and name HG*  )   ( resid   32 and name HG*  )   4.03  2.24  2.24
assign ( resid   25 and name HN   )   ( resid   25 and name HB*  )   2.57  0.77  0.77
assign ( resid   25 and name HB*  )   ( resid   26 and name HN   )   3.11  1.32  1.32
assign ( resid   25 and name HB*  )   ( resid   30 and name HE*  )   4.55  2.76  2.76
assign ( resid   27 and name HN   )   ( resid   27 and name HB*  )   2.56  0.77  0.77
assign ( resid   27 and name HB*  )   ( resid   27 and name HD21 )   2.46  0.67  0.67
assign ( resid   27 and name HB*  )   ( resid   27 and name HD22 )   2.75  0.95  0.95
assign ( resid   27 and name HB*  )   ( resid   28 and name HN   )   2.99  1.20  1.20
assign ( resid   30 and name HN   )   ( resid   30 and name HB*  )   2.78  0.98  0.98
assign ( resid   30 and name HB*  )   ( resid   31 and name HN   )   2.61  0.81  0.81
assign ( resid   30 and name HB*  )   ( resid   31 and name HD1* )   4.75  2.95  2.95
assign ( resid   31 and name HD1* )   ( resid   41 and name HG*  )   3.31  1.51  1.51
assign ( resid   32 and name HG*  )   ( resid   33 and name HG*  )   4.68  2.88  2.88
assign ( resid   33 and name HN   )   ( resid   33 and name HG*  )   3.46  1.66  1.66
assign ( resid   33 and name HN   )   ( resid   33 and name HD*  )   3.62  1.83  1.83
assign ( resid   33 and name HA   )   ( resid   33 and name HD*  )   4.24  2.44  2.44
assign ( resid   33 and name HG*  )   ( resid   33 and name HD*  )   2.06  0.27  0.27
assign ( resid   33 and name HG*  )   ( resid   33 and name HE*  )   2.47  0.67  0.67
assign ( resid   33 and name HG*  )   ( resid   35 and name HD22 )   4.24  2.44  2.44
assign ( resid   33 and name HD*  )   ( resid   33 and name HE*  )   2.07  0.27  0.27
assign ( resid   33 and name HD*  )   ( resid   35 and name HD21 )   4.24  2.44  2.44
assign ( resid   33 and name HD*  )   ( resid   35 and name HD22 )   3.78  1.98  1.98
assign ( resid   37 and name HN   )   ( resid   37 and name HG*  )   2.79  1.00  1.00
assign ( resid   41 and name HG*  )   ( resid   46 and name HD1* )   3.66  1.87  1.87
assign ( resid   41 and name HG*  )   ( resid   46 and name HD2* )   3.55  1.75  1.75
assign ( resid   41 and name HG*  )   ( resid   49 and name HZ3  )   3.80  2.01  2.01
assign ( resid   41 and name HG*  )   ( resid   49 and name HH2  )   3.47  1.68  1.68
assign ( resid   43 and name HN   )   ( resid   43 and name HG*  )   3.20  1.41  1.41
assign ( resid   43 and name HA   )   ( resid   43 and name HG*  )   2.79  1.00  1.00
assign ( resid   43 and name HE2* )   ( resid   46 and name HD1* )   4.13  2.33  2.33
assign ( resid   45 and name HN   )   ( resid   45 and name HG*  )   2.76  0.96  0.96
assign ( resid   45 and name HG*  )   ( resid   49 and name HE1  )   3.63  1.83  1.83
assign ( resid   45 and name HG*  )   ( resid   49 and name HZ3  )   4.24  2.44  2.44
assign ( resid   47 and name HA   )   ( resid   47 and name HG*  )   2.26  0.46  0.46
assign ( resid   47 and name HA   )   ( resid   50 and name HB*  )   2.67  0.88  0.88
assign ( resid   50 and name HN   )   ( resid   50 and name HB*  )   2.35  0.55  0.55
assign ( resid   50 and name HB*  )   ( resid   51 and name HN   )   2.64  0.85  0.85
assign ( resid   52 and name HA   )   ( resid   55 and name HD*  )   4.24  2.44  2.44
assign ( resid   55 and name HN   )   ( resid   55 and name HD*  )   4.02  2.22  2.22
assign ( resid   56 and name HN   )   ( resid   56 and name HB*  )   2.51  0.71  0.71
assign ( resid   56 and name HB*  )   ( resid   56 and name HD21 )   2.46  0.67  0.67
assign ( resid   56 and name HB*  )   ( resid   56 and name HD22 )   2.71  0.91  0.91
assign ( resid   56 and name HB*  )   ( resid   57 and name HD*  )   3.86  2.06  2.06
assign ( resid   57 and name HA   )   ( resid   58 and name HD*  )   2.35  0.55  0.55
assign ( resid   57 and name HB*  )   ( resid   58 and name HD*  )   3.08  1.29  1.29
assign ( resid   58 and name HB*  )   ( resid   59 and name HN   )   2.57  0.77  0.77
assign ( resid   58 and name HD*  )   ( resid   59 and name HN   )   3.61  1.82  1.82
assign ( resid   59 and name HB*  )   ( resid   60 and name HN   )   2.86  1.07  1.07
assign ( resid   59 and name HD*  )   ( resid   61 and name HG*  )   5.31  3.51  3.51
assign ( resid   59 and name HE*  )   ( resid   61 and name HB*  )   4.64  2.85  2.85
assign ( resid   59 and name HE*  )   ( resid   61 and name HG*  )   4.92  3.12  3.12
assign ( resid   60 and name HN   )   ( resid   60 and name HB*  )   2.47  0.67  0.67
assign ( resid   60 and name HB*  )   ( resid   61 and name HD*  )   3.41  1.61  1.61
assign ( resid   61 and name HA   )   ( resid   62 and name HD*  )   2.39  0.60  0.60
assign ( resid   61 and name HB*  )   ( resid   62 and name HD*  )   2.97  1.17  1.17
assign ( resid    3 and name O    )   ( resid    7 and name HN   )   2.00  0.20  0.30
assign ( resid    3 and name O    )   ( resid    7 and name N    )   3.00  0.30  0.30
assign ( resid    4 and name O    )   ( resid    8 and name HN   )   2.00  0.20  0.30
assign ( resid    4 and name O    )   ( resid    8 and name N    )   3.00  0.30  0.30
assign ( resid    5 and name O    )   ( resid    9 and name HN   )   2.00  0.20  0.30
assign ( resid    5 and name O    )   ( resid    9 and name N    )   3.00  0.30  0.30
assign ( resid    6 and name O    )   ( resid   10 and name HN   )   2.00  0.20  0.30
assign ( resid    6 and name O    )   ( resid   10 and name N    )   3.00  0.30  0.30
assign ( resid    7 and name O    )   ( resid   11 and name HN   )   2.00  0.20  0.30
assign ( resid    7 and name O    )   ( resid   11 and name N    )   3.00  0.30  0.30
assign ( resid   19 and name O    )   ( resid   35 and name HN   )   2.00  0.20  0.30
assign ( resid   19 and name O    )   ( resid   35 and name N    )   3.00  0.30  0.30
assign ( resid   21 and name O    )   ( resid   32 and name HN   )   2.00  0.20  0.30
assign ( resid   21 and name O    )   ( resid   32 and name N    )   3.00  0.30  0.30
assign ( resid   17 and name HN   )   ( resid   20 and name O    )   2.00  0.20  0.30
assign ( resid   17 and name N    )   ( resid   20 and name O    )   3.00  0.30  0.30
assign ( resid   23 and name O    )   ( resid   30 and name HN   )   2.00  0.20  0.30
assign ( resid   23 and name O    )   ( resid   30 and name N    )   3.00  0.30  0.30
assign ( resid   23 and name HN   )   ( resid   30 and name O    )   2.00  0.20  0.30
assign ( resid   23 and name N    )   ( resid   30 and name O    )   3.00  0.30  0.30
assign ( resid   36 and name O    )   ( resid   38 and name HN   )   2.00  0.20  0.30
assign ( resid   36 and name O    )   ( resid   38 and name N    )   3.00  0.30  0.30
assign ( resid   42 and name O    )   ( resid   46 and name HN   )   2.00  0.20  0.30
assign ( resid   42 and name O    )   ( resid   46 and name N    )   3.00  0.30  0.30
assign ( resid   43 and name O    )   ( resid   47 and name HN   )   2.00  0.20  0.30
assign ( resid   43 and name O    )   ( resid   47 and name N    )   3.00  0.30  0.30
assign ( resid   44 and name O    )   ( resid   48 and name HN   )   2.00  0.20  0.30
assign ( resid   44 and name O    )   ( resid   48 and name N    )   3.00  0.30  0.30
assign ( resid   45 and name O    )   ( resid   49 and name HN   )   2.00  0.20  0.30
assign ( resid   45 and name O    )   ( resid   49 and name N    )   3.00  0.30  0.30
assign ( resid   46 and name O    )   ( resid   50 and name HN   )   2.00  0.20  0.30
assign ( resid   46 and name O    )   ( resid   50 and name N    )   3.00  0.30  0.30
assign ( resid   47 and name O    )   ( resid   51 and name HN   )   2.00  0.20  0.30
assign ( resid   47 and name O    )   ( resid   51 and name N    )   3.00  0.30  0.30
assign ( resid   48 and name O    )   ( resid   52 and name HN   )   2.00  0.20  0.30
assign ( resid   48 and name O    )   ( resid   52 and name N    )   3.00  0.30  0.30
assign ( resid   49 and name O    )   ( resid   53 and name HN   )   2.00  0.20  0.30
assign ( resid   49 and name O    )   ( resid   53 and name N    )   3.00  0.30  0.30
assign ( resid   50 and name O    )   ( resid   54 and name HN   )   2.00  0.20  0.30
assign ( resid   50 and name O    )   ( resid   54 and name N    )   3.00  0.30  0.30
assign ( resid   51 and name O    )   ( resid   55 and name HN   )   2.00  0.20  0.30
assign ( resid   51 and name O    )   ( resid   55 and name N    )   3.00  0.30  0.30
assign ( resid    2 and name C    )   ( resid    3 and name N    ) 
        (resid    3 and name CA   )   ( resid    3 and name C    )  1  -59.00   10.00 2
assign ( resid    3 and name N    )   ( resid    3 and name CA   ) 
        (resid    3 and name C    )   ( resid    4 and name N    )  1  -44.00   13.00 2
assign ( resid    3 and name C    )   ( resid    4 and name N    ) 
        (resid    4 and name CA   )   ( resid    4 and name C    )  1  -63.00   10.00 2
assign ( resid    4 and name N    )   ( resid    4 and name CA   ) 
        (resid    4 and name C    )   ( resid    5 and name N    )  1  -43.00   18.00 2
assign ( resid    4 and name C    )   ( resid    5 and name N    ) 
        (resid    5 and name CA   )   ( resid    5 and name C    )  1  -63.00   10.00 2
assign ( resid    5 and name N    )   ( resid    5 and name CA   ) 
        (resid    5 and name C    )   ( resid    6 and name N    )  1  -39.00   18.00 2
assign ( resid    5 and name C    )   ( resid    6 and name N    ) 
        (resid    6 and name CA   )   ( resid    6 and name C    )  1  -66.00   11.00 2
assign ( resid    6 and name N    )   ( resid    6 and name CA   ) 
        (resid    6 and name C    )   ( resid    7 and name N    )  1  -43.00   14.00 2
assign ( resid    6 and name C    )   ( resid    7 and name N    ) 
        (resid    7 and name CA   )   ( resid    7 and name C    )  1  -68.00   23.00 2
assign ( resid    7 and name N    )   ( resid    7 and name CA   ) 
        (resid    7 and name C    )   ( resid    8 and name N    )  1  -43.00   12.00 2
assign ( resid    7 and name C    )   ( resid    8 and name N    ) 
        (resid    8 and name CA   )   ( resid    8 and name C    )  1  -65.00   18.00 2
assign ( resid    8 and name N    )   ( resid    8 and name CA   ) 
        (resid    8 and name C    )   ( resid    9 and name N    )  1  -25.00   30.00 2
assign ( resid    8 and name C    )   ( resid    9 and name N    ) 
        (resid    9 and name CA   )   ( resid    9 and name C    )  1  -77.00   30.00 2
assign ( resid    9 and name N    )   ( resid    9 and name CA   ) 
        (resid    9 and name C    )   ( resid   10 and name N    )  1  -21.00   36.00 2
assign ( resid   20 and name C    )   ( resid   21 and name N    ) 
        (resid   21 and name CA   )   ( resid   21 and name C    )  1 -130.00   51.00 2
assign ( resid   21 and name N    )   ( resid   21 and name CA   ) 
        (resid   21 and name C    )   ( resid   22 and name N    )  1  157.00   30.00 2
assign ( resid   21 and name C    )   ( resid   22 and name N    ) 
        (resid   22 and name CA   )   ( resid   22 and name C    )  1 -105.00   40.00 2
assign ( resid   22 and name N    )   ( resid   22 and name CA   ) 
        (resid   22 and name C    )   ( resid   23 and name N    )  1  144.00    9.00 2
assign ( resid   22 and name C    )   ( resid   23 and name N    ) 
        (resid   23 and name CA   )   ( resid   23 and name C    )  1 -137.00   32.00 2
assign ( resid   23 and name N    )   ( resid   23 and name CA   ) 
        (resid   23 and name C    )   ( resid   24 and name N    )  1  155.00   30.00 2
assign ( resid   23 and name C    )   ( resid   24 and name N    ) 
        (resid   24 and name CA   )   ( resid   24 and name C    )  1 -107.00   48.00 2
assign ( resid   24 and name N    )   ( resid   24 and name CA   ) 
        (resid   24 and name C    )   ( resid   25 and name N    )  1  132.00   25.00 2
assign ( resid   28 and name C    )   ( resid   29 and name N    ) 
        (resid   29 and name CA   )   ( resid   29 and name C    )  1 -102.00   41.00 2
assign ( resid   29 and name N    )   ( resid   29 and name CA   ) 
        (resid   29 and name C    )   ( resid   30 and name N    )  1  142.00   33.00 2
assign ( resid   29 and name C    )   ( resid   30 and name N    ) 
        (resid   30 and name CA   )   ( resid   30 and name C    )  1 -108.00   55.00 2
assign ( resid   30 and name N    )   ( resid   30 and name CA   ) 
        (resid   30 and name C    )   ( resid   31 and name N    )  1  165.00   30.00 2
assign ( resid   30 and name C    )   ( resid   31 and name N    ) 
        (resid   31 and name CA   )   ( resid   31 and name C    )  1  -79.00   34.00 2
assign ( resid   31 and name N    )   ( resid   31 and name CA   ) 
        (resid   31 and name C    )   ( resid   32 and name N    )  1  128.00   15.00 2
assign ( resid   32 and name C    )   ( resid   33 and name N    ) 
        (resid   33 and name CA   )   ( resid   33 and name C    )  1 -129.00   56.00 2
assign ( resid   33 and name N    )   ( resid   33 and name CA   ) 
        (resid   33 and name C    )   ( resid   34 and name N    )  1  141.00   36.00 2
assign ( resid   33 and name C    )   ( resid   34 and name N    ) 
        (resid   34 and name CA   )   ( resid   34 and name C    )  1 -110.00   49.00 2
assign ( resid   34 and name N    )   ( resid   34 and name CA   ) 
        (resid   34 and name C    )   ( resid   35 and name N    )  1  129.00   16.00 2
assign ( resid   42 and name C    )   ( resid   43 and name N    ) 
        (resid   43 and name CA   )   ( resid   43 and name C    )  1  -57.00   10.00 2
assign ( resid   43 and name N    )   ( resid   43 and name CA   ) 
        (resid   43 and name C    )   ( resid   44 and name N    )  1  -39.00   16.00 2
assign ( resid   43 and name C    )   ( resid   44 and name N    ) 
        (resid   44 and name CA   )   ( resid   44 and name C    )  1  -65.00   10.00 2
assign ( resid   44 and name N    )   ( resid   44 and name CA   ) 
        (resid   44 and name C    )   ( resid   45 and name N    )  1  -34.00   17.00 2
assign ( resid   44 and name C    )   ( resid   45 and name N    ) 
        (resid   45 and name CA   )   ( resid   45 and name C    )  1  -65.00   12.00 2
assign ( resid   45 and name N    )   ( resid   45 and name CA   ) 
        (resid   45 and name C    )   ( resid   46 and name N    )  1  -45.00   12.00 2
assign ( resid   45 and name C    )   ( resid   46 and name N    ) 
        (resid   46 and name CA   )   ( resid   46 and name C    )  1  -64.00   13.00 2
assign ( resid   46 and name N    )   ( resid   46 and name CA   ) 
        (resid   46 and name C    )   ( resid   47 and name N    )  1  -46.00   17.00 2
assign ( resid   46 and name C    )   ( resid   47 and name N    ) 
        (resid   47 and name CA   )   ( resid   47 and name C    )  1  -69.00   16.00 2
assign ( resid   47 and name N    )   ( resid   47 and name CA   ) 
        (resid   47 and name C    )   ( resid   48 and name N    )  1  -38.00   19.00 2
assign ( resid   47 and name C    )   ( resid   48 and name N    ) 
        (resid   48 and name CA   )   ( resid   48 and name C    )  1  -69.00   10.00 2
assign ( resid   48 and name N    )   ( resid   48 and name CA   ) 
        (resid   48 and name C    )   ( resid   49 and name N    )  1  -41.00   12.00 2
assign ( resid   48 and name C    )   ( resid   49 and name N    ) 
        (resid   49 and name CA   )   ( resid   49 and name C    )  1  -67.00   10.00 2
assign ( resid   49 and name N    )   ( resid   49 and name CA   ) 
        (resid   49 and name C    )   ( resid   50 and name N    )  1  -38.00   17.00 2
assign ( resid   49 and name C    )   ( resid   50 and name N    ) 
        (resid   50 and name CA   )   ( resid   50 and name C    )  1  -64.00   11.00 2
assign ( resid   50 and name N    )   ( resid   50 and name CA   ) 
        (resid   50 and name C    )   ( resid   51 and name N    )  1  -43.00   18.00 2
assign ( resid   50 and name C    )   ( resid   51 and name N    ) 
        (resid   51 and name CA   )   ( resid   51 and name C    )  1  -64.00   11.00 2
assign ( resid   51 and name N    )   ( resid   51 and name CA   ) 
        (resid   51 and name C    )   ( resid   52 and name N    )  1  -40.00   15.00 2
assign ( resid   51 and name C    )   ( resid   52 and name N    ) 
        (resid   52 and name CA   )   ( resid   52 and name C    )  1  -66.00   11.00 2
assign ( resid   52 and name N    )   ( resid   52 and name CA   ) 
        (resid   52 and name C    )   ( resid   53 and name N    )  1  -42.00   11.00 2
assign ( resid   52 and name C    )   ( resid   53 and name N    ) 
        (resid   53 and name CA   )   ( resid   53 and name C    )  1  -64.00   15.00 2
assign ( resid   53 and name N    )   ( resid   53 and name CA   ) 
        (resid   53 and name C    )   ( resid   54 and name N    )  1  -41.00   20.00 2
assign ( resid   53 and name C    )   ( resid   54 and name N    ) 
        (resid   54 and name CA   )   ( resid   54 and name C    )  1  -68.00   23.00 2
assign ( resid   54 and name N    )   ( resid   54 and name CA   ) 
        (resid   54 and name C    )   ( resid   55 and name N    )  1  -29.00   32.00 2
assign ( resid    1 and name C    )   ( resid    2 and name N    ) 
        (resid    2 and name CA   )   ( resid    2 and name C    )  1 -115.00   70.00 2
assign ( resid    2 and name N    )   ( resid    2 and name CA   ) 
        (resid    2 and name C    )   ( resid    3 and name N    )  1  135.00   30.00 2
assign ( resid    9 and name C    )   ( resid   10 and name N    ) 
        (resid   10 and name CA   )   ( resid   10 and name C    )  1 -110.00   65.00 2
assign ( resid   10 and name N    )   ( resid   10 and name CA   ) 
        (resid   10 and name C    )   ( resid   11 and name N    )  1  -40.00   45.00 2
assign ( resid   13 and name C    )   ( resid   14 and name N    ) 
        (resid   14 and name CA   )   ( resid   14 and name C    )  1 -180.00  135.00 2
assign ( resid   13 and name C    )   ( resid   14 and name N    ) 
        (resid   14 and name CA   )   ( resid   14 and name C    )  1  -55.00  130.00 2
assign ( resid   14 and name N    )   ( resid   14 and name CA   ) 
        (resid   14 and name C    )   ( resid   15 and name N    )  1  115.00   80.00 2
assign ( resid   14 and name C    )   ( resid   15 and name N    ) 
        (resid   15 and name CA   )   ( resid   15 and name C    )  1 -180.00  135.00 2
assign ( resid   14 and name C    )   ( resid   15 and name N    ) 
        (resid   15 and name CA   )   ( resid   15 and name C    )  1  -40.00  115.00 2
assign ( resid   15 and name N    )   ( resid   15 and name CA   ) 
        (resid   15 and name C    )   ( resid   16 and name N    )  1  130.00   55.00 2
assign ( resid   15 and name C    )   ( resid   16 and name N    ) 
        (resid   16 and name CA   )   ( resid   16 and name C    )  1 -180.00  135.00 2
assign ( resid   15 and name C    )   ( resid   16 and name N    ) 
        (resid   16 and name CA   )   ( resid   16 and name C    )  1  -55.00  130.00 2
assign ( resid   16 and name N    )   ( resid   16 and name CA   ) 
        (resid   16 and name C    )   ( resid   17 and name N    )  1  120.00   75.00 2
assign ( resid   16 and name C    )   ( resid   17 and name N    ) 
        (resid   17 and name CA   )   ( resid   17 and name C    )  1 -180.00  135.00 2
assign ( resid   16 and name C    )   ( resid   17 and name N    ) 
        (resid   17 and name CA   )   ( resid   17 and name C    )  1   -5.00   80.00 2
assign ( resid   17 and name N    )   ( resid   17 and name CA   ) 
        (resid   17 and name C    )   ( resid   18 and name N    )  1 -180.00  175.00 2
assign ( resid   17 and name N    )   ( resid   17 and name CA   ) 
        (resid   17 and name C    )   ( resid   18 and name N    )  1    0.00   85.00 2
assign ( resid   17 and name C    )   ( resid   18 and name N    ) 
        (resid   18 and name CA   )   ( resid   18 and name C    )  1 -115.00   70.00 2
assign ( resid   18 and name N    )   ( resid   18 and name CA   ) 
        (resid   18 and name C    )   ( resid   19 and name N    )  1  -45.00   40.00 2
assign ( resid   18 and name C    )   ( resid   19 and name N    ) 
        (resid   19 and name CA   )   ( resid   19 and name C    )  1 -180.00  135.00 2
assign ( resid   18 and name C    )   ( resid   19 and name N    ) 
        (resid   19 and name CA   )   ( resid   19 and name C    )  1  -55.00  130.00 2
assign ( resid   19 and name N    )   ( resid   19 and name CA   ) 
        (resid   19 and name C    )   ( resid   20 and name N    )  1    5.00   90.00 2
assign ( resid   19 and name C    )   ( resid   20 and name N    ) 
        (resid   20 and name CA   )   ( resid   20 and name C    )  1 -180.00  135.00 2
assign ( resid   19 and name C    )   ( resid   20 and name N    ) 
        (resid   20 and name CA   )   ( resid   20 and name C    )  1  -55.00  130.00 2
assign ( resid   20 and name N    )   ( resid   20 and name CA   ) 
        (resid   20 and name C    )   ( resid   21 and name N    )  1  155.00   40.00 2
assign ( resid   24 and name C    )   ( resid   25 and name N    ) 
        (resid   25 and name CA   )   ( resid   25 and name C    )  1 -115.00   70.00 2
assign ( resid   25 and name N    )   ( resid   25 and name CA   ) 
        (resid   25 and name C    )   ( resid   26 and name N    )  1 -120.00  155.00 2
assign ( resid   25 and name N    )   ( resid   25 and name CA   ) 
        (resid   25 and name C    )   ( resid   26 and name N    )  1   35.00  120.00 2
assign ( resid   25 and name C    )   ( resid   26 and name N    ) 
        (resid   26 and name CA   )   ( resid   26 and name C    )  1 -180.00  135.00 2
assign ( resid   26 and name C    )   ( resid   27 and name N    ) 
        (resid   27 and name CA   )   ( resid   27 and name C    )  1 -115.00   60.00 2
assign ( resid   27 and name N    )   ( resid   27 and name CA   ) 
        (resid   27 and name C    )   ( resid   28 and name N    )  1    5.00   30.00 2
assign ( resid   27 and name C    )   ( resid   28 and name N    ) 
        (resid   28 and name CA   )   ( resid   28 and name C    )  1 -180.00  135.00 2
assign ( resid   28 and name N    )   ( resid   28 and name CA   ) 
        (resid   28 and name C    )   ( resid   29 and name N    )  1  175.00   40.00 2
assign ( resid   31 and name C    )   ( resid   32 and name N    ) 
        (resid   32 and name CA   )   ( resid   32 and name C    )  1 -180.00  135.00 2
assign ( resid   31 and name C    )   ( resid   32 and name N    ) 
        (resid   32 and name CA   )   ( resid   32 and name C    )  1  -55.00  130.00 2
assign ( resid   32 and name N    )   ( resid   32 and name CA   ) 
        (resid   32 and name C    )   ( resid   33 and name N    )  1    0.00   85.00 2
assign ( resid   34 and name C    )   ( resid   35 and name N    ) 
        (resid   35 and name CA   )   ( resid   35 and name C    )  1  170.00  125.00 2
assign ( resid   34 and name C    )   ( resid   35 and name N    ) 
        (resid   35 and name CA   )   ( resid   35 and name C    )  1  -55.00  130.00 2
assign ( resid   35 and name N    )   ( resid   35 and name CA   ) 
        (resid   35 and name C    )   ( resid   36 and name N    )  1   35.00   50.00 2
assign ( resid   35 and name C    )   ( resid   36 and name N    ) 
        (resid   36 and name CA   )   ( resid   36 and name C    )  1  -95.00   50.00 2
assign ( resid   36 and name N    )   ( resid   36 and name CA   ) 
        (resid   36 and name C    )   ( resid   37 and name N    )  1  155.00   40.00 2
assign ( resid   36 and name C    )   ( resid   37 and name N    ) 
        (resid   37 and name CA   )   ( resid   37 and name C    )  1 -115.00   40.00 2
assign ( resid   37 and name N    )   ( resid   37 and name CA   ) 
        (resid   37 and name C    )   ( resid   38 and name N    )  1   70.00   35.00 2
assign ( resid   54 and name C    )   ( resid   55 and name N    ) 
        (resid   55 and name CA   )   ( resid   55 and name C    )  1  175.00  120.00 2
assign ( resid   54 and name C    )   ( resid   55 and name N    ) 
        (resid   55 and name CA   )   ( resid   55 and name C    )  1  -40.00  105.00 2
assign ( resid   55 and name N    )   ( resid   55 and name CA   ) 
        (resid   55 and name C    )   ( resid   56 and name N    )  1    5.00   20.00 2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          1H        MET   1  -9.085  -5.747   6.608
    2   2H    MET   1          2H        MET   1  -8.695  -7.094   5.652
    3   3H    MET   1          3H        MET   1  -9.110  -5.623   4.918
    4    HA   MET   1           HA       MET   1  -6.763  -6.023   6.667
    5   1HB   MET   1          2HB       MET   1  -5.440  -5.828   4.530
    6   2HB   MET   1          1HB       MET   1  -6.335  -7.323   4.721
    7   1HG   MET   1          2HG       MET   1  -6.595  -6.702   2.482
    8   2HG   MET   1          1HG       MET   1  -8.119  -6.299   3.267
    9   1HE   MET   1          1HE       MET   1  -7.623  -3.561   0.454
   10   2HE   MET   1          2HE       MET   1  -8.653  -4.872   1.028
   11   3HE   MET   1          3HE       MET   1  -7.052  -5.227   0.376
   12    H    ILE   2           H        ILE   2  -5.097  -4.232   5.927
   13    HA   ILE   2           HA       ILE   2  -6.604  -1.701   5.917
   14    HB   ILE   2           HB       ILE   2  -4.006  -2.245   7.369
   15   1HG1  ILE   2          2HG1      ILE   2  -6.799  -1.861   8.479
   16   2HG1  ILE   2          1HG1      ILE   2  -5.948  -3.401   8.388
   17   1HG2  ILE   2          1HG2      ILE   2  -4.193   0.060   6.636
   18   2HG2  ILE   2          2HG2      ILE   2  -4.408  -0.033   8.383
   19   3HG2  ILE   2          3HG2      ILE   2  -5.811   0.174   7.335
   20   1HD1  ILE   2          1HD1      ILE   2  -5.123  -0.997  10.010
   21   2HD1  ILE   2          2HD1      ILE   2  -4.243  -2.524   9.915
   22   3HD1  ILE   2          3HD1      ILE   2  -5.856  -2.478  10.626
   23    H    LEU   3           H        LEU   3  -6.068  -0.277   4.365
   24    HA   LEU   3           HA       LEU   3  -4.259  -0.937   2.321
   25   1HB   LEU   3          2HB       LEU   3  -6.018   1.326   3.045
   26   2HB   LEU   3          1HB       LEU   3  -4.754   1.641   1.896
   27    HG   LEU   3           HG       LEU   3  -6.777   1.152   0.699
   28   1HD1  LEU   3          1HD1      LEU   3  -6.081  -0.778  -0.640
   29   2HD1  LEU   3          2HD1      LEU   3  -4.888  -1.194   0.592
   30   3HD1  LEU   3          3HD1      LEU   3  -4.737   0.315  -0.306
   31   1HD2  LEU   3          1HD2      LEU   3  -7.987  -0.059   2.402
   32   2HD2  LEU   3          2HD2      LEU   3  -6.858  -1.408   2.289
   33   3HD2  LEU   3          3HD2      LEU   3  -7.912  -1.027   0.929
   34    H    TYR   4           H        TYR   4  -4.107   1.201   5.082
   35    HA   TYR   4           HA       TYR   4  -1.884   2.722   4.514
   36   1HB   TYR   4          2HB       TYR   4  -3.280   3.140   6.455
   37   2HB   TYR   4          1HB       TYR   4  -2.791   1.615   7.179
   38    HD1  TYR   4           HD1      TYR   4  -1.169   4.720   5.843
   39    HD2  TYR   4           HD2      TYR   4  -1.240   1.734   8.870
   40    HE1  TYR   4           HE1      TYR   4   0.641   5.889   7.030
   41    HE2  TYR   4           HE2      TYR   4   0.569   2.890  10.063
   42    HH   TYR   4           HH       TYR   4   2.283   4.467   9.747
   43    H    ASP   5           H        ASP   5  -1.958  -0.489   6.053
   44    HA   ASP   5           HA       ASP   5   0.800  -0.733   6.490
   45   1HB   ASP   5          2HB       ASP   5  -1.415  -2.739   6.184
   46   2HB   ASP   5          1HB       ASP   5   0.253  -3.252   6.391
   47    H    ALA   6           H        ALA   6  -1.211  -1.826   3.793
   48    HA   ALA   6           HA       ALA   6   0.804  -3.045   2.283
   49   1HB   ALA   6          1HB       ALA   6  -1.672  -1.670   1.247
   50   2HB   ALA   6          2HB       ALA   6  -1.605  -3.321   1.861
   51   3HB   ALA   6          3HB       ALA   6  -0.711  -2.886   0.404
   52    H    ILE   7           H        ILE   7  -0.399   0.299   2.230
   53    HA   ILE   7           HA       ILE   7   1.231   1.209   0.116
   54    HB   ILE   7           HB       ILE   7   0.131   2.809   2.436
   55   1HG1  ILE   7          2HG1      ILE   7  -1.007   2.354  -0.335
   56   2HG1  ILE   7          1HG1      ILE   7  -1.591   1.584   1.134
   57   1HG2  ILE   7          1HG2      ILE   7   1.150   3.683  -0.267
   58   2HG2  ILE   7          2HG2      ILE   7   1.908   3.995   1.294
   59   3HG2  ILE   7          3HG2      ILE   7   0.352   4.729   0.909
   60   1HD1  ILE   7          1HD1      ILE   7  -1.610   4.544   0.606
   61   2HD1  ILE   7          2HD1      ILE   7  -2.260   3.732   2.031
   62   3HD1  ILE   7          3HD1      ILE   7  -2.993   3.462   0.448
   63    H    MET   8           H        MET   8   1.749   1.076   3.615
   64    HA   MET   8           HA       MET   8   4.224   2.474   3.588
   65   1HB   MET   8          2HB       MET   8   3.029   0.560   5.591
   66   2HB   MET   8          1HB       MET   8   4.542   1.410   5.857
   67   1HG   MET   8          2HG       MET   8   1.929   2.795   5.327
   68   2HG   MET   8          1HG       MET   8   2.528   2.424   6.937
   69   1HE   MET   8          1HE       MET   8   3.797   4.170   3.542
   70   2HE   MET   8          2HE       MET   8   3.902   5.804   4.192
   71   3HE   MET   8          3HE       MET   8   2.352   4.967   4.168
   72    H    TYR   9           H        TYR   9   3.360  -0.774   2.832
   73    HA   TYR   9           HA       TYR   9   5.966  -1.889   3.225
   74   1HB   TYR   9          2HB       TYR   9   4.009  -3.340   3.270
   75   2HB   TYR   9          1HB       TYR   9   3.610  -2.902   1.612
   76    HD1  TYR   9           HD1      TYR   9   4.583  -4.058  -0.214
   77    HD2  TYR   9           HD2      TYR   9   6.132  -4.642   3.706
   78    HE1  TYR   9           HE1      TYR   9   5.965  -5.915  -1.038
   79    HE2  TYR   9           HE2      TYR   9   7.520  -6.500   2.887
   80    HH   TYR   9           HH       TYR   9   7.464  -8.139   0.957
   81    H    LYS  10           H        LYS  10   4.191  -0.583   0.452
   82    HA   LYS  10           HA       LYS  10   6.436  -1.198  -1.297
   83   1HB   LYS  10          2HB       LYS  10   4.077  -1.607  -2.012
   84   2HB   LYS  10          1HB       LYS  10   3.818   0.130  -2.004
   85   1HG   LYS  10          2HG       LYS  10   4.241  -0.717  -4.258
   86   2HG   LYS  10          1HG       LYS  10   5.495   0.414  -3.743
   87   1HD   LYS  10          2HD       LYS  10   6.949  -1.470  -3.160
   88   2HD   LYS  10          1HD       LYS  10   5.695  -2.596  -3.675
   89   1HE   LYS  10          2HE       LYS  10   7.017  -0.558  -5.464
   90   2HE   LYS  10          1HE       LYS  10   7.477  -2.258  -5.371
   91   1HZ   LYS  10          1HZ       LYS  10   4.889  -1.138  -6.304
   92   2HZ   LYS  10          2HZ       LYS  10   5.149  -2.793  -6.023
   93   3HZ   LYS  10          3HZ       LYS  10   6.033  -1.991  -7.223
   94    H    TYR  11           H        TYR  11   4.901   1.612   0.172
   95    HA   TYR  11           HA       TYR  11   6.939   3.309  -1.118
   96   1HB   TYR  11          2HB       TYR  11   4.149   4.161  -0.315
   97   2HB   TYR  11          1HB       TYR  11   5.354   5.151  -1.122
   98    HD1  TYR  11           HD1      TYR  11   6.170   4.268  -3.449
   99    HD2  TYR  11           HD2      TYR  11   2.554   3.060  -1.562
  100    HE1  TYR  11           HE1      TYR  11   5.268   3.576  -5.633
  101    HE2  TYR  11           HE2      TYR  11   1.643   2.366  -3.734
  102    HH   TYR  11           HH       TYR  11   2.006   2.920  -6.144
  103    HA   PRO  12           HA       PRO  12   7.614   3.658   3.445
  104   1HB   PRO  12          2HB       PRO  12  10.417   3.926   2.593
  105   2HB   PRO  12          1HB       PRO  12   9.696   2.801   3.744
  106   1HG   PRO  12          2HG       PRO  12  10.593   1.975   1.354
  107   2HG   PRO  12          1HG       PRO  12   9.152   1.262   2.104
  108   1HD   PRO  12          2HD       PRO  12   9.331   3.345  -0.049
  109   2HD   PRO  12          1HD       PRO  12   8.277   1.915   0.044
  110    H    ASN  13           H        ASN  13   8.572   5.542   0.689
  111    HA   ASN  13           HA       ASN  13   9.360   7.801   2.362
  112   1HB   ASN  13          2HB       ASN  13   9.621   7.243  -0.587
  113   2HB   ASN  13          1HB       ASN  13   9.961   8.819   0.108
  114   1HD2  ASN  13          1HD2      ASN  13  11.039   5.552  -0.251
  115   2HD2  ASN  13          2HD2      ASN  13  12.589   5.763   0.494
  116    H    ALA  14           H        ALA  14   6.527   6.673   1.459
  117    HA   ALA  14           HA       ALA  14   5.381   9.222   0.583
  118   1HB   ALA  14          1HB       ALA  14   4.652   7.210  -0.603
  119   2HB   ALA  14          2HB       ALA  14   3.306   7.961   0.256
  120   3HB   ALA  14          3HB       ALA  14   4.078   6.520   0.915
  121    H    VAL  15           H        VAL  15   3.980  10.431   1.845
  122    HA   VAL  15           HA       VAL  15   3.940   9.647   4.684
  123    HB   VAL  15           HB       VAL  15   3.517  12.410   3.537
  124   1HG1  VAL  15          1HG1      VAL  15   4.058  11.494   6.358
  125   2HG1  VAL  15          2HG1      VAL  15   2.517  12.082   5.731
  126   3HG1  VAL  15          3HG1      VAL  15   3.904  13.168   5.825
  127   1HG2  VAL  15          1HG2      VAL  15   5.808  12.893   4.307
  128   2HG2  VAL  15          2HG2      VAL  15   5.768  11.676   3.032
  129   3HG2  VAL  15          3HG2      VAL  15   6.016  11.189   4.708
  130    H    SER  16           H        SER  16   2.082   9.139   5.625
  131    HA   SER  16           HA       SER  16  -0.392   9.261   4.218
  132   1HB   SER  16          2HB       SER  16  -1.302   8.485   6.486
  133   2HB   SER  16          1HB       SER  16  -0.120   7.432   5.707
  134    HG   SER  16           HG       SER  16   0.105   8.104   8.083
  135    H    ARG  17           H        ARG  17  -2.269  10.453   4.847
  136    HA   ARG  17           HA       ARG  17  -3.429  12.325   5.414
  137   1HB   ARG  17          2HB       ARG  17  -1.296  12.804   7.506
  138   2HB   ARG  17          1HB       ARG  17  -2.919  13.473   7.482
  139   1HG   ARG  17          2HG       ARG  17  -3.870  11.295   7.880
  140   2HG   ARG  17          1HG       ARG  17  -2.276  10.546   7.766
  141   1HD   ARG  17          2HD       ARG  17  -3.239  12.480   9.872
  142   2HD   ARG  17          1HD       ARG  17  -2.865  10.772  10.090
  143    HE   ARG  17           HE       ARG  17  -0.800  12.736   9.327
  144   1HH1  ARG  17          1HH1      ARG  17  -1.941  10.148  11.407
  145   2HH1  ARG  17          2HH1      ARG  17  -0.431  10.004  12.256
  146   1HH2  ARG  17          1HH2      ARG  17   1.178  12.540  10.431
  147   2HH2  ARG  17          2HH2      ARG  17   1.354  11.353  11.693
  148    H    LYS  18           H        LYS  18  -0.982  12.277   3.633
  149    HA   LYS  18           HA       LYS  18  -0.623  15.165   3.370
  150   1HB   LYS  18          2HB       LYS  18   1.262  14.451   4.728
  151   2HB   LYS  18          1HB       LYS  18   1.625  13.153   3.602
  152   1HG   LYS  18          2HG       LYS  18   3.210  14.853   3.211
  153   2HG   LYS  18          1HG       LYS  18   2.065  14.922   1.872
  154   1HD   LYS  18          2HD       LYS  18   0.922  16.798   2.918
  155   2HD   LYS  18          1HD       LYS  18   2.015  16.708   4.302
  156   1HE   LYS  18          2HE       LYS  18   2.774  17.336   1.450
  157   2HE   LYS  18          1HE       LYS  18   2.707  18.480   2.790
  158   1HZ   LYS  18          1HZ       LYS  18   4.570  16.172   2.526
  159   2HZ   LYS  18          2HZ       LYS  18   4.464  17.168   3.894
  160   3HZ   LYS  18          3HZ       LYS  18   4.973  17.817   2.411
  161    H    ASP  19           H        ASP  19   0.964  12.318   1.944
  162    HA   ASP  19           HA       ASP  19   0.555  13.362  -0.719
  163   1HB   ASP  19          2HB       ASP  19   1.739  10.733   0.210
  164   2HB   ASP  19          1HB       ASP  19   1.761  11.324  -1.447
  165    H    PHE  20           H        PHE  20  -0.814  10.963   1.364
  166    HA   PHE  20           HA       PHE  20  -3.022  10.677  -0.512
  167   1HB   PHE  20          2HB       PHE  20  -3.156   8.226  -0.014
  168   2HB   PHE  20          1HB       PHE  20  -1.750   8.691  -0.960
  169    HD1  PHE  20           HD1      PHE  20   0.489   8.667   0.052
  170    HD2  PHE  20           HD2      PHE  20  -2.939   7.310   2.182
  171    HE1  PHE  20           HE1      PHE  20   1.950   7.540   1.677
  172    HE2  PHE  20           HE2      PHE  20  -1.480   6.176   3.809
  173    HZ   PHE  20           HZ       PHE  20   0.966   6.292   3.558
  174    H    GLU  21           H        GLU  21  -4.972  10.650   0.425
  175    HA   GLU  21           HA       GLU  21  -5.042  11.068   3.327
  176   1HB   GLU  21          2HB       GLU  21  -6.111  12.790   1.972
  177   2HB   GLU  21          1HB       GLU  21  -7.097  11.581   1.166
  178   1HG   GLU  21          2HG       GLU  21  -8.538  12.572   2.687
  179   2HG   GLU  21          1HG       GLU  21  -8.052  11.072   3.473
  180    H    LEU  22           H        LEU  22  -5.809   9.531   4.636
  181    HA   LEU  22           HA       LEU  22  -7.076   7.183   3.414
  182   1HB   LEU  22          2HB       LEU  22  -5.931   7.520   6.180
  183   2HB   LEU  22          1HB       LEU  22  -6.549   6.032   5.502
  184    HG   LEU  22           HG       LEU  22  -4.144   7.519   4.447
  185   1HD1  LEU  22          1HD1      LEU  22  -4.291   5.019   6.125
  186   2HD1  LEU  22          2HD1      LEU  22  -3.754   6.602   6.687
  187   3HD1  LEU  22          3HD1      LEU  22  -2.830   5.742   5.456
  188   1HD2  LEU  22          1HD2      LEU  22  -3.753   5.473   3.170
  189   2HD2  LEU  22          2HD2      LEU  22  -5.307   6.198   2.755
  190   3HD2  LEU  22          3HD2      LEU  22  -5.246   4.785   3.810
  191    H    ARG  23           H        ARG  23  -8.935   6.277   4.368
  192    HA   ARG  23           HA       ARG  23 -10.430   8.064   6.163
  193   1HB   ARG  23          2HB       ARG  23 -11.203   8.149   3.720
  194   2HB   ARG  23          1HB       ARG  23 -11.738   6.489   3.946
  195   1HG   ARG  23          2HG       ARG  23 -13.674   7.522   4.450
  196   2HG   ARG  23          1HG       ARG  23 -12.942   7.593   6.049
  197   1HD   ARG  23          2HD       ARG  23 -12.780   9.780   3.984
  198   2HD   ARG  23          1HD       ARG  23 -13.941   9.741   5.304
  199    HE   ARG  23           HE       ARG  23 -11.622   9.583   6.631
  200   1HH1  ARG  23          1HH1      ARG  23 -12.666  11.708   4.034
  201   2HH1  ARG  23          2HH1      ARG  23 -11.679  13.037   4.565
  202   1HH2  ARG  23          1HH2      ARG  23 -10.367  11.371   7.347
  203   2HH2  ARG  23          2HH2      ARG  23 -10.404  12.854   6.440
  204    H    ASN  24           H        ASN  24 -11.688   7.021   7.691
  205    HA   ASN  24           HA       ASN  24 -10.900   4.239   8.125
  206   1HB   ASN  24          2HB       ASN  24 -10.492   5.821   9.958
  207   2HB   ASN  24          1HB       ASN  24 -12.208   6.208  10.013
  208   1HD2  ASN  24          1HD2      ASN  24 -13.627   4.786  10.958
  209   2HD2  ASN  24          2HD2      ASN  24 -13.111   3.429  11.900
  210    H    ASP  25           H        ASP  25 -12.203   2.789   7.303
  211    HA   ASP  25           HA       ASP  25 -15.026   3.237   6.929
  212   1HB   ASP  25          2HB       ASP  25 -14.004   1.901   5.257
  213   2HB   ASP  25          1HB       ASP  25 -13.185   0.896   6.447
  214    H    GLY  26           H        GLY  26 -12.954   1.465   9.125
  215   1HA   GLY  26          2HA       GLY  26 -13.898   1.101  11.405
  216   2HA   GLY  26          1HA       GLY  26 -15.349   0.529  10.585
  217    H    ASN  27           H        ASN  27 -14.266  -0.992   8.571
  218    HA   ASN  27           HA       ASN  27 -13.123  -3.248  10.019
  219   1HB   ASN  27          2HB       ASN  27 -14.964  -3.624   8.398
  220   2HB   ASN  27          1HB       ASN  27 -13.945  -2.994   7.109
  221   1HD2  ASN  27          1HD2      ASN  27 -12.435  -4.322   6.173
  222   2HD2  ASN  27          2HD2      ASN  27 -12.240  -5.988   6.586
  223    H    GLY  28           H        GLY  28 -12.055  -0.546   8.518
  224   1HA   GLY  28          2HA       GLY  28  -9.365  -0.994   8.774
  225   2HA   GLY  28          1HA       GLY  28  -9.754  -1.506   7.136
  226    H    SER  29           H        SER  29  -8.070   0.415   7.052
  227    HA   SER  29           HA       SER  29  -9.654   2.838   6.522
  228   1HB   SER  29          2HB       SER  29  -6.715   2.701   7.250
  229   2HB   SER  29          1HB       SER  29  -7.659   4.166   6.976
  230    HG   SER  29           HG       SER  29  -9.015   2.918   8.764
  231    H    TYR  30           H        TYR  30  -9.608   3.588   4.466
  232    HA   TYR  30           HA       TYR  30  -7.713   2.292   2.621
  233   1HB   TYR  30          2HB       TYR  30  -9.483   2.187   0.924
  234   2HB   TYR  30          1HB       TYR  30  -9.900   1.260   2.358
  235    HD1  TYR  30           HD1      TYR  30 -10.846   3.964   0.168
  236    HD2  TYR  30           HD2      TYR  30 -11.603   2.187   3.958
  237    HE1  TYR  30           HE1      TYR  30 -13.003   5.132   0.277
  238    HE2  TYR  30           HE2      TYR  30 -13.766   3.351   4.079
  239    HH   TYR  30           HH       TYR  30 -15.202   4.800   1.404
  240    H    ILE  31           H        ILE  31  -8.095   3.527   0.319
  241    HA   ILE  31           HA       ILE  31  -6.946   6.121   0.926
  242    HB   ILE  31           HB       ILE  31  -7.294   4.786  -1.762
  243   1HG1  ILE  31          2HG1      ILE  31  -4.876   4.817   0.060
  244   2HG1  ILE  31          1HG1      ILE  31  -5.943   3.439  -0.172
  245   1HG2  ILE  31          1HG2      ILE  31  -5.512   6.315  -2.473
  246   2HG2  ILE  31          2HG2      ILE  31  -5.533   7.070  -0.880
  247   3HG2  ILE  31          3HG2      ILE  31  -6.947   7.182  -1.928
  248   1HD1  ILE  31          1HD1      ILE  31  -5.323   3.335  -2.519
  249   2HD1  ILE  31          2HD1      ILE  31  -3.906   3.222  -1.473
  250   3HD1  ILE  31          3HD1      ILE  31  -4.269   4.734  -2.305
  251    H    GLU  32           H        GLU  32  -8.058   7.906   0.962
  252    HA   GLU  32           HA       GLU  32 -10.629   8.085  -0.422
  253   1HB   GLU  32          2HB       GLU  32 -10.196   8.752   2.054
  254   2HB   GLU  32          1HB       GLU  32  -9.432  10.184   1.387
  255   1HG   GLU  32          2HG       GLU  32 -12.276   9.370   0.838
  256   2HG   GLU  32          1HG       GLU  32 -11.787  10.499   2.097
  257    H    LYS  33           H        LYS  33  -7.704  10.077   0.044
  258    HA   LYS  33           HA       LYS  33  -8.165  11.294  -2.596
  259   1HB   LYS  33          2HB       LYS  33  -8.313  12.808  -0.641
  260   2HB   LYS  33          1HB       LYS  33  -6.666  12.377  -0.208
  261   1HG   LYS  33          2HG       LYS  33  -6.209  13.200  -2.677
  262   2HG   LYS  33          1HG       LYS  33  -7.669  14.130  -2.361
  263   1HD   LYS  33          2HD       LYS  33  -5.078  14.168  -0.873
  264   2HD   LYS  33          1HD       LYS  33  -5.868  15.485  -1.716
  265   1HE   LYS  33          2HE       LYS  33  -6.937  14.140   0.748
  266   2HE   LYS  33          1HE       LYS  33  -6.035  15.649   0.737
  267   1HZ   LYS  33          1HZ       LYS  33  -8.660  15.185  -0.582
  268   2HZ   LYS  33          2HZ       LYS  33  -7.788  16.642  -0.610
  269   3HZ   LYS  33          3HZ       LYS  33  -8.404  16.050   0.856
  270    H    TRP  34           H        TRP  34  -6.502  11.292  -4.068
  271    HA   TRP  34           HA       TRP  34  -4.000   9.953  -3.248
  272   1HB   TRP  34          2HB       TRP  34  -5.556   8.469  -4.533
  273   2HB   TRP  34          1HB       TRP  34  -5.456   9.594  -5.879
  274    HD1  TRP  34           HD1      TRP  34  -3.581   9.166  -7.589
  275    HE1  TRP  34           HE1      TRP  34  -1.572   7.559  -7.730
  276    HE3  TRP  34           HE3      TRP  34  -3.690   7.314  -2.824
  277    HZ2  TRP  34           HZ2      TRP  34  -0.213   5.761  -6.036
  278    HZ3  TRP  34           HZ3      TRP  34  -2.005   5.651  -2.169
  279    HH2  TRP  34           HH2      TRP  34  -0.299   4.888  -3.746
  280    H    ASN  35           H        ASN  35  -2.399  11.430  -3.392
  281    HA   ASN  35           HA       ASN  35  -2.484  13.343  -5.640
  282   1HB   ASN  35          2HB       ASN  35  -1.397  13.672  -2.844
  283   2HB   ASN  35          1HB       ASN  35  -0.979  14.769  -4.154
  284   1HD2  ASN  35          1HD2      ASN  35  -2.303  15.451  -1.735
  285   2HD2  ASN  35          2HD2      ASN  35  -3.867  16.066  -2.160
  286    H    LEU  36           H        LEU  36  -1.138  10.576  -5.065
  287    HA   LEU  36           HA       LEU  36   1.657  11.259  -5.445
  288   1HB   LEU  36          2HB       LEU  36   0.192   8.651  -5.117
  289   2HB   LEU  36          1HB       LEU  36   1.890   8.719  -5.539
  290    HG   LEU  36           HG       LEU  36   0.692   9.876  -3.029
  291   1HD1  LEU  36          1HD1      LEU  36   0.600   7.438  -3.052
  292   2HD1  LEU  36          2HD1      LEU  36   1.788   8.024  -1.888
  293   3HD1  LEU  36          3HD1      LEU  36   2.321   7.374  -3.439
  294   1HD2  LEU  36          1HD2      LEU  36   3.561   9.552  -3.901
  295   2HD2  LEU  36          2HD2      LEU  36   3.025  10.128  -2.323
  296   3HD2  LEU  36          3HD2      LEU  36   2.679  11.073  -3.770
  297    H    ARG  37           H        ARG  37   2.841  10.901  -7.271
  298    HA   ARG  37           HA       ARG  37   1.390  10.606  -9.744
  299   1HB   ARG  37          2HB       ARG  37   4.324  10.976  -9.145
  300   2HB   ARG  37          1HB       ARG  37   3.701  10.748 -10.770
  301   1HG   ARG  37          2HG       ARG  37   2.260  12.771 -10.392
  302   2HG   ARG  37          1HG       ARG  37   3.176  13.044  -8.907
  303   1HD   ARG  37          2HD       ARG  37   4.062  14.343 -10.801
  304   2HD   ARG  37          1HD       ARG  37   5.241  13.188 -10.175
  305    HE   ARG  37           HE       ARG  37   3.601  12.407 -12.474
  306   1HH1  ARG  37          1HH1      ARG  37   6.723  13.407 -11.228
  307   2HH1  ARG  37          2HH1      ARG  37   7.609  12.809 -12.604
  308   1HH2  ARG  37          1HH2      ARG  37   4.744  11.623 -14.274
  309   2HH2  ARG  37          2HH2      ARG  37   6.480  11.790 -14.341
  310    H    ALA  38           H        ALA  38   0.708   8.447  -8.747
  311    HA   ALA  38           HA       ALA  38   2.276   6.383 -10.074
  312   1HB   ALA  38          1HB       ALA  38   3.084   6.350  -7.769
  313   2HB   ALA  38          2HB       ALA  38   2.166   4.891  -8.142
  314   3HB   ALA  38          3HB       ALA  38   1.428   6.175  -7.185
  315    HA   PRO  39           HA       PRO  39  -1.756   5.098 -11.384
  316   1HB   PRO  39          2HB       PRO  39  -0.641   2.351 -11.277
  317   2HB   PRO  39          1HB       PRO  39  -1.369   3.217 -12.634
  318   1HG   PRO  39          2HG       PRO  39   1.271   2.798 -12.517
  319   2HG   PRO  39          1HG       PRO  39   0.599   4.302 -13.173
  320   1HD   PRO  39          2HD       PRO  39   1.855   3.792 -10.510
  321   2HD   PRO  39          1HD       PRO  39   1.973   5.218 -11.560
  322    H    LEU  40           H        LEU  40  -3.592   4.244 -10.488
  323    HA   LEU  40           HA       LEU  40  -3.609   3.712  -7.708
  324   1HB   LEU  40          2HB       LEU  40  -5.635   3.701  -9.891
  325   2HB   LEU  40          1HB       LEU  40  -6.030   2.895  -8.391
  326    HG   LEU  40           HG       LEU  40  -6.917   5.151  -8.395
  327   1HD1  LEU  40          1HD1      LEU  40  -6.169   4.205  -6.264
  328   2HD1  LEU  40          2HD1      LEU  40  -5.969   5.957  -6.307
  329   3HD1  LEU  40          3HD1      LEU  40  -4.570   4.905  -6.516
  330   1HD2  LEU  40          1HD2      LEU  40  -5.344   6.190  -9.932
  331   2HD2  LEU  40          2HD2      LEU  40  -4.057   6.044  -8.735
  332   3HD2  LEU  40          3HD2      LEU  40  -5.436   7.098  -8.423
  333    HA   PRO  41           HA       PRO  41  -2.367  -0.550  -8.004
  334   1HB   PRO  41          2HB       PRO  41  -2.996  -1.143  -5.379
  335   2HB   PRO  41          1HB       PRO  41  -1.460  -0.479  -5.937
  336   1HG   PRO  41          2HG       PRO  41  -3.788   0.903  -4.691
  337   2HG   PRO  41          1HG       PRO  41  -2.056   1.218  -4.490
  338   1HD   PRO  41          2HD       PRO  41  -3.637   2.775  -6.029
  339   2HD   PRO  41          1HD       PRO  41  -1.930   2.475  -6.420
  340    H    THR  42           H        THR  42  -3.336  -2.493  -8.200
  341    HA   THR  42           HA       THR  42  -6.258  -2.392  -8.298
  342    HB   THR  42           HB       THR  42  -5.927  -4.639  -9.515
  343    HG1  THR  42           HG1      THR  42  -3.252  -3.607  -9.620
  344   1HG2  THR  42          1HG2      THR  42  -5.368  -3.517 -11.629
  345   2HG2  THR  42          2HG2      THR  42  -4.839  -2.096 -10.728
  346   3HG2  THR  42          3HG2      THR  42  -6.533  -2.590 -10.680
  347    H    GLN  43           H        GLN  43  -7.345  -4.583  -7.809
  348    HA   GLN  43           HA       GLN  43  -7.224  -5.078  -5.089
  349   1HB   GLN  43          2HB       GLN  43  -9.100  -5.681  -6.605
  350   2HB   GLN  43          1HB       GLN  43  -8.140  -7.008  -7.224
  351   1HG   GLN  43          2HG       GLN  43  -9.793  -7.731  -5.575
  352   2HG   GLN  43          1HG       GLN  43  -8.141  -8.083  -5.072
  353   1HE2  GLN  43          1HE2      GLN  43  -7.259  -6.972  -3.325
  354   2HE2  GLN  43          2HE2      GLN  43  -8.232  -6.050  -2.231
  355    H    ALA  44           H        ALA  44  -5.932  -7.068  -7.717
  356    HA   ALA  44           HA       ALA  44  -4.679  -9.031  -6.188
  357   1HB   ALA  44          1HB       ALA  44  -3.290  -9.460  -8.146
  358   2HB   ALA  44          2HB       ALA  44  -3.762  -7.903  -8.829
  359   3HB   ALA  44          3HB       ALA  44  -4.965  -9.174  -8.609
  360    H    GLU  45           H        GLU  45  -3.435  -5.879  -7.232
  361    HA   GLU  45           HA       GLU  45  -0.807  -6.184  -6.264
  362   1HB   GLU  45          2HB       GLU  45  -2.533  -3.798  -6.851
  363   2HB   GLU  45          1HB       GLU  45  -0.904  -3.608  -6.227
  364   1HG   GLU  45          2HG       GLU  45  -0.025  -4.821  -8.146
  365   2HG   GLU  45          1HG       GLU  45  -1.664  -5.021  -8.767
  366    H    LEU  46           H        LEU  46  -3.669  -4.656  -4.806
  367    HA   LEU  46           HA       LEU  46  -2.515  -3.872  -2.396
  368   1HB   LEU  46          2HB       LEU  46  -5.356  -4.747  -2.951
  369   2HB   LEU  46          1HB       LEU  46  -4.830  -3.857  -1.540
  370    HG   LEU  46           HG       LEU  46  -4.708  -2.842  -4.376
  371   1HD1  LEU  46          1HD1      LEU  46  -6.495  -1.333  -3.673
  372   2HD1  LEU  46          2HD1      LEU  46  -6.538  -2.114  -2.093
  373   3HD1  LEU  46          3HD1      LEU  46  -6.991  -3.021  -3.535
  374   1HD2  LEU  46          1HD2      LEU  46  -4.129  -0.697  -3.340
  375   2HD2  LEU  46          2HD2      LEU  46  -2.917  -1.932  -2.996
  376   3HD2  LEU  46          3HD2      LEU  46  -4.087  -1.477  -1.757
  377    H    GLU  47           H        GLU  47  -4.137  -6.892  -3.286
  378    HA   GLU  47           HA       GLU  47  -3.934  -8.106  -0.758
  379   1HB   GLU  47          2HB       GLU  47  -4.222  -9.278  -3.515
  380   2HB   GLU  47          1HB       GLU  47  -4.233 -10.252  -2.050
  381   1HG   GLU  47          2HG       GLU  47  -6.154  -8.911  -1.241
  382   2HG   GLU  47          1HG       GLU  47  -6.177  -8.090  -2.800
  383    H    THR  48           H        THR  48  -1.814  -8.207  -3.606
  384    HA   THR  48           HA       THR  48  -0.032 -10.156  -2.673
  385    HB   THR  48           HB       THR  48   0.496  -7.822  -4.529
  386    HG1  THR  48           HG1      THR  48  -1.087  -9.269  -5.292
  387   1HG2  THR  48          1HG2      THR  48   2.595  -8.738  -3.615
  388   2HG2  THR  48          2HG2      THR  48   2.417  -9.088  -5.336
  389   3HG2  THR  48          3HG2      THR  48   2.108 -10.350  -4.144
  390    H    TRP  49           H        TRP  49   0.067  -6.609  -2.260
  391    HA   TRP  49           HA       TRP  49   2.515  -6.527  -0.880
  392   1HB   TRP  49          2HB       TRP  49   0.125  -4.681  -0.678
  393   2HB   TRP  49          1HB       TRP  49   1.695  -4.350   0.044
  394    HD1  TRP  49           HD1      TRP  49   3.174  -5.597  -2.732
  395    HE1  TRP  49           HE1      TRP  49   3.386  -3.971  -4.713
  396    HE3  TRP  49           HE3      TRP  49  -0.378  -2.192  -1.353
  397    HZ2  TRP  49           HZ2      TRP  49   2.202  -1.560  -5.573
  398    HZ3  TRP  49           HZ3      TRP  49  -0.775  -0.251  -2.812
  399    HH2  TRP  49           HH2      TRP  49   0.490   0.058  -4.878
  400    H    TRP  50           H        TRP  50  -0.792  -6.971   0.249
  401    HA   TRP  50           HA       TRP  50  -0.208  -7.069   3.015
  402   1HB   TRP  50          2HB       TRP  50  -2.472  -6.713   2.061
  403   2HB   TRP  50          1HB       TRP  50  -2.476  -8.375   1.486
  404    HD1  TRP  50           HD1      TRP  50  -3.219 -10.226   3.174
  405    HE1  TRP  50           HE1      TRP  50  -4.065 -10.194   5.605
  406    HE3  TRP  50           HE3      TRP  50  -2.109  -5.374   4.360
  407    HZ2  TRP  50           HZ2      TRP  50  -4.234  -8.357   7.744
  408    HZ3  TRP  50           HZ3      TRP  50  -2.643  -4.559   6.621
  409    HH2  TRP  50           HH2      TRP  50  -3.685  -6.022   8.276
  410    H    GLU  51           H        GLU  51  -0.487  -9.565   0.526
  411    HA   GLU  51           HA       GLU  51  -0.092 -11.797   2.143
  412   1HB   GLU  51          2HB       GLU  51   0.467 -11.267  -0.772
  413   2HB   GLU  51          1HB       GLU  51   0.639 -12.844  -0.039
  414   1HG   GLU  51          2HG       GLU  51  -1.715 -12.870   0.544
  415   2HG   GLU  51          1HG       GLU  51  -1.904 -11.246  -0.113
  416    H    GLU  52           H        GLU  52   2.215  -9.725   0.422
  417    HA   GLU  52           HA       GLU  52   4.467 -11.308   1.155
  418   1HB   GLU  52          2HB       GLU  52   4.211  -8.550  -0.008
  419   2HB   GLU  52          1HB       GLU  52   5.769  -9.278   0.360
  420   1HG   GLU  52          2HG       GLU  52   5.120 -11.194  -1.112
  421   2HG   GLU  52          1HG       GLU  52   3.707 -10.261  -1.588
  422    H    LEU  53           H        LEU  53   2.809  -8.592   2.600
  423    HA   LEU  53           HA       LEU  53   4.925  -7.939   4.428
  424   1HB   LEU  53          2HB       LEU  53   3.312  -6.263   3.672
  425   2HB   LEU  53          1HB       LEU  53   2.007  -7.167   4.415
  426    HG   LEU  53           HG       LEU  53   3.058  -6.776   6.639
  427   1HD1  LEU  53          1HD1      LEU  53   4.795  -5.072   6.837
  428   2HD1  LEU  53          2HD1      LEU  53   4.891  -4.960   5.079
  429   3HD1  LEU  53          3HD1      LEU  53   5.353  -6.453   5.893
  430   1HD2  LEU  53          1HD2      LEU  53   1.249  -5.350   5.831
  431   2HD2  LEU  53          2HD2      LEU  53   2.421  -4.292   5.046
  432   3HD2  LEU  53          3HD2      LEU  53   2.397  -4.431   6.804
  433    H    GLN  54           H        GLN  54   1.933  -9.810   4.564
  434    HA   GLN  54           HA       GLN  54   2.232 -10.261   7.392
  435   1HB   GLN  54          2HB       GLN  54   0.162 -10.745   5.368
  436   2HB   GLN  54          1HB       GLN  54   0.260 -11.975   6.620
  437   1HG   GLN  54          2HG       GLN  54  -1.348 -10.237   7.197
  438   2HG   GLN  54          1HG       GLN  54  -0.008 -10.275   8.341
  439   1HE2  GLN  54          1HE2      GLN  54  -0.284  -8.164   9.019
  440   2HE2  GLN  54          2HE2      GLN  54   0.076  -6.810   8.002
  441    H    LYS  55           H        LYS  55   3.143 -11.962   4.477
  442    HA   LYS  55           HA       LYS  55   3.610 -14.414   5.957
  443   1HB   LYS  55          2HB       LYS  55   2.903 -14.426   3.541
  444   2HB   LYS  55          1HB       LYS  55   4.492 -13.782   3.143
  445   1HG   LYS  55          2HG       LYS  55   5.465 -15.803   4.293
  446   2HG   LYS  55          1HG       LYS  55   3.826 -16.454   4.335
  447   1HD   LYS  55          2HD       LYS  55   3.694 -16.389   1.922
  448   2HD   LYS  55          1HD       LYS  55   5.274 -15.605   1.832
  449   1HE   LYS  55          2HE       LYS  55   6.251 -17.611   2.945
  450   2HE   LYS  55          1HE       LYS  55   4.676 -18.387   2.819
  451   1HZ   LYS  55          1HZ       LYS  55   6.216 -17.384   0.488
  452   2HZ   LYS  55          2HZ       LYS  55   4.808 -18.329   0.452
  453   3HZ   LYS  55          3HZ       LYS  55   6.260 -18.985   1.035
  454    H    ASN  56           H        ASN  56   5.215 -11.548   5.345
  455    HA   ASN  56           HA       ASN  56   7.722 -12.675   6.371
  456   1HB   ASN  56          2HB       ASN  56   8.082 -12.333   3.983
  457   2HB   ASN  56          1HB       ASN  56   7.496 -10.686   4.098
  458   1HD2  ASN  56          1HD2      ASN  56   8.798  -9.138   4.986
  459   2HD2  ASN  56          2HD2      ASN  56  10.487  -9.385   5.252
  460    HA   PRO  57           HA       PRO  57   6.575  -9.303   9.182
  461   1HB   PRO  57          2HB       PRO  57   8.361 -10.116  11.103
  462   2HB   PRO  57          1HB       PRO  57   6.710 -10.730  10.966
  463   1HG   PRO  57          2HG       PRO  57   9.273 -11.947  10.026
  464   2HG   PRO  57          1HG       PRO  57   7.871 -12.726  10.785
  465   1HD   PRO  57          2HD       PRO  57   8.315 -12.847   8.128
  466   2HD   PRO  57          1HD       PRO  57   6.675 -12.787   8.808
  467    HA   PRO  58           HA       PRO  58   9.913  -6.721   7.671
  468   1HB   PRO  58          2HB       PRO  58   8.825  -4.859   9.707
  469   2HB   PRO  58          1HB       PRO  58   9.084  -4.611   7.978
  470   1HG   PRO  58          2HG       PRO  58   6.628  -4.936   8.989
  471   2HG   PRO  58          1HG       PRO  58   7.073  -5.588   7.400
  472   1HD   PRO  58          2HD       PRO  58   6.760  -6.999  10.014
  473   2HD   PRO  58          1HD       PRO  58   6.347  -7.551   8.377
  474    H    TYR  59           H        TYR  59  11.906  -6.028   8.450
  475    HA   TYR  59           HA       TYR  59  12.691  -7.235  10.961
  476   1HB   TYR  59          2HB       TYR  59  14.113  -7.317   8.905
  477   2HB   TYR  59          1HB       TYR  59  14.390  -5.590   9.083
  478    HD1  TYR  59           HD1      TYR  59  14.756  -8.816  10.902
  479    HD2  TYR  59           HD2      TYR  59  16.170  -4.833  10.398
  480    HE1  TYR  59           HE1      TYR  59  16.636  -9.302  12.406
  481    HE2  TYR  59           HE2      TYR  59  18.057  -5.307  11.906
  482    HH   TYR  59           HH       TYR  59  18.701  -6.838  13.642
  483    H    GLU  60           H        GLU  60  11.571  -6.058  12.406
  484    HA   GLU  60           HA       GLU  60  11.664  -3.224  12.600
  485   1HB   GLU  60          2HB       GLU  60  10.837  -5.329  14.610
  486   2HB   GLU  60          1HB       GLU  60  10.575  -3.603  14.800
  487   1HG   GLU  60          2HG       GLU  60   9.099  -3.554  12.914
  488   2HG   GLU  60          1HG       GLU  60   9.462  -5.238  12.534
  Start of MODEL    2
    1   1H    MET   1          1H        MET   1  -8.374  -6.003   4.159
    2   2H    MET   1          2H        MET   1  -8.054  -6.241   5.808
    3   3H    MET   1          3H        MET   1  -7.583  -7.408   4.677
    4    HA   MET   1           HA       MET   1  -5.678  -6.172   5.385
    5   1HB   MET   1          2HB       MET   1  -4.841  -5.454   3.228
    6   2HB   MET   1          1HB       MET   1  -5.799  -6.914   3.023
    7   1HG   MET   1          2HG       MET   1  -7.602  -5.723   2.087
    8   2HG   MET   1          1HG       MET   1  -6.930  -4.174   2.588
    9   1HE   MET   1          1HE       MET   1  -8.001  -4.926  -0.396
   10   2HE   MET   1          2HE       MET   1  -6.790  -4.075  -1.355
   11   3HE   MET   1          3HE       MET   1  -7.459  -3.327   0.100
   12    H    ILE   2           H        ILE   2  -4.514  -4.123   5.307
   13    HA   ILE   2           HA       ILE   2  -6.313  -1.792   5.402
   14    HB   ILE   2           HB       ILE   2  -3.717  -2.182   6.918
   15   1HG1  ILE   2          2HG1      ILE   2  -5.345  -1.741   8.900
   16   2HG1  ILE   2          1HG1      ILE   2  -6.610  -2.178   7.760
   17   1HG2  ILE   2          1HG2      ILE   2  -3.927   0.114   6.188
   18   2HG2  ILE   2          2HG2      ILE   2  -4.204   0.013   7.926
   19   3HG2  ILE   2          3HG2      ILE   2  -5.569   0.195   6.824
   20   1HD1  ILE   2          1HD1      ILE   2  -4.307  -3.928   8.588
   21   2HD1  ILE   2          2HD1      ILE   2  -5.584  -4.367   7.455
   22   3HD1  ILE   2          3HD1      ILE   2  -5.974  -4.064   9.148
   23    H    LEU   3           H        LEU   3  -5.936  -0.259   3.923
   24    HA   LEU   3           HA       LEU   3  -4.200  -0.694   1.793
   25   1HB   LEU   3          2HB       LEU   3  -5.991   1.464   2.738
   26   2HB   LEU   3          1HB       LEU   3  -4.804   1.894   1.545
   27    HG   LEU   3           HG       LEU   3  -6.899   1.393   0.457
   28   1HD1  LEU   3          1HD1      LEU   3  -6.170  -0.301  -1.114
   29   2HD1  LEU   3          2HD1      LEU   3  -4.928  -0.842   0.015
   30   3HD1  LEU   3          3HD1      LEU   3  -4.833   0.769  -0.698
   31   1HD2  LEU   3          1HD2      LEU   3  -6.702  -1.306   1.788
   32   2HD2  LEU   3          2HD2      LEU   3  -7.895  -0.844   0.576
   33   3HD2  LEU   3          3HD2      LEU   3  -7.883  -0.045   2.148
   34    H    TYR   4           H        TYR   4  -3.939   1.363   4.619
   35    HA   TYR   4           HA       TYR   4  -1.792   2.967   3.915
   36   1HB   TYR   4          2HB       TYR   4  -3.295   3.091   5.964
   37   2HB   TYR   4          1HB       TYR   4  -2.256   1.870   6.684
   38    HD1  TYR   4           HD1      TYR   4  -1.645   5.005   4.742
   39    HD2  TYR   4           HD2      TYR   4  -0.864   2.777   8.275
   40    HE1  TYR   4           HE1      TYR   4  -0.169   6.799   5.539
   41    HE2  TYR   4           HE2      TYR   4   0.630   4.557   9.074
   42    HH   TYR   4           HH       TYR   4   1.863   6.410   8.328
   43    H    ASP   5           H        ASP   5  -1.746  -0.112   5.668
   44    HA   ASP   5           HA       ASP   5   1.027  -0.312   5.963
   45   1HB   ASP   5          2HB       ASP   5  -1.176  -2.364   5.910
   46   2HB   ASP   5          1HB       ASP   5   0.504  -2.811   6.166
   47    H    ALA   6           H        ALA   6  -1.116  -1.646   3.487
   48    HA   ALA   6           HA       ALA   6   0.775  -3.050   2.002
   49   1HB   ALA   6          1HB       ALA   6  -1.674  -1.637   0.951
   50   2HB   ALA   6          2HB       ALA   6  -1.652  -3.242   1.679
   51   3HB   ALA   6          3HB       ALA   6  -0.804  -2.954   0.160
   52    H    ILE   7           H        ILE   7  -0.268   0.335   1.678
   53    HA   ILE   7           HA       ILE   7   1.368   0.910  -0.568
   54    HB   ILE   7           HB       ILE   7   0.276   2.842   1.493
   55   1HG1  ILE   7          2HG1      ILE   7  -0.839   2.032  -1.201
   56   2HG1  ILE   7          1HG1      ILE   7  -1.460   1.484   0.353
   57   1HG2  ILE   7          1HG2      ILE   7   2.075   3.841   0.223
   58   2HG2  ILE   7          2HG2      ILE   7   0.534   4.517  -0.309
   59   3HG2  ILE   7          3HG2      ILE   7   1.347   3.296  -1.288
   60   1HD1  ILE   7          1HD1      ILE   7  -1.399   4.337  -0.605
   61   2HD1  ILE   7          2HD1      ILE   7  -2.059   3.766   0.929
   62   3HD1  ILE   7          3HD1      ILE   7  -2.810   3.278  -0.588
   63    H    MET   8           H        MET   8   1.822   1.387   2.917
   64    HA   MET   8           HA       MET   8   4.261   2.804   2.702
   65   1HB   MET   8          2HB       MET   8   3.020   1.249   4.966
   66   2HB   MET   8          1HB       MET   8   4.537   2.116   5.133
   67   1HG   MET   8          2HG       MET   8   2.151   3.579   4.122
   68   2HG   MET   8          1HG       MET   8   2.258   3.195   5.837
   69   1HE   MET   8          1HE       MET   8   5.099   6.017   3.533
   70   2HE   MET   8          2HE       MET   8   3.688   5.205   2.854
   71   3HE   MET   8          3HE       MET   8   5.141   4.280   3.233
   72    H    TYR   9           H        TYR   9   3.502  -0.586   2.696
   73    HA   TYR   9           HA       TYR   9   6.163  -1.475   3.273
   74   1HB   TYR   9          2HB       TYR   9   4.269  -2.902   3.778
   75   2HB   TYR   9          1HB       TYR   9   3.781  -2.915   2.089
   76    HD1  TYR   9           HD1      TYR   9   4.306  -4.812   0.879
   77    HD2  TYR   9           HD2      TYR   9   6.820  -3.719   4.136
   78    HE1  TYR   9           HE1      TYR   9   5.645  -6.843   0.520
   79    HE2  TYR   9           HE2      TYR   9   8.167  -5.748   3.783
   80    HH   TYR   9           HH       TYR   9   7.771  -7.758   0.979
   81    H    LYS  10           H        LYS  10   4.263  -0.995   0.329
   82    HA   LYS  10           HA       LYS  10   6.389  -2.062  -1.320
   83   1HB   LYS  10          2HB       LYS  10   3.757  -2.135  -1.641
   84   2HB   LYS  10          1HB       LYS  10   4.045  -0.614  -2.472
   85   1HG   LYS  10          2HG       LYS  10   5.524  -3.133  -3.173
   86   2HG   LYS  10          1HG       LYS  10   3.969  -2.711  -3.889
   87   1HD   LYS  10          2HD       LYS  10   4.948  -0.608  -4.711
   88   2HD   LYS  10          1HD       LYS  10   6.504  -1.078  -4.022
   89   1HE   LYS  10          2HE       LYS  10   6.644  -2.975  -5.493
   90   2HE   LYS  10          1HE       LYS  10   5.009  -2.685  -6.090
   91   1HZ   LYS  10          1HZ       LYS  10   7.249  -0.760  -6.405
   92   2HZ   LYS  10          2HZ       LYS  10   5.716  -0.675  -7.129
   93   3HZ   LYS  10          3HZ       LYS  10   6.806  -1.891  -7.588
   94    H    TYR  11           H        TYR  11   5.056   1.095  -0.485
   95    HA   TYR  11           HA       TYR  11   7.308   2.329  -1.924
   96   1HB   TYR  11          2HB       TYR  11   4.476   3.390  -1.758
   97   2HB   TYR  11          1HB       TYR  11   5.840   4.259  -2.448
   98    HD1  TYR  11           HD1      TYR  11   7.005   3.239  -4.469
   99    HD2  TYR  11           HD2      TYR  11   3.221   1.904  -3.066
  100    HE1  TYR  11           HE1      TYR  11   6.577   2.184  -6.646
  101    HE2  TYR  11           HE2      TYR  11   2.782   0.841  -5.241
  102    HH   TYR  11           HH       TYR  11   3.502   0.987  -7.557
  103    HA   PRO  12           HA       PRO  12   7.552   3.707   2.456
  104   1HB   PRO  12          2HB       PRO  12  10.248   3.696   2.593
  105   2HB   PRO  12          1HB       PRO  12   9.289   2.227   2.788
  106   1HG   PRO  12          2HG       PRO  12  10.761   3.216   0.378
  107   2HG   PRO  12          1HG       PRO  12  10.678   1.573   1.040
  108   1HD   PRO  12          2HD       PRO  12   9.183   2.404  -1.077
  109   2HD   PRO  12          1HD       PRO  12   8.650   1.145   0.056
  110    H    ASN  13           H        ASN  13   8.880   4.859  -0.505
  111    HA   ASN  13           HA       ASN  13   9.812   7.362   0.598
  112   1HB   ASN  13          2HB       ASN  13   9.712   6.291  -2.225
  113   2HB   ASN  13          1HB       ASN  13  10.343   7.874  -1.803
  114   1HD2  ASN  13          1HD2      ASN  13  11.650   5.534  -3.008
  115   2HD2  ASN  13          2HD2      ASN  13  13.000   5.180  -1.988
  116    H    ALA  14           H        ALA  14   6.852   6.248   0.073
  117    HA   ALA  14           HA       ALA  14   5.753   8.645  -1.175
  118   1HB   ALA  14          1HB       ALA  14   4.813   6.465  -1.805
  119   2HB   ALA  14          2HB       ALA  14   3.605   7.495  -1.035
  120   3HB   ALA  14          3HB       ALA  14   4.353   6.184  -0.124
  121    H    VAL  15           H        VAL  15   4.868  10.283  -0.029
  122    HA   VAL  15           HA       VAL  15   5.177  10.153   2.860
  123    HB   VAL  15           HB       VAL  15   4.433  12.551   1.182
  124   1HG1  VAL  15          1HG1      VAL  15   3.884  12.767   3.541
  125   2HG1  VAL  15          2HG1      VAL  15   5.224  13.828   3.107
  126   3HG1  VAL  15          3HG1      VAL  15   5.537  12.327   3.976
  127   1HG2  VAL  15          1HG2      VAL  15   6.593  11.660   0.463
  128   2HG2  VAL  15          2HG2      VAL  15   7.164  11.682   2.132
  129   3HG2  VAL  15          3HG2      VAL  15   6.787  13.195   1.306
  130    H    SER  16           H        SER  16   3.517   9.378   3.958
  131    HA   SER  16           HA       SER  16   0.799   9.712   3.093
  132   1HB   SER  16          2HB       SER  16   0.310   8.590   5.306
  133   2HB   SER  16          1HB       SER  16   1.329   7.666   4.205
  134    HG   SER  16           HG       SER  16   1.978   7.898   6.536
  135    H    ARG  17           H        ARG  17  -0.852  10.654   4.559
  136    HA   ARG  17           HA       ARG  17  -1.740  12.431   5.664
  137   1HB   ARG  17          2HB       ARG  17   0.961  12.398   7.018
  138   2HB   ARG  17          1HB       ARG  17  -0.356  13.464   7.502
  139   1HG   ARG  17          2HG       ARG  17  -1.738  11.580   8.070
  140   2HG   ARG  17          1HG       ARG  17  -0.531  10.459   7.442
  141   1HD   ARG  17          2HD       ARG  17  -0.011  12.360   9.720
  142   2HD   ARG  17          1HD       ARG  17  -0.585  10.708   9.943
  143    HE   ARG  17           HE       ARG  17   1.896  11.125   8.437
  144   1HH1  ARG  17          1HH1      ARG  17   0.282  10.102  11.368
  145   2HH1  ARG  17          2HH1      ARG  17   1.656   9.227  11.980
  146   1HH2  ARG  17          1HH2      ARG  17   3.706  10.007   9.219
  147   2HH2  ARG  17          2HH2      ARG  17   3.628   9.176  10.749
  148    H    LYS  18           H        LYS  18  -0.134  12.648   3.204
  149    HA   LYS  18           HA       LYS  18  -0.064  15.553   3.054
  150   1HB   LYS  18          2HB       LYS  18   2.269  15.035   3.486
  151   2HB   LYS  18          1HB       LYS  18   2.247  13.754   2.280
  152   1HG   LYS  18          2HG       LYS  18   1.630  15.670   0.634
  153   2HG   LYS  18          1HG       LYS  18   2.293  16.715   1.892
  154   1HD   LYS  18          2HD       LYS  18   4.420  15.611   1.778
  155   2HD   LYS  18          1HD       LYS  18   3.775  14.372   0.701
  156   1HE   LYS  18          2HE       LYS  18   3.276  16.218  -0.934
  157   2HE   LYS  18          1HE       LYS  18   4.211  17.288   0.108
  158   1HZ   LYS  18          1HZ       LYS  18   5.599  16.461  -1.647
  159   2HZ   LYS  18          2HZ       LYS  18   5.207  14.855  -1.275
  160   3HZ   LYS  18          3HZ       LYS  18   6.118  15.776  -0.184
  161    H    ASP  19           H        ASP  19   0.962  12.800   1.053
  162    HA   ASP  19           HA       ASP  19  -0.641  13.810  -1.143
  163   1HB   ASP  19          2HB       ASP  19   1.276  11.481  -0.957
  164   2HB   ASP  19          1HB       ASP  19   0.400  11.919  -2.420
  165    H    PHE  20           H        PHE  20  -0.352  10.749   0.691
  166    HA   PHE  20           HA       PHE  20  -3.123  10.212  -0.115
  167   1HB   PHE  20          2HB       PHE  20  -2.681   7.832  -0.075
  168   2HB   PHE  20          1HB       PHE  20  -1.544   8.630  -1.149
  169    HD1  PHE  20           HD1      PHE  20   0.824   8.963  -0.398
  170    HD2  PHE  20           HD2      PHE  20  -1.955   6.573   1.772
  171    HE1  PHE  20           HE1      PHE  20   2.686   7.853   0.767
  172    HE2  PHE  20           HE2      PHE  20  -0.097   5.476   2.952
  173    HZ   PHE  20           HZ       PHE  20   2.227   6.112   2.446
  174    H    GLU  21           H        GLU  21  -4.582   9.975   1.390
  175    HA   GLU  21           HA       GLU  21  -3.739   9.340   4.124
  176   1HB   GLU  21          2HB       GLU  21  -5.632  11.489   3.208
  177   2HB   GLU  21          1HB       GLU  21  -5.725  10.810   4.819
  178   1HG   GLU  21          2HG       GLU  21  -4.341  12.486   5.353
  179   2HG   GLU  21          1HG       GLU  21  -3.099  11.420   4.699
  180    H    LEU  22           H        LEU  22  -5.579   8.530   5.452
  181    HA   LEU  22           HA       LEU  22  -6.955   6.514   3.849
  182   1HB   LEU  22          2HB       LEU  22  -6.621   6.632   6.834
  183   2HB   LEU  22          1HB       LEU  22  -7.184   5.269   5.893
  184    HG   LEU  22           HG       LEU  22  -4.396   6.407   5.743
  185   1HD1  LEU  22          1HD1      LEU  22  -5.389   3.914   7.119
  186   2HD1  LEU  22          2HD1      LEU  22  -4.916   5.403   7.936
  187   3HD1  LEU  22          3HD1      LEU  22  -3.718   4.475   7.036
  188   1HD2  LEU  22          1HD2      LEU  22  -5.109   5.305   3.687
  189   2HD2  LEU  22          2HD2      LEU  22  -5.618   3.890   4.608
  190   3HD2  LEU  22          3HD2      LEU  22  -3.911   4.324   4.531
  191    H    ARG  23           H        ARG  23  -9.092   5.977   4.177
  192    HA   ARG  23           HA       ARG  23 -10.700   7.724   5.904
  193   1HB   ARG  23          2HB       ARG  23 -10.797   8.000   3.227
  194   2HB   ARG  23          1HB       ARG  23 -11.970   6.709   3.426
  195   1HG   ARG  23          2HG       ARG  23 -13.209   8.698   3.466
  196   2HG   ARG  23          1HG       ARG  23 -13.087   8.192   5.151
  197   1HD   ARG  23          2HD       ARG  23 -11.318   9.762   5.558
  198   2HD   ARG  23          1HD       ARG  23 -11.242  10.183   3.850
  199    HE   ARG  23           HE       ARG  23 -13.752  10.677   5.266
  200   1HH1  ARG  23          1HH1      ARG  23 -10.810  11.948   3.847
  201   2HH1  ARG  23          2HH1      ARG  23 -11.379  13.587   3.803
  202   1HH2  ARG  23          1HH2      ARG  23 -14.506  12.834   5.207
  203   2HH2  ARG  23          2HH2      ARG  23 -13.481  14.090   4.587
  204    H    ASN  24           H        ASN  24 -12.691   6.642   6.638
  205    HA   ASN  24           HA       ASN  24 -12.137   3.807   6.974
  206   1HB   ASN  24          2HB       ASN  24 -12.684   5.183   8.955
  207   2HB   ASN  24          1HB       ASN  24 -14.279   5.498   8.276
  208   1HD2  ASN  24          1HD2      ASN  24 -15.268   4.528  10.066
  209   2HD2  ASN  24          2HD2      ASN  24 -15.286   2.816  10.268
  210    H    ASP  25           H        ASP  25 -13.011   2.334   5.751
  211    HA   ASP  25           HA       ASP  25 -15.397   2.923   4.171
  212   1HB   ASP  25          2HB       ASP  25 -13.562   1.863   2.994
  213   2HB   ASP  25          1HB       ASP  25 -13.485   0.577   4.191
  214    H    GLY  26           H        GLY  26 -14.405   1.281   6.999
  215   1HA   GLY  26          2HA       GLY  26 -16.112   0.563   8.580
  216   2HA   GLY  26          1HA       GLY  26 -17.044  -0.025   7.206
  217    H    ASN  27           H        ASN  27 -15.231  -1.393   5.751
  218    HA   ASN  27           HA       ASN  27 -14.669  -3.675   7.469
  219   1HB   ASN  27          2HB       ASN  27 -15.854  -3.931   5.273
  220   2HB   ASN  27          1HB       ASN  27 -14.373  -3.436   4.464
  221   1HD2  ASN  27          1HD2      ASN  27 -12.771  -4.909   4.160
  222   2HD2  ASN  27          2HD2      ASN  27 -12.877  -6.567   4.647
  223    H    GLY  28           H        GLY  28 -13.112  -0.967   6.516
  224   1HA   GLY  28          2HA       GLY  28 -10.669  -1.537   7.640
  225   2HA   GLY  28          1HA       GLY  28 -10.503  -1.940   5.934
  226    H    SER  29           H        SER  29  -8.849  -0.080   6.594
  227    HA   SER  29           HA       SER  29 -10.070   2.531   6.083
  228   1HB   SER  29          2HB       SER  29  -7.168   1.911   6.694
  229   2HB   SER  29          1HB       SER  29  -7.974   3.478   6.797
  230    HG   SER  29           HG       SER  29  -9.382   1.989   8.357
  231    H    TYR  30           H        TYR  30 -10.141   3.268   4.043
  232    HA   TYR  30           HA       TYR  30  -8.354   1.997   2.077
  233   1HB   TYR  30          2HB       TYR  30 -10.045   2.336   0.397
  234   2HB   TYR  30          1HB       TYR  30 -10.797   1.558   1.782
  235    HD1  TYR  30           HD1      TYR  30 -12.120   3.061   3.401
  236    HD2  TYR  30           HD2      TYR  30 -10.928   4.304  -0.484
  237    HE1  TYR  30           HE1      TYR  30 -13.851   4.806   3.434
  238    HE2  TYR  30           HE2      TYR  30 -12.647   6.060  -0.456
  239    HH   TYR  30           HH       TYR  30 -14.834   6.477   0.689
  240    H    ILE  31           H        ILE  31  -8.381   3.543  -0.012
  241    HA   ILE  31           HA       ILE  31  -6.973   5.928   0.905
  242    HB   ILE  31           HB       ILE  31  -7.236   4.908  -1.928
  243   1HG1  ILE  31          2HG1      ILE  31  -4.979   4.359   0.012
  244   2HG1  ILE  31          1HG1      ILE  31  -6.242   3.202  -0.379
  245   1HG2  ILE  31          1HG2      ILE  31  -5.182   6.208  -2.292
  246   2HG2  ILE  31          2HG2      ILE  31  -5.249   6.759  -0.618
  247   3HG2  ILE  31          3HG2      ILE  31  -6.522   7.218  -1.748
  248   1HD1  ILE  31          1HD1      ILE  31  -4.246   4.361  -2.300
  249   2HD1  ILE  31          2HD1      ILE  31  -5.536   3.237  -2.726
  250   3HD1  ILE  31          3HD1      ILE  31  -4.242   2.726  -1.641
  251    H    GLU  32           H        GLU  32  -7.935   7.851   0.930
  252    HA   GLU  32           HA       GLU  32 -10.096   8.350  -1.018
  253   1HB   GLU  32          2HB       GLU  32 -10.685   8.228   1.490
  254   2HB   GLU  32          1HB       GLU  32  -9.855   9.768   1.631
  255   1HG   GLU  32          2HG       GLU  32 -12.131   9.312  -0.273
  256   2HG   GLU  32          1HG       GLU  32 -12.369   9.828   1.394
  257    H    LYS  33           H        LYS  33  -7.678   9.990   1.018
  258    HA   LYS  33           HA       LYS  33  -7.355  12.139  -0.869
  259   1HB   LYS  33          2HB       LYS  33  -6.247  11.411   1.773
  260   2HB   LYS  33          1HB       LYS  33  -5.154  12.298   0.722
  261   1HG   LYS  33          2HG       LYS  33  -7.934  13.254   1.330
  262   2HG   LYS  33          1HG       LYS  33  -6.542  13.657   2.326
  263   1HD   LYS  33          2HD       LYS  33  -6.454  14.124  -0.609
  264   2HD   LYS  33          1HD       LYS  33  -7.299  15.264   0.434
  265   1HE   LYS  33          2HE       LYS  33  -5.088  16.077   0.154
  266   2HE   LYS  33          1HE       LYS  33  -5.198  15.442   1.790
  267   1HZ   LYS  33          1HZ       LYS  33  -4.025  13.949  -0.499
  268   2HZ   LYS  33          2HZ       LYS  33  -3.992  13.498   1.140
  269   3HZ   LYS  33          3HZ       LYS  33  -3.121  14.848   0.616
  270    H    TRP  34           H        TRP  34  -6.385  11.776  -2.753
  271    HA   TRP  34           HA       TRP  34  -3.831  10.333  -2.702
  272   1HB   TRP  34          2HB       TRP  34  -5.665   8.880  -3.635
  273   2HB   TRP  34          1HB       TRP  34  -5.893  10.071  -4.908
  274    HD1  TRP  34           HD1      TRP  34  -4.321   9.924  -6.984
  275    HE1  TRP  34           HE1      TRP  34  -2.416   8.336  -7.685
  276    HE3  TRP  34           HE3      TRP  34  -3.633   7.475  -2.547
  277    HZ2  TRP  34           HZ2      TRP  34  -0.835   6.327  -6.511
  278    HZ3  TRP  34           HZ3      TRP  34  -1.897   5.738  -2.419
  279    HH2  TRP  34           HH2      TRP  34  -0.526   5.175  -4.362
  280    H    ASN  35           H        ASN  35  -2.401  11.865  -3.117
  281    HA   ASN  35           HA       ASN  35  -3.013  13.859  -5.197
  282   1HB   ASN  35          2HB       ASN  35  -1.233  14.161  -2.765
  283   2HB   ASN  35          1HB       ASN  35  -1.446  15.370  -4.016
  284   1HD2  ASN  35          1HD2      ASN  35  -2.240  16.917  -2.662
  285   2HD2  ASN  35          2HD2      ASN  35  -3.796  16.821  -1.911
  286    H    LEU  36           H        LEU  36  -1.412  11.129  -4.792
  287    HA   LEU  36           HA       LEU  36   1.245  11.817  -5.589
  288   1HB   LEU  36          2HB       LEU  36  -0.241   9.204  -5.433
  289   2HB   LEU  36          1HB       LEU  36   1.397   9.313  -6.042
  290    HG   LEU  36           HG       LEU  36   0.558  10.163  -3.280
  291   1HD1  LEU  36          1HD1      LEU  36   1.961   7.657  -4.185
  292   2HD1  LEU  36          2HD1      LEU  36   0.314   7.754  -3.564
  293   3HD1  LEU  36          3HD1      LEU  36   1.677   8.134  -2.510
  294   1HD2  LEU  36          1HD2      LEU  36   2.519  11.345  -4.136
  295   2HD2  LEU  36          2HD2      LEU  36   3.283   9.804  -4.521
  296   3HD2  LEU  36          3HD2      LEU  36   2.958  10.232  -2.841
  297    H    ARG  37           H        ARG  37   2.180  11.727  -7.560
  298    HA   ARG  37           HA       ARG  37   0.457  11.966  -9.856
  299   1HB   ARG  37          2HB       ARG  37   3.456  12.096  -9.503
  300   2HB   ARG  37          1HB       ARG  37   2.651  12.329 -11.049
  301   1HG   ARG  37          2HG       ARG  37   1.627  14.318 -10.346
  302   2HG   ARG  37          1HG       ARG  37   1.968  13.988  -8.647
  303   1HD   ARG  37          2HD       ARG  37   3.432  15.732  -9.624
  304   2HD   ARG  37          1HD       ARG  37   4.319  14.348  -8.988
  305    HE   ARG  37           HE       ARG  37   3.712  14.324 -11.841
  306   1HH1  ARG  37          1HH1      ARG  37   6.035  15.044  -9.311
  307   2HH1  ARG  37          2HH1      ARG  37   7.414  14.919 -10.367
  308   1HH2  ARG  37          1HH2      ARG  37   5.525  14.166 -13.235
  309   2HH2  ARG  37          2HH2      ARG  37   7.127  14.389 -12.586
  310    H    ALA  38           H        ALA  38   0.069   9.502  -8.885
  311    HA   ALA  38           HA       ALA  38   1.163   7.761 -10.959
  312   1HB   ALA  38          1HB       ALA  38   1.708   6.004  -9.337
  313   2HB   ALA  38          2HB       ALA  38   1.299   7.098  -8.018
  314   3HB   ALA  38          3HB       ALA  38   2.676   7.452  -9.060
  315    HA   PRO  39           HA       PRO  39  -3.056   6.404 -10.927
  316   1HB   PRO  39          2HB       PRO  39  -2.805   4.044 -12.231
  317   2HB   PRO  39          1HB       PRO  39  -2.651   5.602 -13.051
  318   1HG   PRO  39          2HG       PRO  39  -0.514   3.744 -12.090
  319   2HG   PRO  39          1HG       PRO  39  -0.601   4.663 -13.604
  320   1HD   PRO  39          2HD       PRO  39   0.887   5.448 -11.462
  321   2HD   PRO  39          1HD       PRO  39   0.180   6.586 -12.626
  322    H    LEU  40           H        LEU  40  -4.471   4.909  -9.962
  323    HA   LEU  40           HA       LEU  40  -3.519   3.698  -7.577
  324   1HB   LEU  40          2HB       LEU  40  -6.170   3.816  -8.977
  325   2HB   LEU  40          1HB       LEU  40  -5.946   2.765  -7.601
  326    HG   LEU  40           HG       LEU  40  -6.965   4.788  -6.834
  327   1HD1  LEU  40          1HD1      LEU  40  -5.317   5.580  -5.202
  328   2HD1  LEU  40          2HD1      LEU  40  -4.043   4.760  -6.104
  329   3HD1  LEU  40          3HD1      LEU  40  -5.325   3.821  -5.338
  330   1HD2  LEU  40          1HD2      LEU  40  -6.328   6.248  -8.682
  331   2HD2  LEU  40          2HD2      LEU  40  -4.664   6.268  -8.099
  332   3HD2  LEU  40          3HD2      LEU  40  -5.948   6.982  -7.124
  333    HA   PRO  41           HA       PRO  41  -2.682  -0.394  -9.218
  334   1HB   PRO  41          2HB       PRO  41  -2.325  -1.647  -6.866
  335   2HB   PRO  41          1HB       PRO  41  -1.128  -0.518  -7.513
  336   1HG   PRO  41          2HG       PRO  41  -3.217  -0.071  -5.417
  337   2HG   PRO  41          1HG       PRO  41  -1.525   0.458  -5.441
  338   1HD   PRO  41          2HD       PRO  41  -3.621   2.081  -6.087
  339   2HD   PRO  41          1HD       PRO  41  -1.988   2.281  -6.751
  340    H    THR  42           H        THR  42  -3.437  -2.726  -8.431
  341    HA   THR  42           HA       THR  42  -6.373  -2.534  -8.454
  342    HB   THR  42           HB       THR  42  -6.299  -4.915  -9.230
  343    HG1  THR  42           HG1      THR  42  -3.494  -4.410  -9.492
  344   1HG2  THR  42          1HG2      THR  42  -6.510  -3.105 -10.844
  345   2HG2  THR  42          2HG2      THR  42  -5.492  -4.388 -11.499
  346   3HG2  THR  42          3HG2      THR  42  -4.757  -2.909 -10.880
  347    H    GLN  43           H        GLN  43  -7.564  -4.338  -7.331
  348    HA   GLN  43           HA       GLN  43  -7.022  -4.265  -4.575
  349   1HB   GLN  43          2HB       GLN  43  -9.233  -4.781  -5.828
  350   2HB   GLN  43          1HB       GLN  43  -8.653  -6.439  -5.853
  351   1HG   GLN  43          2HG       GLN  43  -8.363  -6.158  -3.317
  352   2HG   GLN  43          1HG       GLN  43  -9.404  -4.749  -3.502
  353   1HE2  GLN  43          1HE2      GLN  43  -9.211  -8.181  -3.462
  354   2HE2  GLN  43          2HE2      GLN  43 -10.910  -8.483  -3.591
  355    H    ALA  44           H        ALA  44  -6.572  -6.805  -6.993
  356    HA   ALA  44           HA       ALA  44  -5.530  -8.804  -5.362
  357   1HB   ALA  44          1HB       ALA  44  -6.145  -9.141  -7.716
  358   2HB   ALA  44          2HB       ALA  44  -4.522  -9.734  -7.367
  359   3HB   ALA  44          3HB       ALA  44  -4.737  -8.199  -8.210
  360    H    GLU  45           H        GLU  45  -3.823  -6.237  -7.109
  361    HA   GLU  45           HA       GLU  45  -1.229  -6.815  -6.290
  362   1HB   GLU  45          2HB       GLU  45  -2.653  -4.324  -7.133
  363   2HB   GLU  45          1HB       GLU  45  -0.999  -4.210  -6.573
  364   1HG   GLU  45          2HG       GLU  45  -0.282  -5.746  -8.314
  365   2HG   GLU  45          1HG       GLU  45  -1.954  -5.923  -8.850
  366    H    LEU  46           H        LEU  46  -3.582  -4.605  -4.803
  367    HA   LEU  46           HA       LEU  46  -2.066  -3.701  -2.674
  368   1HB   LEU  46          2HB       LEU  46  -5.027  -4.256  -2.809
  369   2HB   LEU  46          1HB       LEU  46  -4.246  -3.299  -1.572
  370    HG   LEU  46           HG       LEU  46  -4.142  -2.588  -4.493
  371   1HD1  LEU  46          1HD1      LEU  46  -6.456  -2.583  -3.817
  372   2HD1  LEU  46          2HD1      LEU  46  -5.879  -0.922  -3.968
  373   3HD1  LEU  46          3HD1      LEU  46  -6.064  -1.653  -2.373
  374   1HD2  LEU  46          1HD2      LEU  46  -3.531  -0.382  -3.630
  375   2HD2  LEU  46          2HD2      LEU  46  -2.380  -1.620  -3.127
  376   3HD2  LEU  46          3HD2      LEU  46  -3.580  -1.014  -1.984
  377    H    GLU  47           H        GLU  47  -4.266  -6.494  -2.780
  378    HA   GLU  47           HA       GLU  47  -3.844  -7.227  -0.091
  379   1HB   GLU  47          2HB       GLU  47  -4.887  -8.845  -2.409
  380   2HB   GLU  47          1HB       GLU  47  -4.915  -9.380  -0.733
  381   1HG   GLU  47          2HG       GLU  47  -6.273  -7.397  -0.171
  382   2HG   GLU  47          1HG       GLU  47  -6.321  -6.988  -1.882
  383    H    THR  48           H        THR  48  -2.202  -8.096  -3.074
  384    HA   THR  48           HA       THR  48  -0.761 -10.311  -2.032
  385    HB   THR  48           HB       THR  48   0.058  -8.459  -4.294
  386    HG1  THR  48           HG1      THR  48  -1.867  -9.280  -4.919
  387   1HG2  THR  48          1HG2      THR  48   1.867  -9.920  -3.508
  388   2HG2  THR  48          2HG2      THR  48   1.311 -10.398  -5.111
  389   3HG2  THR  48          3HG2      THR  48   0.815 -11.324  -3.695
  390    H    TRP  49           H        TRP  49  -0.082  -6.836  -2.152
  391    HA   TRP  49           HA       TRP  49   2.527  -7.022  -1.059
  392   1HB   TRP  49          2HB       TRP  49   0.546  -4.735  -0.996
  393   2HB   TRP  49          1HB       TRP  49   2.238  -4.610  -0.522
  394    HD1  TRP  49           HD1      TRP  49   3.446  -6.336  -2.962
  395    HE1  TRP  49           HE1      TRP  49   3.516  -5.288  -5.309
  396    HE3  TRP  49           HE3      TRP  49  -0.115  -2.724  -2.331
  397    HZ2  TRP  49           HZ2      TRP  49   2.227  -3.200  -6.706
  398    HZ3  TRP  49           HZ3      TRP  49  -0.634  -1.242  -4.223
  399    HH2  TRP  49           HH2      TRP  49   0.512  -1.473  -6.365
  400    H    TRP  50           H        TRP  50  -0.681  -6.648   0.374
  401    HA   TRP  50           HA       TRP  50   0.098  -6.473   3.066
  402   1HB   TRP  50          2HB       TRP  50  -2.192  -6.031   2.395
  403   2HB   TRP  50          1HB       TRP  50  -2.383  -7.681   1.813
  404    HD1  TRP  50           HD1      TRP  50  -3.357  -9.379   3.487
  405    HE1  TRP  50           HE1      TRP  50  -3.878  -9.371   6.011
  406    HE3  TRP  50           HE3      TRP  50  -1.198  -4.915   4.750
  407    HZ2  TRP  50           HZ2      TRP  50  -3.429  -7.691   8.237
  408    HZ3  TRP  50           HZ3      TRP  50  -1.288  -4.186   7.098
  409    HH2  TRP  50           HH2      TRP  50  -2.380  -5.546   8.800
  410    H    GLU  51           H        GLU  51  -0.591  -9.277   1.016
  411    HA   GLU  51           HA       GLU  51  -0.145 -11.281   2.909
  412   1HB   GLU  51          2HB       GLU  51   0.124 -11.203  -0.092
  413   2HB   GLU  51          1HB       GLU  51   0.298 -12.671   0.833
  414   1HG   GLU  51          2HG       GLU  51  -2.003 -12.250   1.750
  415   2HG   GLU  51          1HG       GLU  51  -2.142 -10.959   0.557
  416    H    GLU  52           H        GLU  52   2.091  -9.782   0.578
  417    HA   GLU  52           HA       GLU  52   4.345 -11.283   1.338
  418   1HB   GLU  52          2HB       GLU  52   4.077  -8.578   0.039
  419   2HB   GLU  52          1HB       GLU  52   5.637  -9.336   0.336
  420   1HG   GLU  52          2HG       GLU  52   4.971 -11.245  -1.026
  421   2HG   GLU  52          1HG       GLU  52   3.408 -10.486  -1.319
  422    H    LEU  53           H        LEU  53   3.107  -8.174   2.488
  423    HA   LEU  53           HA       LEU  53   5.161  -7.499   4.250
  424   1HB   LEU  53          2HB       LEU  53   3.478  -5.891   3.774
  425   2HB   LEU  53          1HB       LEU  53   2.199  -6.961   4.310
  426    HG   LEU  53           HG       LEU  53   3.060  -6.750   6.645
  427   1HD1  LEU  53          1HD1      LEU  53   4.610  -4.902   7.136
  428   2HD1  LEU  53          2HD1      LEU  53   4.855  -4.664   5.405
  429   3HD1  LEU  53          3HD1      LEU  53   5.366  -6.170   6.168
  430   1HD2  LEU  53          1HD2      LEU  53   2.203  -4.484   6.993
  431   2HD2  LEU  53          2HD2      LEU  53   1.201  -5.385   5.856
  432   3HD2  LEU  53          3HD2      LEU  53   2.330  -4.169   5.260
  433    H    GLN  54           H        GLN  54   2.321  -9.542   4.746
  434    HA   GLN  54           HA       GLN  54   2.805  -9.842   7.546
  435   1HB   GLN  54          2HB       GLN  54   0.598 -10.087   6.078
  436   2HB   GLN  54          1HB       GLN  54   1.090 -11.775   6.089
  437   1HG   GLN  54          2HG       GLN  54  -0.448 -11.357   7.889
  438   2HG   GLN  54          1HG       GLN  54   1.151 -11.730   8.538
  439   1HE2  GLN  54          1HE2      GLN  54   0.897 -10.689  10.459
  440   2HE2  GLN  54          2HE2      GLN  54   0.737  -8.973  10.610
  441    H    LYS  55           H        LYS  55   3.569 -11.677   4.660
  442    HA   LYS  55           HA       LYS  55   4.545 -13.950   6.163
  443   1HB   LYS  55          2HB       LYS  55   3.451 -14.164   3.927
  444   2HB   LYS  55          1HB       LYS  55   4.853 -13.370   3.220
  445   1HG   LYS  55          2HG       LYS  55   6.247 -15.224   4.208
  446   2HG   LYS  55          1HG       LYS  55   4.729 -16.048   4.574
  447   1HD   LYS  55          2HD       LYS  55   4.129 -16.070   2.236
  448   2HD   LYS  55          1HD       LYS  55   5.562 -15.125   1.832
  449   1HE   LYS  55          2HE       LYS  55   5.539 -17.909   2.988
  450   2HE   LYS  55          1HE       LYS  55   5.884 -17.489   1.312
  451   1HZ   LYS  55          1HZ       LYS  55   7.789 -16.148   2.178
  452   2HZ   LYS  55          2HZ       LYS  55   7.944 -17.820   2.412
  453   3HZ   LYS  55          3HZ       LYS  55   7.509 -16.821   3.710
  454    H    ASN  56           H        ASN  56   5.785 -10.972   5.530
  455    HA   ASN  56           HA       ASN  56   8.526 -11.871   5.011
  456   1HB   ASN  56          2HB       ASN  56   7.386  -9.949   3.722
  457   2HB   ASN  56          1HB       ASN  56   7.608  -9.002   5.178
  458   1HD2  ASN  56          1HD2      ASN  56   9.638  -8.361   5.754
  459   2HD2  ASN  56          2HD2      ASN  56  10.987  -8.469   4.679
  460    HA   PRO  57           HA       PRO  57   9.887 -11.199   9.242
  461   1HB   PRO  57          2HB       PRO  57  12.404 -10.373   7.893
  462   2HB   PRO  57          1HB       PRO  57  12.146 -11.598   9.138
  463   1HG   PRO  57          2HG       PRO  57  12.633 -12.301   6.619
  464   2HG   PRO  57          1HG       PRO  57  11.466 -13.202   7.608
  465   1HD   PRO  57          2HD       PRO  57  10.972 -11.172   5.465
  466   2HD   PRO  57          1HD       PRO  57  10.101 -12.679   5.810
  467    HA   PRO  58           HA       PRO  58   9.731  -6.806   9.888
  468   1HB   PRO  58          2HB       PRO  58  11.445  -6.459  11.973
  469   2HB   PRO  58          1HB       PRO  58   9.841  -7.178  12.153
  470   1HG   PRO  58          2HG       PRO  58  12.506  -8.517  11.949
  471   2HG   PRO  58          1HG       PRO  58  11.142  -8.890  13.020
  472   1HD   PRO  58          2HD       PRO  58  11.653 -10.313  10.776
  473   2HD   PRO  58          1HD       PRO  58  10.007 -10.049  11.382
  474    H    TYR  59           H        TYR  59  11.147  -4.830  10.135
  475    HA   TYR  59           HA       TYR  59  13.125  -4.795   8.072
  476   1HB   TYR  59          2HB       TYR  59  11.620  -2.879   8.692
  477   2HB   TYR  59          1HB       TYR  59  12.577  -2.662  10.149
  478    HD1  TYR  59           HD1      TYR  59  15.006  -1.985   9.910
  479    HD2  TYR  59           HD2      TYR  59  12.307  -1.991   6.621
  480    HE1  TYR  59           HE1      TYR  59  16.518  -0.494   8.672
  481    HE2  TYR  59           HE2      TYR  59  13.819  -0.504   5.373
  482    HH   TYR  59           HH       TYR  59  17.015   0.084   6.306
  483    H    GLU  60           H        GLU  60  14.930  -5.870   8.424
  484    HA   GLU  60           HA       GLU  60  16.021  -6.384  10.969
  485   1HB   GLU  60          2HB       GLU  60  17.233  -6.665   8.215
  486   2HB   GLU  60          1HB       GLU  60  17.917  -7.342   9.688
  487   1HG   GLU  60          2HG       GLU  60  15.982  -8.746   9.999
  488   2HG   GLU  60          1HG       GLU  60  15.179  -7.996   8.622
  Start of MODEL    3
    1   1H    MET   1          1H        MET   1  -9.385  -3.773   6.148
    2   2H    MET   1          2H        MET   1  -9.374  -5.238   5.303
    3   3H    MET   1          3H        MET   1  -8.904  -3.808   4.526
    4    HA   MET   1           HA       MET   1  -7.499  -5.074   6.806
    5   1HB   MET   1          2HB       MET   1  -5.737  -5.604   5.172
    6   2HB   MET   1          1HB       MET   1  -7.254  -6.389   4.765
    7   1HG   MET   1          2HG       MET   1  -7.690  -4.611   3.112
    8   2HG   MET   1          1HG       MET   1  -6.113  -3.921   3.486
    9   1HE   MET   1          1HE       MET   1  -5.625  -5.493  -0.083
   10   2HE   MET   1          2HE       MET   1  -5.599  -4.016   0.876
   11   3HE   MET   1          3HE       MET   1  -7.133  -4.817   0.528
   12    H    ILE   2           H        ILE   2  -5.333  -4.103   7.145
   13    HA   ILE   2           HA       ILE   2  -5.614  -1.242   7.195
   14    HB   ILE   2           HB       ILE   2  -3.287  -2.929   8.093
   15   1HG1  ILE   2          2HG1      ILE   2  -4.221  -2.180  10.409
   16   2HG1  ILE   2          1HG1      ILE   2  -5.719  -1.895   9.527
   17   1HG2  ILE   2          1HG2      ILE   2  -2.569  -0.957   9.342
   18   2HG2  ILE   2          2HG2      ILE   2  -3.898  -0.035   8.639
   19   3HG2  ILE   2          3HG2      ILE   2  -2.611  -0.655   7.605
   20   1HD1  ILE   2          1HD1      ILE   2  -5.757  -4.240   8.850
   21   2HD1  ILE   2          2HD1      ILE   2  -5.729  -4.065  10.603
   22   3HD1  ILE   2          3HD1      ILE   2  -4.260  -4.519   9.738
   23    H    LEU   3           H        LEU   3  -5.329  -0.246   5.356
   24    HA   LEU   3           HA       LEU   3  -3.551  -1.048   3.295
   25   1HB   LEU   3          2HB       LEU   3  -5.630   0.853   3.688
   26   2HB   LEU   3          1HB       LEU   3  -4.236   1.694   3.049
   27    HG   LEU   3           HG       LEU   3  -5.680   1.021   1.249
   28   1HD1  LEU   3          1HD1      LEU   3  -4.116  -0.284  -0.111
   29   2HD1  LEU   3          2HD1      LEU   3  -3.196  -0.682   1.341
   30   3HD1  LEU   3          3HD1      LEU   3  -3.295   0.992   0.790
   31   1HD2  LEU   3          1HD2      LEU   3  -5.338  -1.786   2.290
   32   2HD2  LEU   3          2HD2      LEU   3  -6.124  -1.349   0.773
   33   3HD2  LEU   3          3HD2      LEU   3  -6.823  -0.834   2.307
   34    H    TYR   4           H        TYR   4  -3.340   1.101   6.001
   35    HA   TYR   4           HA       TYR   4  -1.406   2.904   5.248
   36   1HB   TYR   4          2HB       TYR   4  -2.676   2.963   7.380
   37   2HB   TYR   4          1HB       TYR   4  -1.697   1.631   7.979
   38    HD1  TYR   4           HD1      TYR   4   0.678   1.999   8.553
   39    HD2  TYR   4           HD2      TYR   4  -1.827   5.210   7.320
   40    HE1  TYR   4           HE1      TYR   4   2.310   3.607   9.441
   41    HE2  TYR   4           HE2      TYR   4  -0.192   6.823   8.199
   42    HH   TYR   4           HH       TYR   4   2.944   6.032   8.972
   43    H    ASP   5           H        ASP   5  -0.840  -0.205   6.897
   44    HA   ASP   5           HA       ASP   5   1.970  -0.007   6.843
   45   1HB   ASP   5          2HB       ASP   5   0.037  -2.259   7.252
   46   2HB   ASP   5          1HB       ASP   5   1.752  -2.601   7.080
   47    H    ALA   6           H        ALA   6  -0.318  -1.582   4.672
   48    HA   ALA   6           HA       ALA   6   1.493  -2.836   2.955
   49   1HB   ALA   6          1HB       ALA   6  -1.230  -1.716   2.285
   50   2HB   ALA   6          2HB       ALA   6  -0.908  -3.306   2.979
   51   3HB   ALA   6          3HB       ALA   6  -0.342  -2.923   1.353
   52    H    ILE   7           H        ILE   7   0.088   0.428   2.787
   53    HA   ILE   7           HA       ILE   7   1.249   1.177   0.337
   54    HB   ILE   7           HB       ILE   7   0.521   2.935   2.689
   55   1HG1  ILE   7          2HG1      ILE   7  -1.073   2.276   0.201
   56   2HG1  ILE   7          1HG1      ILE   7  -1.331   1.540   1.779
   57   1HG2  ILE   7          1HG2      ILE   7   0.998   3.654  -0.203
   58   2HG2  ILE   7          2HG2      ILE   7   2.034   4.074   1.161
   59   3HG2  ILE   7          3HG2      ILE   7   0.409   4.752   1.045
   60   1HD1  ILE   7          1HD1      ILE   7  -1.890   3.709   2.716
   61   2HD1  ILE   7          2HD1      ILE   7  -2.934   3.315   1.351
   62   3HD1  ILE   7          3HD1      ILE   7  -1.612   4.461   1.150
   63    H    MET   8           H        MET   8   2.405   1.452   3.665
   64    HA   MET   8           HA       MET   8   4.772   2.886   3.078
   65   1HB   MET   8          2HB       MET   8   4.172   1.058   5.410
   66   2HB   MET   8          1HB       MET   8   5.536   2.162   5.317
   67   1HG   MET   8          2HG       MET   8   2.682   3.081   5.166
   68   2HG   MET   8          1HG       MET   8   3.557   2.910   6.684
   69   1HE   MET   8          1HE       MET   8   2.698   5.115   3.733
   70   2HE   MET   8          2HE       MET   8   4.208   4.529   3.042
   71   3HE   MET   8          3HE       MET   8   4.064   6.213   3.538
   72    H    TYR   9           H        TYR   9   3.919  -0.442   2.779
   73    HA   TYR   9           HA       TYR   9   6.559  -1.506   2.794
   74   1HB   TYR   9          2HB       TYR   9   4.703  -2.976   3.251
   75   2HB   TYR   9          1HB       TYR   9   3.955  -2.594   1.705
   76    HD1  TYR   9           HD1      TYR   9   7.036  -4.129   3.161
   77    HD2  TYR   9           HD2      TYR   9   4.341  -3.980  -0.137
   78    HE1  TYR   9           HE1      TYR   9   8.197  -6.038   2.127
   79    HE2  TYR   9           HE2      TYR   9   5.494  -5.887  -1.173
   80    HH   TYR   9           HH       TYR   9   7.622  -6.994  -1.132
   81    H    LYS  10           H        LYS  10   4.334  -0.528   0.190
   82    HA   LYS  10           HA       LYS  10   6.385  -1.115  -1.785
   83   1HB   LYS  10          2HB       LYS  10   3.965  -1.610  -2.207
   84   2HB   LYS  10          1HB       LYS  10   3.669   0.122  -2.255
   85   1HG   LYS  10          2HG       LYS  10   5.307   0.286  -4.128
   86   2HG   LYS  10          1HG       LYS  10   5.403  -1.474  -4.132
   87   1HD   LYS  10          2HD       LYS  10   2.986  -1.586  -4.571
   88   2HD   LYS  10          1HD       LYS  10   2.925   0.176  -4.604
   89   1HE   LYS  10          2HE       LYS  10   4.601   0.095  -6.480
   90   2HE   LYS  10          1HE       LYS  10   4.368  -1.654  -6.516
   91   1HZ   LYS  10          1HZ       LYS  10   2.951  -0.670  -8.145
   92   2HZ   LYS  10          2HZ       LYS  10   2.321   0.432  -7.026
   93   3HZ   LYS  10          3HZ       LYS  10   1.963  -1.220  -6.878
   94    H    TYR  11           H        TYR  11   4.756   1.731  -0.451
   95    HA   TYR  11           HA       TYR  11   6.733   3.404  -1.863
   96   1HB   TYR  11          2HB       TYR  11   3.994   4.286  -0.938
   97   2HB   TYR  11          1HB       TYR  11   5.126   5.202  -1.921
   98    HD1  TYR  11           HD1      TYR  11   5.762   4.058  -4.228
   99    HD2  TYR  11           HD2      TYR  11   2.264   3.172  -1.964
  100    HE1  TYR  11           HE1      TYR  11   4.667   3.200  -6.261
  101    HE2  TYR  11           HE2      TYR  11   1.165   2.306  -3.984
  102    HH   TYR  11           HH       TYR  11   1.371   2.634  -6.483
  103    HA   PRO  12           HA       PRO  12   7.602   3.906   2.641
  104   1HB   PRO  12          2HB       PRO  12  10.330   4.384   1.684
  105   2HB   PRO  12          1HB       PRO  12   9.741   3.188   2.835
  106   1HG   PRO  12          2HG       PRO  12  10.610   2.495   0.385
  107   2HG   PRO  12          1HG       PRO  12   9.295   1.628   1.200
  108   1HD   PRO  12          2HD       PRO  12   9.148   3.710  -0.948
  109   2HD   PRO  12          1HD       PRO  12   8.225   2.199  -0.780
  110    H    ASN  13           H        ASN  13   8.404   5.852  -0.150
  111    HA   ASN  13           HA       ASN  13   9.143   8.140   1.493
  112   1HB   ASN  13          2HB       ASN  13   9.225   7.609  -1.470
  113   2HB   ASN  13          1HB       ASN  13   9.529   9.202  -0.792
  114   1HD2  ASN  13          1HD2      ASN  13  11.295   7.394  -2.271
  115   2HD2  ASN  13          2HD2      ASN  13  12.665   7.134  -1.242
  116    H    ALA  14           H        ALA  14   6.276   6.965   0.888
  117    HA   ALA  14           HA       ALA  14   5.007   9.473   0.061
  118   1HB   ALA  14          1HB       ALA  14   3.802   6.762   0.619
  119   2HB   ALA  14          2HB       ALA  14   4.187   7.413  -0.972
  120   3HB   ALA  14          3HB       ALA  14   2.927   8.164   0.009
  121    H    VAL  15           H        VAL  15   3.975  10.809   1.468
  122    HA   VAL  15           HA       VAL  15   4.100  10.061   4.308
  123    HB   VAL  15           HB       VAL  15   3.706  12.797   3.085
  124   1HG1  VAL  15          1HG1      VAL  15   4.316  11.980   5.929
  125   2HG1  VAL  15          2HG1      VAL  15   2.774  12.602   5.339
  126   3HG1  VAL  15          3HG1      VAL  15   4.204  13.637   5.334
  127   1HG2  VAL  15          1HG2      VAL  15   5.906  11.921   2.539
  128   2HG2  VAL  15          2HG2      VAL  15   6.190  11.532   4.236
  129   3HG2  VAL  15          3HG2      VAL  15   6.035  13.215   3.733
  130    H    SER  16           H        SER  16   2.315   9.644   5.414
  131    HA   SER  16           HA       SER  16  -0.234   9.589   4.204
  132   1HB   SER  16          2HB       SER  16   0.391   9.451   7.161
  133   2HB   SER  16          1HB       SER  16  -1.033   8.815   6.340
  134    HG   SER  16           HG       SER  16   1.584   7.834   6.405
  135    H    ARG  17           H        ARG  17  -1.991  10.873   4.433
  136    HA   ARG  17           HA       ARG  17  -3.213  12.713   4.626
  137   1HB   ARG  17          2HB       ARG  17  -2.390  12.152   7.160
  138   2HB   ARG  17          1HB       ARG  17  -1.868  13.827   6.981
  139   1HG   ARG  17          2HG       ARG  17  -4.099  14.455   6.290
  140   2HG   ARG  17          1HG       ARG  17  -4.637  12.792   6.444
  141   1HD   ARG  17          2HD       ARG  17  -3.501  14.387   8.729
  142   2HD   ARG  17          1HD       ARG  17  -5.225  14.270   8.380
  143    HE   ARG  17           HE       ARG  17  -3.481  12.087   9.288
  144   1HH1  ARG  17          1HH1      ARG  17  -6.697  13.277   8.530
  145   2HH1  ARG  17          2HH1      ARG  17  -7.502  11.986   9.369
  146   1HH2  ARG  17          1HH2      ARG  17  -4.545  10.397  10.397
  147   2HH2  ARG  17          2HH2      ARG  17  -6.289  10.372  10.463
  148    H    LYS  18           H        LYS  18  -0.498  12.716   3.352
  149    HA   LYS  18           HA       LYS  18  -0.528  15.599   2.809
  150   1HB   LYS  18          2HB       LYS  18   1.496  15.234   4.099
  151   2HB   LYS  18          1HB       LYS  18   1.930  13.855   3.097
  152   1HG   LYS  18          2HG       LYS  18   2.058  15.457   1.148
  153   2HG   LYS  18          1HG       LYS  18   1.911  16.762   2.326
  154   1HD   LYS  18          2HD       LYS  18   3.935  16.075   3.423
  155   2HD   LYS  18          1HD       LYS  18   4.047  14.635   2.407
  156   1HE   LYS  18          2HE       LYS  18   4.230  17.500   1.467
  157   2HE   LYS  18          1HE       LYS  18   5.579  16.377   1.642
  158   1HZ   LYS  18          1HZ       LYS  18   3.313  16.166  -0.269
  159   2HZ   LYS  18          2HZ       LYS  18   4.455  14.940  -0.029
  160   3HZ   LYS  18          3HZ       LYS  18   4.944  16.445  -0.641
  161    H    ASP  19           H        ASP  19   0.973  12.588   1.655
  162    HA   ASP  19           HA       ASP  19   0.488  13.390  -1.099
  163   1HB   ASP  19          2HB       ASP  19   1.864  10.934   0.019
  164   2HB   ASP  19          1HB       ASP  19   1.835  11.412  -1.676
  165    H    PHE  20           H        PHE  20  -0.704  11.204   1.303
  166    HA   PHE  20           HA       PHE  20  -2.995  10.611  -0.367
  167   1HB   PHE  20          2HB       PHE  20  -2.852   8.191  -0.096
  168   2HB   PHE  20          1HB       PHE  20  -1.402   8.779  -0.900
  169    HD1  PHE  20           HD1      PHE  20  -2.751   7.146   2.038
  170    HD2  PHE  20           HD2      PHE  20   0.733   8.870   0.318
  171    HE1  PHE  20           HE1      PHE  20  -1.373   6.031   3.737
  172    HE2  PHE  20           HE2      PHE  20   2.124   7.756   2.018
  173    HZ   PHE  20           HZ       PHE  20   1.071   6.337   3.729
  174    H    GLU  21           H        GLU  21  -4.837  10.163   0.852
  175    HA   GLU  21           HA       GLU  21  -4.434  10.024   3.765
  176   1HB   GLU  21          2HB       GLU  21  -5.216  12.287   3.058
  177   2HB   GLU  21          1HB       GLU  21  -6.661  11.539   2.390
  178   1HG   GLU  21          2HG       GLU  21  -7.287  10.749   4.611
  179   2HG   GLU  21          1HG       GLU  21  -5.828  11.473   5.286
  180    H    LEU  22           H        LEU  22  -5.640   8.574   4.835
  181    HA   LEU  22           HA       LEU  22  -6.985   6.596   3.189
  182   1HB   LEU  22          2HB       LEU  22  -6.393   6.498   6.140
  183   2HB   LEU  22          1HB       LEU  22  -6.869   5.157   5.122
  184    HG   LEU  22           HG       LEU  22  -4.250   6.647   4.940
  185   1HD1  LEU  22          1HD1      LEU  22  -4.877   3.870   5.930
  186   2HD1  LEU  22          2HD1      LEU  22  -4.419   5.245   6.936
  187   3HD1  LEU  22          3HD1      LEU  22  -3.271   4.579   5.774
  188   1HD2  LEU  22          1HD2      LEU  22  -4.986   5.843   2.763
  189   2HD2  LEU  22          2HD2      LEU  22  -5.252   4.235   3.435
  190   3HD2  LEU  22          3HD2      LEU  22  -3.617   4.895   3.350
  191    H    ARG  23           H        ARG  23  -9.038   5.744   3.711
  192    HA   ARG  23           HA       ARG  23 -10.702   7.356   5.520
  193   1HB   ARG  23          2HB       ARG  23 -10.961   7.958   3.002
  194   2HB   ARG  23          1HB       ARG  23 -11.783   6.408   2.879
  195   1HG   ARG  23          2HG       ARG  23 -13.484   7.992   3.179
  196   2HG   ARG  23          1HG       ARG  23 -13.286   7.218   4.754
  197   1HD   ARG  23          2HD       ARG  23 -13.483   9.635   5.006
  198   2HD   ARG  23          1HD       ARG  23 -11.874   9.086   5.483
  199    HE   ARG  23           HE       ARG  23 -12.277  10.079   2.755
  200   1HH1  ARG  23          1HH1      ARG  23 -10.938  10.605   5.959
  201   2HH1  ARG  23          2HH1      ARG  23  -9.817  11.816   5.416
  202   1HH2  ARG  23          1HH2      ARG  23 -10.803  11.671   2.060
  203   2HH2  ARG  23          2HH2      ARG  23  -9.727  12.417   3.227
  204    H    ASN  24           H        ASN  24 -12.507   6.206   6.369
  205    HA   ASN  24           HA       ASN  24 -12.118   3.331   6.432
  206   1HB   ASN  24          2HB       ASN  24 -12.553   4.487   8.536
  207   2HB   ASN  24          1HB       ASN  24 -14.072   5.114   7.904
  208   1HD2  ASN  24          1HD2      ASN  24 -15.289   4.161   9.511
  209   2HD2  ASN  24          2HD2      ASN  24 -15.558   2.451   9.583
  210    H    ASP  25           H        ASP  25 -12.969   2.156   4.885
  211    HA   ASP  25           HA       ASP  25 -15.313   3.002   3.407
  212   1HB   ASP  25          2HB       ASP  25 -13.552   1.895   2.173
  213   2HB   ASP  25          1HB       ASP  25 -13.579   0.523   3.274
  214    H    GLY  26           H        GLY  26 -14.638   1.190   6.185
  215   1HA   GLY  26          2HA       GLY  26 -16.438   0.282   7.549
  216   2HA   GLY  26          1HA       GLY  26 -17.256  -0.172   6.052
  217    H    ASN  27           H        ASN  27 -15.179  -1.223   4.621
  218    HA   ASN  27           HA       ASN  27 -14.687  -3.762   5.873
  219   1HB   ASN  27          2HB       ASN  27 -14.003  -2.548   3.212
  220   2HB   ASN  27          1HB       ASN  27 -13.215  -4.035   3.725
  221   1HD2  ASN  27          1HD2      ASN  27 -15.104  -3.478   1.534
  222   2HD2  ASN  27          2HD2      ASN  27 -16.408  -4.598   1.763
  223    H    GLY  28           H        GLY  28 -13.268  -0.808   6.110
  224   1HA   GLY  28          2HA       GLY  28 -11.355  -1.094   7.845
  225   2HA   GLY  28          1HA       GLY  28 -10.545  -1.820   6.464
  226    H    SER  29           H        SER  29  -9.062   0.005   7.129
  227    HA   SER  29           HA       SER  29  -9.902   2.595   6.067
  228   1HB   SER  29          2HB       SER  29  -7.293   1.860   7.422
  229   2HB   SER  29          1HB       SER  29  -7.912   3.485   7.115
  230    HG   SER  29           HG       SER  29  -8.694   1.599   9.039
  231    H    TYR  30           H        TYR  30  -9.620   2.891   3.945
  232    HA   TYR  30           HA       TYR  30  -7.212   1.732   2.703
  233   1HB   TYR  30          2HB       TYR  30  -8.407   1.113   0.757
  234   2HB   TYR  30          1HB       TYR  30  -9.380   0.552   2.107
  235    HD1  TYR  30           HD1      TYR  30  -9.891   1.489  -0.973
  236    HD2  TYR  30           HD2      TYR  30 -10.831   3.013   2.885
  237    HE1  TYR  30           HE1      TYR  30 -11.818   2.680  -1.918
  238    HE2  TYR  30           HE2      TYR  30 -12.771   4.201   1.947
  239    HH   TYR  30           HH       TYR  30 -14.067   3.528  -1.016
  240    H    ILE  31           H        ILE  31  -7.221   2.817   0.259
  241    HA   ILE  31           HA       ILE  31  -6.487   5.546   0.862
  242    HB   ILE  31           HB       ILE  31  -6.392   4.144  -1.814
  243   1HG1  ILE  31          2HG1      ILE  31  -4.207   4.357   0.269
  244   2HG1  ILE  31          1HG1      ILE  31  -5.134   2.902  -0.066
  245   1HG2  ILE  31          1HG2      ILE  31  -4.897   6.542  -0.751
  246   2HG2  ILE  31          2HG2      ILE  31  -6.204   6.572  -1.934
  247   3HG2  ILE  31          3HG2      ILE  31  -4.669   5.803  -2.339
  248   1HD1  ILE  31          1HD1      ILE  31  -3.325   4.313  -2.010
  249   2HD1  ILE  31          2HD1      ILE  31  -4.240   2.840  -2.332
  250   3HD1  ILE  31          3HD1      ILE  31  -2.950   2.833  -1.128
  251    H    GLU  32           H        GLU  32  -7.631   7.308   0.433
  252    HA   GLU  32           HA       GLU  32  -9.768   7.152  -1.590
  253   1HB   GLU  32          2HB       GLU  32 -10.723   7.348   0.697
  254   2HB   GLU  32          1HB       GLU  32  -9.807   8.835   0.929
  255   1HG   GLU  32          2HG       GLU  32 -11.041   9.599  -1.232
  256   2HG   GLU  32          1HG       GLU  32 -12.173   8.316  -0.808
  257    H    LYS  33           H        LYS  33  -7.786   9.445   0.271
  258    HA   LYS  33           HA       LYS  33  -7.943  11.385  -1.895
  259   1HB   LYS  33          2HB       LYS  33  -8.059  11.721   0.743
  260   2HB   LYS  33          1HB       LYS  33  -6.315  11.816   0.570
  261   1HG   LYS  33          2HG       LYS  33  -8.184  13.533  -1.021
  262   2HG   LYS  33          1HG       LYS  33  -7.593  13.990   0.568
  263   1HD   LYS  33          2HD       LYS  33  -5.314  13.860  -0.241
  264   2HD   LYS  33          1HD       LYS  33  -5.900  13.382  -1.830
  265   1HE   LYS  33          2HE       LYS  33  -6.575  15.973  -0.455
  266   2HE   LYS  33          1HE       LYS  33  -5.313  15.789  -1.671
  267   1HZ   LYS  33          1HZ       LYS  33  -7.345  16.630  -2.648
  268   2HZ   LYS  33          2HZ       LYS  33  -8.215  15.285  -2.086
  269   3HZ   LYS  33          3HZ       LYS  33  -7.004  15.081  -3.252
  270    H    TRP  34           H        TRP  34  -6.357  11.701  -3.351
  271    HA   TRP  34           HA       TRP  34  -3.763  10.388  -2.908
  272   1HB   TRP  34          2HB       TRP  34  -5.422   8.949  -4.192
  273   2HB   TRP  34          1HB       TRP  34  -5.342  10.151  -5.469
  274    HD1  TRP  34           HD1      TRP  34  -3.634   9.670  -7.290
  275    HE1  TRP  34           HE1      TRP  34  -1.569   8.150  -7.533
  276    HE3  TRP  34           HE3      TRP  34  -3.346   7.935  -2.492
  277    HZ2  TRP  34           HZ2      TRP  34  -0.011   6.463  -5.892
  278    HZ3  TRP  34           HZ3      TRP  34  -1.537   6.371  -1.910
  279    HH2  TRP  34           HH2      TRP  34   0.094   5.651  -3.575
  280    H    ASN  35           H        ASN  35  -2.221  11.872  -3.173
  281    HA   ASN  35           HA       ASN  35  -2.721  14.115  -5.026
  282   1HB   ASN  35          2HB       ASN  35  -1.161  13.968  -2.452
  283   2HB   ASN  35          1HB       ASN  35  -0.930  15.277  -3.602
  284   1HD2  ASN  35          1HD2      ASN  35  -1.929  15.291  -0.846
  285   2HD2  ASN  35          2HD2      ASN  35  -3.483  16.062  -0.925
  286    H    LEU  36           H        LEU  36  -1.112  11.317  -4.980
  287    HA   LEU  36           HA       LEU  36   1.482  12.327  -5.832
  288   1HB   LEU  36          2HB       LEU  36   0.443   9.556  -5.298
  289   2HB   LEU  36          1HB       LEU  36   2.025   9.855  -5.985
  290    HG   LEU  36           HG       LEU  36   1.104  10.853  -3.302
  291   1HD1  LEU  36          1HD1      LEU  36   2.631   9.172  -2.387
  292   2HD1  LEU  36          2HD1      LEU  36   2.935   8.570  -4.019
  293   3HD1  LEU  36          3HD1      LEU  36   1.323   8.432  -3.313
  294   1HD2  LEU  36          1HD2      LEU  36   2.772  12.295  -4.336
  295   2HD2  LEU  36          2HD2      LEU  36   3.811  10.901  -4.628
  296   3HD2  LEU  36          3HD2      LEU  36   3.467  11.411  -2.976
  297    H    ARG  37           H        ARG  37   2.450  11.758  -7.823
  298    HA   ARG  37           HA       ARG  37   0.614  11.435 -10.047
  299   1HB   ARG  37          2HB       ARG  37   3.632  11.573 -10.086
  300   2HB   ARG  37          1HB       ARG  37   2.563  11.749 -11.465
  301   1HG   ARG  37          2HG       ARG  37   1.687  13.840 -10.456
  302   2HG   ARG  37          1HG       ARG  37   2.893  13.667  -9.170
  303   1HD   ARG  37          2HD       ARG  37   4.619  13.500 -11.026
  304   2HD   ARG  37          1HD       ARG  37   3.352  14.060 -12.112
  305    HE   ARG  37           HE       ARG  37   3.371  15.942 -10.168
  306   1HH1  ARG  37          1HH1      ARG  37   5.845  14.500 -12.189
  307   2HH1  ARG  37          2HH1      ARG  37   6.846  15.922 -12.198
  308   1HH2  ARG  37          1HH2      ARG  37   4.675  17.817 -10.194
  309   2HH2  ARG  37          2HH2      ARG  37   6.180  17.813 -11.071
  310    H    ALA  38           H        ALA  38   0.526   9.251  -8.433
  311    HA   ALA  38           HA       ALA  38   2.093   7.220  -9.874
  312   1HB   ALA  38          1HB       ALA  38   2.129   5.893  -7.817
  313   2HB   ALA  38          2HB       ALA  38   1.240   7.164  -6.979
  314   3HB   ALA  38          3HB       ALA  38   2.875   7.470  -7.561
  315    HA   PRO  39           HA       PRO  39  -1.793   5.462 -11.030
  316   1HB   PRO  39          2HB       PRO  39  -0.999   2.862 -11.328
  317   2HB   PRO  39          1HB       PRO  39  -0.687   4.125 -12.523
  318   1HG   PRO  39          2HG       PRO  39   1.130   3.014 -10.417
  319   2HG   PRO  39          1HG       PRO  39   1.488   3.424 -12.107
  320   1HD   PRO  39          2HD       PRO  39   2.167   5.052 -10.069
  321   2HD   PRO  39          1HD       PRO  39   1.663   5.686 -11.652
  322    H    LEU  40           H        LEU  40  -3.505   4.543 -10.009
  323    HA   LEU  40           HA       LEU  40  -3.218   3.672  -7.297
  324   1HB   LEU  40          2HB       LEU  40  -5.499   4.044  -9.197
  325   2HB   LEU  40          1HB       LEU  40  -5.746   3.098  -7.749
  326    HG   LEU  40           HG       LEU  40  -6.499   5.343  -7.368
  327   1HD1  LEU  40          1HD1      LEU  40  -3.890   4.817  -5.958
  328   2HD1  LEU  40          2HD1      LEU  40  -5.480   4.220  -5.484
  329   3HD1  LEU  40          3HD1      LEU  40  -5.133   5.948  -5.422
  330   1HD2  LEU  40          1HD2      LEU  40  -5.181   6.485  -9.065
  331   2HD2  LEU  40          2HD2      LEU  40  -3.716   6.223  -8.122
  332   3HD2  LEU  40          3HD2      LEU  40  -4.993   7.263  -7.492
  333    HA   PRO  41           HA       PRO  41  -2.335  -0.555  -8.339
  334   1HB   PRO  41          2HB       PRO  41  -2.762  -1.569  -5.830
  335   2HB   PRO  41          1HB       PRO  41  -1.281  -0.740  -6.315
  336   1HG   PRO  41          2HG       PRO  41  -3.649   0.332  -4.831
  337   2HG   PRO  41          1HG       PRO  41  -1.923   0.597  -4.522
  338   1HD   PRO  41          2HD       PRO  41  -3.418   2.437  -5.773
  339   2HD   PRO  41          1HD       PRO  41  -1.723   2.147  -6.225
  340    H    THR  42           H        THR  42  -3.401  -2.579  -8.427
  341    HA   THR  42           HA       THR  42  -6.257  -2.337  -8.735
  342    HB   THR  42           HB       THR  42  -6.116  -4.683  -9.544
  343    HG1  THR  42           HG1      THR  42  -3.822  -5.395  -9.887
  344   1HG2  THR  42          1HG2      THR  42  -5.824  -2.861 -11.129
  345   2HG2  THR  42          2HG2      THR  42  -4.778  -4.216 -11.554
  346   3HG2  THR  42          3HG2      THR  42  -4.102  -2.792 -10.756
  347    H    GLN  43           H        GLN  43  -7.646  -4.195  -7.896
  348    HA   GLN  43           HA       GLN  43  -7.589  -4.322  -5.082
  349   1HB   GLN  43          2HB       GLN  43  -9.584  -4.732  -6.544
  350   2HB   GLN  43          1HB       GLN  43  -8.896  -6.282  -6.978
  351   1HG   GLN  43          2HG       GLN  43 -10.620  -6.485  -5.258
  352   2HG   GLN  43          1HG       GLN  43  -9.044  -7.036  -4.691
  353   1HE2  GLN  43          1HE2      GLN  43  -7.983  -5.882  -3.082
  354   2HE2  GLN  43          2HE2      GLN  43  -8.773  -4.658  -2.146
  355    H    ALA  44           H        ALA  44  -6.618  -6.565  -7.581
  356    HA   ALA  44           HA       ALA  44  -5.697  -8.683  -6.045
  357   1HB   ALA  44          1HB       ALA  44  -4.528  -7.699  -8.644
  358   2HB   ALA  44          2HB       ALA  44  -5.939  -8.745  -8.491
  359   3HB   ALA  44          3HB       ALA  44  -4.357  -9.318  -7.962
  360    H    GLU  45           H        GLU  45  -3.848  -5.854  -7.237
  361    HA   GLU  45           HA       GLU  45  -1.405  -6.578  -6.111
  362   1HB   GLU  45          2HB       GLU  45  -2.039  -4.726  -7.837
  363   2HB   GLU  45          1HB       GLU  45  -2.229  -3.716  -6.409
  364   1HG   GLU  45          2HG       GLU  45   0.055  -4.396  -5.738
  365   2HG   GLU  45          1HG       GLU  45   0.228  -5.160  -7.311
  366    H    LEU  46           H        LEU  46  -4.013  -4.512  -4.876
  367    HA   LEU  46           HA       LEU  46  -2.886  -3.656  -2.513
  368   1HB   LEU  46          2HB       LEU  46  -5.734  -4.391  -3.156
  369   2HB   LEU  46          1HB       LEU  46  -5.258  -3.630  -1.656
  370    HG   LEU  46           HG       LEU  46  -4.840  -2.426  -4.386
  371   1HD1  LEU  46          1HD1      LEU  46  -6.658  -0.912  -3.789
  372   2HD1  LEU  46          2HD1      LEU  46  -6.910  -1.798  -2.286
  373   3HD1  LEU  46          3HD1      LEU  46  -7.211  -2.587  -3.834
  374   1HD2  LEU  46          1HD2      LEU  46  -4.345  -0.382  -3.131
  375   2HD2  LEU  46          2HD2      LEU  46  -3.206  -1.674  -2.750
  376   3HD2  LEU  46          3HD2      LEU  46  -4.501  -1.276  -1.618
  377    H    GLU  47           H        GLU  47  -4.742  -6.652  -3.050
  378    HA   GLU  47           HA       GLU  47  -4.441  -7.565  -0.382
  379   1HB   GLU  47          2HB       GLU  47  -5.108  -9.094  -2.899
  380   2HB   GLU  47          1HB       GLU  47  -5.233  -9.740  -1.266
  381   1HG   GLU  47          2HG       GLU  47  -6.857  -7.989  -0.715
  382   2HG   GLU  47          1HG       GLU  47  -6.755  -7.393  -2.366
  383    H    THR  48           H        THR  48  -2.522  -7.881  -3.279
  384    HA   THR  48           HA       THR  48  -0.785  -9.931  -2.377
  385    HB   THR  48           HB       THR  48  -0.212  -7.702  -4.353
  386    HG1  THR  48           HG1      THR  48  -2.027  -8.988  -4.956
  387   1HG2  THR  48          1HG2      THR  48   1.817  -8.860  -3.572
  388   2HG2  THR  48          2HG2      THR  48   1.473  -9.211  -5.265
  389   3HG2  THR  48          3HG2      THR  48   1.098 -10.406  -4.024
  390    H    TRP  49           H        TRP  49  -0.719  -6.384  -2.099
  391    HA   TRP  49           HA       TRP  49   1.772  -6.053  -0.883
  392   1HB   TRP  49          2HB       TRP  49  -0.822  -4.585  -0.362
  393   2HB   TRP  49          1HB       TRP  49   0.731  -4.081   0.281
  394    HD1  TRP  49           HD1      TRP  49   1.398  -5.189  -3.140
  395    HE1  TRP  49           HE1      TRP  49   1.425  -3.183  -4.761
  396    HE3  TRP  49           HE3      TRP  49  -0.739  -1.666  -0.114
  397    HZ2  TRP  49           HZ2      TRP  49   0.661  -0.470  -4.740
  398    HZ3  TRP  49           HZ3      TRP  49  -1.046   0.610  -0.989
  399    HH2  TRP  49           HH2      TRP  49  -0.360   1.196  -3.254
  400    H    TRP  50           H        TRP  50  -1.391  -6.612   0.610
  401    HA   TRP  50           HA       TRP  50  -0.534  -6.740   3.267
  402   1HB   TRP  50          2HB       TRP  50  -2.900  -6.524   2.590
  403   2HB   TRP  50          1HB       TRP  50  -2.876  -8.179   1.987
  404    HD1  TRP  50           HD1      TRP  50  -3.502 -10.023   3.665
  405    HE1  TRP  50           HE1      TRP  50  -3.961 -10.116   6.200
  406    HE3  TRP  50           HE3      TRP  50  -2.050  -5.290   4.913
  407    HZ2  TRP  50           HZ2      TRP  50  -3.732  -8.395   8.432
  408    HZ3  TRP  50           HZ3      TRP  50  -2.202  -4.588   7.267
  409    HH2  TRP  50           HH2      TRP  50  -3.026  -6.108   8.989
  410    H    GLU  51           H        GLU  51  -0.972  -9.339   0.879
  411    HA   GLU  51           HA       GLU  51  -0.255 -11.469   2.532
  412   1HB   GLU  51          2HB       GLU  51  -0.350 -10.993  -0.413
  413   2HB   GLU  51          1HB       GLU  51   0.391 -12.460   0.185
  414   1HG   GLU  51          2HG       GLU  51  -1.659 -13.065   1.338
  415   2HG   GLU  51          1HG       GLU  51  -2.405 -11.559   0.806
  416    H    GLU  52           H        GLU  52   1.759  -9.502   0.341
  417    HA   GLU  52           HA       GLU  52   4.161 -10.887   0.868
  418   1HB   GLU  52          2HB       GLU  52   3.595  -8.108  -0.137
  419   2HB   GLU  52          1HB       GLU  52   5.235  -8.701   0.079
  420   1HG   GLU  52          2HG       GLU  52   4.700 -10.573  -1.457
  421   2HG   GLU  52          1HG       GLU  52   3.124  -9.841  -1.733
  422    H    LEU  53           H        LEU  53   2.624  -8.112   2.412
  423    HA   LEU  53           HA       LEU  53   4.743  -7.438   4.143
  424   1HB   LEU  53          2HB       LEU  53   2.887  -5.936   3.687
  425   2HB   LEU  53          1HB       LEU  53   1.767  -7.049   4.447
  426    HG   LEU  53           HG       LEU  53   3.008  -6.699   6.601
  427   1HD1  LEU  53          1HD1      LEU  53   4.299  -4.455   5.055
  428   2HD1  LEU  53          2HD1      LEU  53   5.116  -5.895   5.662
  429   3HD1  LEU  53          3HD1      LEU  53   4.432  -4.726   6.792
  430   1HD2  LEU  53          1HD2      LEU  53   1.738  -4.301   5.290
  431   2HD2  LEU  53          2HD2      LEU  53   1.988  -4.505   7.024
  432   3HD2  LEU  53          3HD2      LEU  53   0.900  -5.590   6.156
  433    H    GLN  54           H        GLN  54   1.963  -9.596   4.545
  434    HA   GLN  54           HA       GLN  54   2.514 -10.181   7.272
  435   1HB   GLN  54          2HB       GLN  54   0.717 -11.410   5.201
  436   2HB   GLN  54          1HB       GLN  54   0.819 -12.021   6.838
  437   1HG   GLN  54          2HG       GLN  54   0.092  -9.191   6.150
  438   2HG   GLN  54          1HG       GLN  54  -1.085 -10.477   6.412
  439   1HE2  GLN  54          1HE2      GLN  54   1.269  -8.397   7.890
  440   2HE2  GLN  54          2HE2      GLN  54   0.813  -8.704   9.532
  441    H    LYS  55           H        LYS  55   3.434 -11.623   4.218
  442    HA   LYS  55           HA       LYS  55   4.259 -14.094   5.498
  443   1HB   LYS  55          2HB       LYS  55   3.086 -13.734   3.175
  444   2HB   LYS  55          1HB       LYS  55   4.734 -13.491   2.617
  445   1HG   LYS  55          2HG       LYS  55   5.347 -15.697   3.433
  446   2HG   LYS  55          1HG       LYS  55   3.704 -15.945   4.027
  447   1HD   LYS  55          2HD       LYS  55   2.904 -15.596   1.676
  448   2HD   LYS  55          1HD       LYS  55   4.594 -15.612   1.171
  449   1HE   LYS  55          2HE       LYS  55   3.156 -17.844   2.598
  450   2HE   LYS  55          1HE       LYS  55   3.543 -17.803   0.879
  451   1HZ   LYS  55          1HZ       LYS  55   5.531 -17.784   3.092
  452   2HZ   LYS  55          2HZ       LYS  55   5.889 -17.782   1.433
  453   3HZ   LYS  55          3HZ       LYS  55   5.130 -19.123   2.133
  454    H    ASN  56           H        ASN  56   5.651 -11.149   5.092
  455    HA   ASN  56           HA       ASN  56   8.353 -12.292   4.824
  456   1HB   ASN  56          2HB       ASN  56   7.255  -9.628   3.963
  457   2HB   ASN  56          1HB       ASN  56   8.981  -9.856   4.221
  458   1HD2  ASN  56          1HD2      ASN  56   9.435  -9.474   2.057
  459   2HD2  ASN  56          2HD2      ASN  56   9.084 -10.632   0.821
  460    HA   PRO  57           HA       PRO  57   9.323 -11.159   8.950
  461   1HB   PRO  57          2HB       PRO  57  11.929 -10.325   8.623
  462   2HB   PRO  57          1HB       PRO  57  11.424 -12.013   8.746
  463   1HG   PRO  57          2HG       PRO  57  12.054 -10.394   6.313
  464   2HG   PRO  57          1HG       PRO  57  12.454 -12.083   6.677
  465   1HD   PRO  57          2HD       PRO  57  10.431 -11.431   5.031
  466   2HD   PRO  57          1HD       PRO  57  10.336 -12.838   6.114
  467    HA   PRO  58           HA       PRO  58   8.396  -6.799   9.126
  468   1HB   PRO  58          2HB       PRO  58   9.146  -7.127  11.972
  469   2HB   PRO  58          1HB       PRO  58   7.635  -6.546  11.266
  470   1HG   PRO  58          2HG       PRO  58   7.783  -8.964  12.388
  471   2HG   PRO  58          1HG       PRO  58   6.808  -8.681  10.934
  472   1HD   PRO  58          2HD       PRO  58   9.507  -9.944  11.192
  473   2HD   PRO  58          1HD       PRO  58   8.141 -10.409  10.156
  474    H    TYR  59           H        TYR  59   9.447  -4.835   9.427
  475    HA   TYR  59           HA       TYR  59  12.240  -4.834   8.963
  476   1HB   TYR  59          2HB       TYR  59  10.599  -3.108   8.168
  477   2HB   TYR  59          1HB       TYR  59  10.504  -2.509   9.819
  478    HD1  TYR  59           HD1      TYR  59  11.979  -0.845  10.530
  479    HD2  TYR  59           HD2      TYR  59  12.939  -3.130   7.068
  480    HE1  TYR  59           HE1      TYR  59  13.888   0.640  10.085
  481    HE2  TYR  59           HE2      TYR  59  14.856  -1.658   6.620
  482    HH   TYR  59           HH       TYR  59  15.962   0.680   8.908
  483    H    GLU  60           H        GLU  60  13.890  -4.820  10.335
  484    HA   GLU  60           HA       GLU  60  13.599  -5.335  13.055
  485   1HB   GLU  60          2HB       GLU  60  15.575  -5.942  11.715
  486   2HB   GLU  60          1HB       GLU  60  16.019  -4.246  11.610
  487   1HG   GLU  60          2HG       GLU  60  16.373  -4.154  13.998
  488   2HG   GLU  60          1HG       GLU  60  15.835  -5.823  14.168
  Start of MODEL    4
    1   1H    MET   1          1H        MET   1  -8.379  -6.296   6.623
    2   2H    MET   1          2H        MET   1  -6.854  -6.541   7.330
    3   3H    MET   1          3H        MET   1  -7.472  -7.678   6.239
    4    HA   MET   1           HA       MET   1  -5.774  -6.311   5.209
    5   1HB   MET   1          2HB       MET   1  -7.589  -7.236   3.839
    6   2HB   MET   1          1HB       MET   1  -8.580  -5.825   4.180
    7   1HG   MET   1          2HG       MET   1  -6.929  -4.419   3.017
    8   2HG   MET   1          1HG       MET   1  -6.002  -5.870   2.631
    9   1HE   MET   1          1HE       MET   1  -7.068  -3.744   0.454
   10   2HE   MET   1          2HE       MET   1  -7.607  -4.839  -0.816
   11   3HE   MET   1          3HE       MET   1  -6.101  -5.161   0.044
   12    H    ILE   2           H        ILE   2  -4.745  -4.556   5.992
   13    HA   ILE   2           HA       ILE   2  -6.253  -2.023   6.031
   14    HB   ILE   2           HB       ILE   2  -3.833  -2.750   7.689
   15   1HG1  ILE   2          2HG1      ILE   2  -5.503  -2.083   9.566
   16   2HG1  ILE   2          1HG1      ILE   2  -6.743  -2.337   8.341
   17   1HG2  ILE   2          1HG2      ILE   2  -5.327  -0.138   7.541
   18   2HG2  ILE   2          2HG2      ILE   2  -3.697  -0.441   6.940
   19   3HG2  ILE   2          3HG2      ILE   2  -4.026  -0.517   8.672
   20   1HD1  ILE   2          1HD1      ILE   2  -4.763  -4.399   9.301
   21   2HD1  ILE   2          2HD1      ILE   2  -6.018  -4.649   8.086
   22   3HD1  ILE   2          3HD1      ILE   2  -6.465  -4.293   9.753
   23    H    LEU   3           H        LEU   3  -5.686  -0.627   4.514
   24    HA   LEU   3           HA       LEU   3  -3.678  -1.297   2.636
   25   1HB   LEU   3          2HB       LEU   3  -5.799   0.678   2.954
   26   2HB   LEU   3          1HB       LEU   3  -4.407   1.273   2.088
   27    HG   LEU   3           HG       LEU   3  -6.042   0.430   0.532
   28   1HD1  LEU   3          1HD1      LEU   3  -3.644  -1.370   0.777
   29   2HD1  LEU   3          2HD1      LEU   3  -3.745   0.146  -0.119
   30   3HD1  LEU   3          3HD1      LEU   3  -4.676  -1.255  -0.647
   31   1HD2  LEU   3          1HD2      LEU   3  -6.701  -1.924   0.513
   32   2HD2  LEU   3          2HD2      LEU   3  -7.194  -1.124   2.006
   33   3HD2  LEU   3          3HD2      LEU   3  -5.789  -2.190   1.999
   34    H    TYR   4           H        TYR   4  -3.856   0.968   5.289
   35    HA   TYR   4           HA       TYR   4  -1.830   2.736   4.674
   36   1HB   TYR   4          2HB       TYR   4  -3.368   2.856   6.653
   37   2HB   TYR   4          1HB       TYR   4  -2.385   1.625   7.433
   38    HD1  TYR   4           HD1      TYR   4  -0.255   2.182   8.414
   39    HD2  TYR   4           HD2      TYR   4  -2.481   5.113   6.291
   40    HE1  TYR   4           HE1      TYR   4   1.196   3.941   9.330
   41    HE2  TYR   4           HE2      TYR   4  -1.034   6.875   7.199
   42    HH   TYR   4           HH       TYR   4   0.433   7.223   9.149
   43    H    ASP   5           H        ASP   5  -1.554  -0.373   6.344
   44    HA   ASP   5           HA       ASP   5   1.249  -0.272   6.686
   45   1HB   ASP   5          2HB       ASP   5  -0.757  -2.516   6.742
   46   2HB   ASP   5          1HB       ASP   5   0.956  -2.793   7.006
   47    H    ALA   6           H        ALA   6  -0.803  -1.891   4.301
   48    HA   ALA   6           HA       ALA   6   1.191  -3.214   2.877
   49   1HB   ALA   6          1HB       ALA   6  -1.402  -2.127   1.784
   50   2HB   ALA   6          2HB       ALA   6  -1.208  -3.665   2.625
   51   3HB   ALA   6          3HB       ALA   6  -0.419  -3.406   1.070
   52    H    ILE   7           H        ILE   7  -0.234  -0.004   2.257
   53    HA   ILE   7           HA       ILE   7   1.259   0.565  -0.063
   54    HB   ILE   7           HB       ILE   7   0.100   2.512   1.945
   55   1HG1  ILE   7          2HG1      ILE   7  -1.057   1.568  -0.686
   56   2HG1  ILE   7          1HG1      ILE   7  -1.523   0.927   0.888
   57   1HG2  ILE   7          1HG2      ILE   7   0.216   4.164   0.169
   58   2HG2  ILE   7          2HG2      ILE   7   0.943   2.978  -0.916
   59   3HG2  ILE   7          3HG2      ILE   7   1.820   3.521   0.515
   60   1HD1  ILE   7          1HD1      ILE   7  -3.121   2.573   0.082
   61   2HD1  ILE   7          2HD1      ILE   7  -1.840   3.782  -0.014
   62   3HD1  ILE   7          3HD1      ILE   7  -2.321   3.129   1.552
   63    H    MET   8           H        MET   8   1.853   1.287   3.360
   64    HA   MET   8           HA       MET   8   4.185   2.845   2.816
   65   1HB   MET   8          2HB       MET   8   2.783   3.251   4.783
   66   2HB   MET   8          1HB       MET   8   3.194   1.663   5.413
   67   1HG   MET   8          2HG       MET   8   5.418   2.286   5.834
   68   2HG   MET   8          1HG       MET   8   5.280   3.738   4.841
   69   1HE   MET   8          1HE       MET   8   2.497   4.933   5.719
   70   2HE   MET   8          2HE       MET   8   3.969   5.885   5.521
   71   3HE   MET   8          3HE       MET   8   3.007   6.040   6.993
   72    H    TYR   9           H        TYR   9   3.573  -0.525   3.399
   73    HA   TYR   9           HA       TYR   9   6.210  -1.323   4.025
   74   1HB   TYR   9          2HB       TYR   9   4.470  -2.905   4.408
   75   2HB   TYR   9          1HB       TYR   9   3.884  -2.770   2.755
   76    HD1  TYR   9           HD1      TYR   9   4.470  -4.403   1.233
   77    HD2  TYR   9           HD2      TYR   9   6.942  -3.807   4.647
   78    HE1  TYR   9           HE1      TYR   9   5.831  -6.344   0.575
   79    HE2  TYR   9           HE2      TYR   9   8.310  -5.746   4.002
   80    HH   TYR   9           HH       TYR   9   7.998  -7.284   0.920
   81    H    LYS  10           H        LYS  10   4.479  -0.917   0.979
   82    HA   LYS  10           HA       LYS  10   6.722  -1.787  -0.599
   83   1HB   LYS  10          2HB       LYS  10   4.339  -2.104  -1.279
   84   2HB   LYS  10          1HB       LYS  10   4.209  -0.364  -1.491
   85   1HG   LYS  10          2HG       LYS  10   5.834  -0.405  -3.255
   86   2HG   LYS  10          1HG       LYS  10   6.145  -2.119  -2.983
   87   1HD   LYS  10          2HD       LYS  10   3.770  -2.579  -3.554
   88   2HD   LYS  10          1HD       LYS  10   3.580  -0.872  -3.958
   89   1HE   LYS  10          2HE       LYS  10   3.990  -2.251  -5.948
   90   2HE   LYS  10          1HE       LYS  10   5.265  -1.063  -5.688
   91   1HZ   LYS  10          1HZ       LYS  10   6.021  -3.364  -6.290
   92   2HZ   LYS  10          2HZ       LYS  10   5.488  -3.871  -4.760
   93   3HZ   LYS  10          3HZ       LYS  10   6.722  -2.714  -4.887
   94    H    TYR  11           H        TYR  11   5.157   1.308   0.143
   95    HA   TYR  11           HA       TYR  11   7.587   2.672  -0.826
   96   1HB   TYR  11          2HB       TYR  11   4.777   3.794  -0.858
   97   2HB   TYR  11          1HB       TYR  11   6.227   4.573  -1.478
   98    HD1  TYR  11           HD1      TYR  11   3.416   2.622  -2.319
   99    HD2  TYR  11           HD2      TYR  11   7.481   3.264  -3.378
  100    HE1  TYR  11           HE1      TYR  11   2.989   1.635  -4.528
  101    HE2  TYR  11           HE2      TYR  11   7.065   2.281  -5.595
  102    HH   TYR  11           HH       TYR  11   3.958   1.739  -6.820
  103    HA   PRO  12           HA       PRO  12   7.331   3.471   3.674
  104   1HB   PRO  12          2HB       PRO  12  10.187   4.082   3.313
  105   2HB   PRO  12          1HB       PRO  12   9.420   2.912   4.385
  106   1HG   PRO  12          2HG       PRO  12  10.815   2.130   2.234
  107   2HG   PRO  12          1HG       PRO  12   9.362   1.262   2.767
  108   1HD   PRO  12          2HD       PRO  12   9.677   3.251   0.544
  109   2HD   PRO  12          1HD       PRO  12   8.777   1.718   0.565
  110    H    ASN  13           H        ASN  13   8.569   5.403   1.085
  111    HA   ASN  13           HA       ASN  13   8.746   7.795   2.741
  112   1HB   ASN  13          2HB       ASN  13  10.492   7.092   1.007
  113   2HB   ASN  13          1HB       ASN  13   9.329   7.629  -0.189
  114   1HD2  ASN  13          1HD2      ASN  13  11.325   8.645   2.493
  115   2HD2  ASN  13          2HD2      ASN  13  11.337  10.329   2.100
  116    H    ALA  14           H        ALA  14   6.313   6.235   1.477
  117    HA   ALA  14           HA       ALA  14   4.937   8.387   0.118
  118   1HB   ALA  14          1HB       ALA  14   3.864   5.761   1.156
  119   2HB   ALA  14          2HB       ALA  14   4.449   6.068  -0.481
  120   3HB   ALA  14          3HB       ALA  14   3.008   6.892   0.108
  121    H    VAL  15           H        VAL  15   4.736  10.110   1.459
  122    HA   VAL  15           HA       VAL  15   4.152   9.784   4.246
  123    HB   VAL  15           HB       VAL  15   4.159  12.370   2.682
  124   1HG1  VAL  15          1HG1      VAL  15   4.597  11.803   5.612
  125   2HG1  VAL  15          2HG1      VAL  15   3.147  12.516   4.904
  126   3HG1  VAL  15          3HG1      VAL  15   4.680  13.386   4.843
  127   1HG2  VAL  15          1HG2      VAL  15   6.261  11.202   2.327
  128   2HG2  VAL  15          2HG2      VAL  15   6.447  10.984   4.068
  129   3HG2  VAL  15          3HG2      VAL  15   6.497  12.604   3.372
  130    H    SER  16           H        SER  16   2.190   9.225   4.874
  131    HA   SER  16           HA       SER  16  -0.216   9.778   3.508
  132   1HB   SER  16          2HB       SER  16   0.176   9.161   6.446
  133   2HB   SER  16          1HB       SER  16  -1.305   8.936   5.514
  134    HG   SER  16           HG       SER  16   0.563   7.647   4.209
  135    H    ARG  17           H        ARG  17  -1.912  11.212   4.112
  136    HA   ARG  17           HA       ARG  17  -2.889  13.145   4.808
  137   1HB   ARG  17          2HB       ARG  17  -0.484  13.426   6.615
  138   2HB   ARG  17          1HB       ARG  17  -1.861  14.517   6.615
  139   1HG   ARG  17          2HG       ARG  17  -3.321  12.781   7.373
  140   2HG   ARG  17          1HG       ARG  17  -2.052  11.569   7.184
  141   1HD   ARG  17          2HD       ARG  17  -0.735  12.643   8.913
  142   2HD   ARG  17          1HD       ARG  17  -1.937  13.922   9.064
  143    HE   ARG  17           HE       ARG  17  -3.491  12.181   9.866
  144   1HH1  ARG  17          1HH1      ARG  17  -0.069  11.424   9.881
  145   2HH1  ARG  17          2HH1      ARG  17  -0.167  10.408  11.292
  146   1HH2  ARG  17          1HH2      ARG  17  -3.625  10.855  11.723
  147   2HH2  ARG  17          2HH2      ARG  17  -2.190  10.075  12.335
  148    H    LYS  18           H        LYS  18   0.507  13.201   3.983
  149    HA   LYS  18           HA       LYS  18   0.488  15.925   3.042
  150   1HB   LYS  18          2HB       LYS  18   2.544  14.910   3.915
  151   2HB   LYS  18          1HB       LYS  18   2.492  13.683   2.657
  152   1HG   LYS  18          2HG       LYS  18   4.073  15.190   1.888
  153   2HG   LYS  18          1HG       LYS  18   2.614  15.655   1.015
  154   1HD   LYS  18          2HD       LYS  18   2.214  17.437   2.656
  155   2HD   LYS  18          1HD       LYS  18   3.691  16.974   3.506
  156   1HE   LYS  18          2HE       LYS  18   4.893  17.366   1.300
  157   2HE   LYS  18          1HE       LYS  18   3.411  18.148   0.754
  158   1HZ   LYS  18          1HZ       LYS  18   4.958  19.765   1.610
  159   2HZ   LYS  18          2HZ       LYS  18   5.053  18.955   3.091
  160   3HZ   LYS  18          3HZ       LYS  18   3.604  19.696   2.620
  161    H    ASP  19           H        ASP  19   0.935  12.772   1.443
  162    HA   ASP  19           HA       ASP  19   0.174  14.010  -1.106
  163   1HB   ASP  19          2HB       ASP  19   2.316  12.744  -0.945
  164   2HB   ASP  19          1HB       ASP  19   1.388  11.288  -0.598
  165    H    PHE  20           H        PHE  20  -0.520  11.141   0.855
  166    HA   PHE  20           HA       PHE  20  -3.157  11.041  -0.412
  167   1HB   PHE  20          2HB       PHE  20  -3.088   8.636  -0.552
  168   2HB   PHE  20          1HB       PHE  20  -1.666   9.278  -1.363
  169    HD1  PHE  20           HD1      PHE  20  -2.895   7.095   1.190
  170    HD2  PHE  20           HD2      PHE  20   0.541   9.233  -0.122
  171    HE1  PHE  20           HE1      PHE  20  -1.471   5.646   2.578
  172    HE2  PHE  20           HE2      PHE  20   1.969   7.786   1.263
  173    HZ   PHE  20           HZ       PHE  20   0.963   5.988   2.614
  174    H    GLU  21           H        GLU  21  -4.845  10.447   0.913
  175    HA   GLU  21           HA       GLU  21  -4.208   9.970   3.743
  176   1HB   GLU  21          2HB       GLU  21  -4.823  12.344   3.456
  177   2HB   GLU  21          1HB       GLU  21  -6.334  11.860   2.697
  178   1HG   GLU  21          2HG       GLU  21  -7.078  10.841   4.763
  179   2HG   GLU  21          1HG       GLU  21  -5.537  11.222   5.529
  180    H    LEU  22           H        LEU  22  -5.425   8.401   4.698
  181    HA   LEU  22           HA       LEU  22  -7.173   6.937   2.852
  182   1HB   LEU  22          2HB       LEU  22  -5.978   5.953   5.434
  183   2HB   LEU  22          1HB       LEU  22  -6.733   4.992   4.179
  184    HG   LEU  22           HG       LEU  22  -4.094   6.441   3.983
  185   1HD1  LEU  22          1HD1      LEU  22  -4.785   3.511   3.985
  186   2HD1  LEU  22          2HD1      LEU  22  -4.009   4.400   5.295
  187   3HD1  LEU  22          3HD1      LEU  22  -3.174   4.192   3.755
  188   1HD2  LEU  22          1HD2      LEU  22  -5.523   4.785   1.907
  189   2HD2  LEU  22          2HD2      LEU  22  -3.894   5.446   1.765
  190   3HD2  LEU  22          3HD2      LEU  22  -5.282   6.530   1.851
  191    H    ARG  23           H        ARG  23  -9.123   6.000   3.587
  192    HA   ARG  23           HA       ARG  23 -10.265   7.266   5.995
  193   1HB   ARG  23          2HB       ARG  23 -11.195   7.402   3.278
  194   2HB   ARG  23          1HB       ARG  23 -12.378   6.557   4.264
  195   1HG   ARG  23          2HG       ARG  23 -12.999   8.807   4.335
  196   2HG   ARG  23          1HG       ARG  23 -12.216   8.492   5.881
  197   1HD   ARG  23          2HD       ARG  23 -10.207   9.542   5.185
  198   2HD   ARG  23          1HD       ARG  23 -10.761   9.641   3.516
  199    HE   ARG  23           HE       ARG  23 -12.561  11.064   5.132
  200   1HH1  ARG  23          1HH1      ARG  23  -9.253  11.201   4.045
  201   2HH1  ARG  23          2HH1      ARG  23  -9.147  12.929   4.102
  202   1HH2  ARG  23          1HH2      ARG  23 -12.474  13.363   5.153
  203   2HH2  ARG  23          2HH2      ARG  23 -10.994  14.167   4.724
  204    H    ASN  24           H        ASN  24 -12.074   6.045   6.925
  205    HA   ASN  24           HA       ASN  24 -11.591   3.154   6.666
  206   1HB   ASN  24          2HB       ASN  24 -11.363   4.209   8.946
  207   2HB   ASN  24          1HB       ASN  24 -13.082   4.578   8.882
  208   1HD2  ASN  24          1HD2      ASN  24 -14.567   2.957   9.152
  209   2HD2  ASN  24          2HD2      ASN  24 -14.134   1.372   9.694
  210    H    ASP  25           H        ASP  25 -12.905   2.254   5.270
  211    HA   ASP  25           HA       ASP  25 -15.397   3.514   4.548
  212   1HB   ASP  25          2HB       ASP  25 -13.868   2.546   2.866
  213   2HB   ASP  25          1HB       ASP  25 -14.149   0.951   3.552
  214    H    GLY  26           H        GLY  26 -14.381   0.507   6.090
  215   1HA   GLY  26          2HA       GLY  26 -16.578   0.278   7.758
  216   2HA   GLY  26          1HA       GLY  26 -16.989  -0.602   6.293
  217    H    ASN  27           H        ASN  27 -14.911  -1.979   5.545
  218    HA   ASN  27           HA       ASN  27 -14.431  -3.739   7.833
  219   1HB   ASN  27          2HB       ASN  27 -14.278  -4.125   4.863
  220   2HB   ASN  27          1HB       ASN  27 -13.465  -5.249   5.947
  221   1HD2  ASN  27          1HD2      ASN  27 -14.774  -6.957   5.401
  222   2HD2  ASN  27          2HD2      ASN  27 -16.429  -7.062   5.912
  223    H    GLY  28           H        GLY  28 -12.881  -1.262   6.325
  224   1HA   GLY  28          2HA       GLY  28 -10.539  -1.511   7.813
  225   2HA   GLY  28          1HA       GLY  28 -10.215  -2.167   6.213
  226    H    SER  29           H        SER  29  -8.678  -0.186   6.708
  227    HA   SER  29           HA       SER  29  -9.932   2.253   5.675
  228   1HB   SER  29          2HB       SER  29  -7.713   3.278   6.455
  229   2HB   SER  29          1HB       SER  29  -8.810   2.713   7.715
  230    HG   SER  29           HG       SER  29  -6.955   1.783   8.310
  231    H    TYR  30           H        TYR  30  -9.406   3.001   3.673
  232    HA   TYR  30           HA       TYR  30  -6.920   2.139   2.463
  233   1HB   TYR  30          2HB       TYR  30  -7.967   1.416   0.357
  234   2HB   TYR  30          1HB       TYR  30  -8.398   0.384   1.710
  235    HD1  TYR  30           HD1      TYR  30 -10.680   0.219   2.464
  236    HD2  TYR  30           HD2      TYR  30  -9.637   2.881  -0.686
  237    HE1  TYR  30           HE1      TYR  30 -13.055   0.437   1.866
  238    HE2  TYR  30           HE2      TYR  30 -12.009   3.113  -1.287
  239    HH   TYR  30           HH       TYR  30 -14.518   2.178   0.682
  240    H    ILE  31           H        ILE  31  -7.260   3.044  -0.069
  241    HA   ILE  31           HA       ILE  31  -6.473   5.703   0.355
  242    HB   ILE  31           HB       ILE  31  -7.234   4.499  -2.304
  243   1HG1  ILE  31          2HG1      ILE  31  -4.573   4.306  -0.874
  244   2HG1  ILE  31          1HG1      ILE  31  -5.733   2.987  -1.000
  245   1HG2  ILE  31          1HG2      ILE  31  -5.222   6.608  -1.532
  246   2HG2  ILE  31          2HG2      ILE  31  -6.774   6.897  -2.320
  247   3HG2  ILE  31          3HG2      ILE  31  -5.507   6.002  -3.163
  248   1HD1  ILE  31          1HD1      ILE  31  -5.491   3.024  -3.436
  249   2HD1  ILE  31          2HD1      ILE  31  -3.956   2.731  -2.620
  250   3HD1  ILE  31          3HD1      ILE  31  -4.308   4.323  -3.293
  251    H    GLU  32           H        GLU  32  -7.569   7.503   0.494
  252    HA   GLU  32           HA       GLU  32 -10.176   7.734  -0.859
  253   1HB   GLU  32          2HB       GLU  32 -10.390   7.887   1.590
  254   2HB   GLU  32          1HB       GLU  32  -9.180   9.161   1.622
  255   1HG   GLU  32          2HG       GLU  32 -11.319  10.172   1.844
  256   2HG   GLU  32          1HG       GLU  32 -10.702  10.556   0.241
  257    H    LYS  33           H        LYS  33  -7.512   9.723   0.399
  258    HA   LYS  33           HA       LYS  33  -7.685  11.450  -1.960
  259   1HB   LYS  33          2HB       LYS  33  -7.625  12.452   0.342
  260   2HB   LYS  33          1HB       LYS  33  -6.023  11.767   0.553
  261   1HG   LYS  33          2HG       LYS  33  -5.715  14.037   0.004
  262   2HG   LYS  33          1HG       LYS  33  -5.308  13.122  -1.446
  263   1HD   LYS  33          2HD       LYS  33  -8.108  14.017  -1.179
  264   2HD   LYS  33          1HD       LYS  33  -6.900  15.260  -1.478
  265   1HE   LYS  33          2HE       LYS  33  -6.172  14.132  -3.480
  266   2HE   LYS  33          1HE       LYS  33  -7.249  12.776  -3.144
  267   1HZ   LYS  33          1HZ       LYS  33  -9.139  14.193  -3.460
  268   2HZ   LYS  33          2HZ       LYS  33  -8.133  14.320  -4.818
  269   3HZ   LYS  33          3HZ       LYS  33  -8.155  15.559  -3.662
  270    H    TRP  34           H        TRP  34  -6.227  11.222  -3.570
  271    HA   TRP  34           HA       TRP  34  -3.658   9.919  -3.001
  272   1HB   TRP  34          2HB       TRP  34  -5.200   8.176  -3.774
  273   2HB   TRP  34          1HB       TRP  34  -5.608   9.138  -5.186
  274    HD1  TRP  34           HD1      TRP  34  -3.925   9.081  -7.237
  275    HE1  TRP  34           HE1      TRP  34  -1.969   7.517  -7.837
  276    HE3  TRP  34           HE3      TRP  34  -3.238   6.852  -2.678
  277    HZ2  TRP  34           HZ2      TRP  34  -0.349   5.603  -6.549
  278    HZ3  TRP  34           HZ3      TRP  34  -1.459   5.167  -2.452
  279    HH2  TRP  34           HH2      TRP  34  -0.048   4.557  -4.347
  280    H    ASN  35           H        ASN  35  -2.208  11.484  -3.576
  281    HA   ASN  35           HA       ASN  35  -2.832  13.040  -5.989
  282   1HB   ASN  35          2HB       ASN  35  -1.124  13.672  -3.598
  283   2HB   ASN  35          1HB       ASN  35  -1.013  14.600  -5.090
  284   1HD2  ASN  35          1HD2      ASN  35  -1.876  15.398  -2.410
  285   2HD2  ASN  35          2HD2      ASN  35  -3.464  16.057  -2.607
  286    H    LEU  36           H        LEU  36  -0.851  10.586  -4.907
  287    HA   LEU  36           HA       LEU  36   1.558  11.008  -6.210
  288   1HB   LEU  36          2HB       LEU  36   0.048   8.466  -5.680
  289   2HB   LEU  36          1HB       LEU  36   1.610   8.468  -6.461
  290    HG   LEU  36           HG       LEU  36   1.093   9.571  -3.710
  291   1HD1  LEU  36          1HD1      LEU  36   2.339   6.958  -4.553
  292   2HD1  LEU  36          2HD1      LEU  36   0.783   7.155  -3.745
  293   3HD1  LEU  36          3HD1      LEU  36   2.274   7.582  -2.905
  294   1HD2  LEU  36          1HD2      LEU  36   3.650   9.047  -5.215
  295   2HD2  LEU  36          2HD2      LEU  36   3.536   9.576  -3.537
  296   3HD2  LEU  36          3HD2      LEU  36   2.969  10.630  -4.832
  297    H    ARG  37           H        ARG  37   2.235  10.943  -8.219
  298    HA   ARG  37           HA       ARG  37   0.301  10.809 -10.341
  299   1HB   ARG  37          2HB       ARG  37   3.268  11.338 -10.291
  300   2HB   ARG  37          1HB       ARG  37   2.336  11.272 -11.780
  301   1HG   ARG  37          2HG       ARG  37   0.998  13.139 -11.104
  302   2HG   ARG  37          1HG       ARG  37   1.744  13.145  -9.503
  303   1HD   ARG  37          2HD       ARG  37   3.848  13.801 -10.407
  304   2HD   ARG  37          1HD       ARG  37   3.284  13.547 -12.058
  305    HE   ARG  37           HE       ARG  37   1.771  15.459 -11.688
  306   1HH1  ARG  37          1HH1      ARG  37   4.542  15.091  -9.569
  307   2HH1  ARG  37          2HH1      ARG  37   4.646  16.794  -9.213
  308   1HH2  ARG  37          1HH2      ARG  37   1.933  17.685 -11.253
  309   2HH2  ARG  37          2HH2      ARG  37   3.176  18.267 -10.187
  310    H    ALA  38           H        ALA  38   0.004   8.479  -9.446
  311    HA   ALA  38           HA       ALA  38   1.206   6.742 -11.451
  312   1HB   ALA  38          1HB       ALA  38   2.623   6.420  -9.483
  313   2HB   ALA  38          2HB       ALA  38   1.660   4.974  -9.790
  314   3HB   ALA  38          3HB       ALA  38   1.199   6.083  -8.499
  315    HA   PRO  39           HA       PRO  39  -2.992   5.481 -11.954
  316   1HB   PRO  39          2HB       PRO  39  -2.509   2.810 -12.567
  317   2HB   PRO  39          1HB       PRO  39  -2.511   4.145 -13.723
  318   1HG   PRO  39          2HG       PRO  39  -0.214   2.818 -12.357
  319   2HG   PRO  39          1HG       PRO  39  -0.335   3.427 -14.019
  320   1HD   PRO  39          2HD       PRO  39   1.000   4.788 -12.138
  321   2HD   PRO  39          1HD       PRO  39   0.029   5.630 -13.365
  322    H    LEU  40           H        LEU  40  -4.552   4.766 -10.658
  323    HA   LEU  40           HA       LEU  40  -4.038   3.985  -8.041
  324   1HB   LEU  40          2HB       LEU  40  -6.466   4.045  -9.771
  325   2HB   LEU  40          1HB       LEU  40  -6.556   3.218  -8.236
  326    HG   LEU  40           HG       LEU  40  -7.401   5.475  -8.011
  327   1HD1  LEU  40          1HD1      LEU  40  -4.716   5.168  -6.677
  328   2HD1  LEU  40          2HD1      LEU  40  -6.249   4.519  -6.096
  329   3HD1  LEU  40          3HD1      LEU  40  -6.004   6.265  -6.174
  330   1HD2  LEU  40          1HD2      LEU  40  -4.682   6.376  -8.950
  331   2HD2  LEU  40          2HD2      LEU  40  -5.960   7.424  -8.336
  332   3HD2  LEU  40          3HD2      LEU  40  -6.197   6.534  -9.839
  333    HA   PRO  41           HA       PRO  41  -2.997  -0.310  -8.571
  334   1HB   PRO  41          2HB       PRO  41  -3.242  -0.920  -5.895
  335   2HB   PRO  41          1HB       PRO  41  -1.795  -0.233  -6.638
  336   1HG   PRO  41          2HG       PRO  41  -3.984   1.134  -5.129
  337   2HG   PRO  41          1HG       PRO  41  -2.231   1.408  -5.061
  338   1HD   PRO  41          2HD       PRO  41  -3.850   3.052  -6.427
  339   2HD   PRO  41          1HD       PRO  41  -2.226   2.649  -7.021
  340    H    THR  42           H        THR  42  -4.000  -2.380  -8.218
  341    HA   THR  42           HA       THR  42  -6.918  -2.072  -8.187
  342    HB   THR  42           HB       THR  42  -6.906  -4.362  -9.254
  343    HG1  THR  42           HG1      THR  42  -4.104  -3.788  -9.464
  344   1HG2  THR  42          1HG2      THR  42  -5.473  -2.121 -10.684
  345   2HG2  THR  42          2HG2      THR  42  -7.218  -2.356 -10.591
  346   3HG2  THR  42          3HG2      THR  42  -6.217  -3.513 -11.469
  347    H    GLN  43           H        GLN  43  -8.186  -3.877  -7.290
  348    HA   GLN  43           HA       GLN  43  -7.784  -4.202  -4.583
  349   1HB   GLN  43          2HB       GLN  43  -9.877  -4.589  -6.010
  350   2HB   GLN  43          1HB       GLN  43  -9.254  -6.200  -6.296
  351   1HG   GLN  43          2HG       GLN  43  -9.675  -5.156  -3.523
  352   2HG   GLN  43          1HG       GLN  43 -10.981  -5.895  -4.447
  353   1HE2  GLN  43          1HE2      GLN  43  -9.713  -6.755  -1.975
  354   2HE2  GLN  43          2HE2      GLN  43  -9.071  -8.340  -2.272
  355    H    ALA  44           H        ALA  44  -7.103  -6.538  -7.167
  356    HA   ALA  44           HA       ALA  44  -6.058  -8.597  -5.596
  357   1HB   ALA  44          1HB       ALA  44  -5.247  -7.852  -8.406
  358   2HB   ALA  44          2HB       ALA  44  -6.635  -8.851  -7.972
  359   3HB   ALA  44          3HB       ALA  44  -5.001  -9.414  -7.626
  360    H    GLU  45           H        GLU  45  -4.403  -5.885  -7.147
  361    HA   GLU  45           HA       GLU  45  -1.789  -6.522  -6.379
  362   1HB   GLU  45          2HB       GLU  45  -3.169  -3.947  -7.088
  363   2HB   GLU  45          1HB       GLU  45  -1.474  -3.962  -6.643
  364   1HG   GLU  45          2HG       GLU  45  -0.977  -5.463  -8.485
  365   2HG   GLU  45          1HG       GLU  45  -2.689  -5.534  -8.902
  366    H    LEU  46           H        LEU  46  -4.256  -4.554  -4.765
  367    HA   LEU  46           HA       LEU  46  -2.690  -3.569  -2.686
  368   1HB   LEU  46          2HB       LEU  46  -5.628  -4.243  -2.667
  369   2HB   LEU  46          1HB       LEU  46  -4.813  -3.225  -1.504
  370    HG   LEU  46           HG       LEU  46  -5.177  -2.635  -4.435
  371   1HD1  LEU  46          1HD1      LEU  46  -6.600  -0.814  -3.634
  372   2HD1  LEU  46          2HD1      LEU  46  -6.378  -1.372  -1.975
  373   3HD1  LEU  46          3HD1      LEU  46  -7.220  -2.389  -3.145
  374   1HD2  LEU  46          1HD2      LEU  46  -3.049  -1.768  -3.663
  375   2HD2  LEU  46          2HD2      LEU  46  -3.834  -1.011  -2.279
  376   3HD2  LEU  46          3HD2      LEU  46  -4.189  -0.447  -3.912
  377    H    GLU  47           H        GLU  47  -4.645  -6.544  -2.821
  378    HA   GLU  47           HA       GLU  47  -4.050  -7.285  -0.157
  379   1HB   GLU  47          2HB       GLU  47  -5.168  -8.791  -2.490
  380   2HB   GLU  47          1HB       GLU  47  -4.786  -9.610  -0.981
  381   1HG   GLU  47          2HG       GLU  47  -6.224  -7.829   0.140
  382   2HG   GLU  47          1HG       GLU  47  -6.807  -7.466  -1.482
  383    H    THR  48           H        THR  48  -2.473  -7.965  -3.236
  384    HA   THR  48           HA       THR  48  -0.765 -10.016  -2.326
  385    HB   THR  48           HB       THR  48  -0.212  -7.971  -4.493
  386    HG1  THR  48           HG1      THR  48  -1.754 -10.325  -4.387
  387   1HG2  THR  48          1HG2      THR  48   1.794  -9.199  -3.812
  388   2HG2  THR  48          2HG2      THR  48   1.271  -9.679  -5.426
  389   3HG2  THR  48          3HG2      THR  48   0.944 -10.728  -4.047
  390    H    TRP  49           H        TRP  49  -0.360  -6.476  -2.384
  391    HA   TRP  49           HA       TRP  49   2.288  -6.490  -1.380
  392   1HB   TRP  49          2HB       TRP  49   0.180  -4.323  -1.172
  393   2HB   TRP  49          1HB       TRP  49   1.903  -4.104  -0.885
  394    HD1  TRP  49           HD1      TRP  49   2.612  -6.038  -3.526
  395    HE1  TRP  49           HE1      TRP  49   2.497  -4.913  -5.832
  396    HE3  TRP  49           HE3      TRP  49  -0.298  -2.019  -2.310
  397    HZ2  TRP  49           HZ2      TRP  49   1.332  -2.616  -6.987
  398    HZ3  TRP  49           HZ3      TRP  49  -0.863  -0.401  -4.073
  399    HH2  TRP  49           HH2      TRP  49  -0.064  -0.694  -6.362
  400    H    TRP  50           H        TRP  50  -0.871  -6.380   0.172
  401    HA   TRP  50           HA       TRP  50  -0.010  -6.142   2.841
  402   1HB   TRP  50          2HB       TRP  50  -2.342  -5.831   2.277
  403   2HB   TRP  50          1HB       TRP  50  -2.457  -7.465   1.640
  404    HD1  TRP  50           HD1      TRP  50  -3.189  -9.308   3.272
  405    HE1  TRP  50           HE1      TRP  50  -3.696  -9.423   5.793
  406    HE3  TRP  50           HE3      TRP  50  -1.491  -4.684   4.632
  407    HZ2  TRP  50           HZ2      TRP  50  -3.413  -7.756   8.054
  408    HZ3  TRP  50           HZ3      TRP  50  -1.647  -4.027   6.994
  409    HH2  TRP  50           HH2      TRP  50  -2.586  -5.527   8.668
  410    H    GLU  51           H        GLU  51  -0.605  -8.965   0.797
  411    HA   GLU  51           HA       GLU  51  -0.007 -10.902   2.733
  412   1HB   GLU  51          2HB       GLU  51  -0.202 -10.861  -0.250
  413   2HB   GLU  51          1HB       GLU  51   0.364 -12.299   0.568
  414   1HG   GLU  51          2HG       GLU  51  -1.721 -12.271   1.930
  415   2HG   GLU  51          1HG       GLU  51  -2.287 -10.935   0.930
  416    H    GLU  52           H        GLU  52   2.027  -9.238   0.347
  417    HA   GLU  52           HA       GLU  52   4.395 -10.668   0.774
  418   1HB   GLU  52          2HB       GLU  52   3.950  -7.771   0.064
  419   2HB   GLU  52          1HB       GLU  52   5.543  -8.510   0.119
  420   1HG   GLU  52          2HG       GLU  52   4.835 -10.119  -1.590
  421   2HG   GLU  52          1HG       GLU  52   3.266  -9.321  -1.665
  422    H    LEU  53           H        LEU  53   3.108  -7.802   2.398
  423    HA   LEU  53           HA       LEU  53   5.159  -7.447   4.284
  424   1HB   LEU  53          2HB       LEU  53   3.611  -5.679   3.949
  425   2HB   LEU  53          1HB       LEU  53   2.238  -6.718   4.273
  426    HG   LEU  53           HG       LEU  53   2.948  -6.865   6.655
  427   1HD1  LEU  53          1HD1      LEU  53   4.978  -4.787   5.820
  428   2HD1  LEU  53          2HD1      LEU  53   5.324  -6.423   6.379
  429   3HD1  LEU  53          3HD1      LEU  53   4.608  -5.246   7.481
  430   1HD2  LEU  53          1HD2      LEU  53   2.510  -4.076   5.580
  431   2HD2  LEU  53          2HD2      LEU  53   2.245  -4.596   7.245
  432   3HD2  LEU  53          3HD2      LEU  53   1.256  -5.262   5.945
  433    H    GLN  54           H        GLN  54   2.114  -9.246   4.460
  434    HA   GLN  54           HA       GLN  54   2.334  -9.933   7.178
  435   1HB   GLN  54          2HB       GLN  54   0.368 -10.115   5.348
  436   2HB   GLN  54          1HB       GLN  54   0.893 -11.792   5.395
  437   1HG   GLN  54          2HG       GLN  54  -0.921 -11.458   6.939
  438   2HG   GLN  54          1HG       GLN  54   0.563 -11.812   7.826
  439   1HE2  GLN  54          1HE2      GLN  54  -0.142 -10.817   9.714
  440   2HE2  GLN  54          2HE2      GLN  54  -0.315  -9.102   9.853
  441    H    LYS  55           H        LYS  55   3.683 -11.351   4.304
  442    HA   LYS  55           HA       LYS  55   4.454 -13.772   5.747
  443   1HB   LYS  55          2HB       LYS  55   3.508 -13.663   3.327
  444   2HB   LYS  55          1HB       LYS  55   5.149 -13.206   2.890
  445   1HG   LYS  55          2HG       LYS  55   5.992 -15.270   3.856
  446   2HG   LYS  55          1HG       LYS  55   4.354 -15.730   4.325
  447   1HD   LYS  55          2HD       LYS  55   3.724 -15.577   1.902
  448   2HD   LYS  55          1HD       LYS  55   5.440 -15.382   1.542
  449   1HE   LYS  55          2HE       LYS  55   5.912 -17.536   2.584
  450   2HE   LYS  55          1HE       LYS  55   4.202 -17.735   2.966
  451   1HZ   LYS  55          1HZ       LYS  55   5.449 -17.658   0.276
  452   2HZ   LYS  55          2HZ       LYS  55   3.774 -17.591   0.529
  453   3HZ   LYS  55          3HZ       LYS  55   4.648 -18.962   1.005
  454    H    ASN  56           H        ASN  56   5.620 -10.773   5.536
  455    HA   ASN  56           HA       ASN  56   8.426 -11.461   5.147
  456   1HB   ASN  56          2HB       ASN  56   7.423  -9.338   4.222
  457   2HB   ASN  56          1HB       ASN  56   7.213  -8.780   5.875
  458   1HD2  ASN  56          1HD2      ASN  56   8.815  -7.809   3.557
  459   2HD2  ASN  56          2HD2      ASN  56  10.421  -7.617   4.186
  460    HA   PRO  57           HA       PRO  57   9.033 -12.538   9.431
  461   1HB   PRO  57          2HB       PRO  57  11.731 -11.721   9.409
  462   2HB   PRO  57          1HB       PRO  57  11.117 -13.346   9.105
  463   1HG   PRO  57          2HG       PRO  57  11.923 -11.234   7.175
  464   2HG   PRO  57          1HG       PRO  57  12.066 -12.995   7.041
  465   1HD   PRO  57          2HD       PRO  57  10.199 -11.647   5.680
  466   2HD   PRO  57          1HD       PRO  57   9.852 -13.247   6.374
  467    HA   PRO  58           HA       PRO  58   8.266  -8.910  11.751
  468   1HB   PRO  58          2HB       PRO  58   9.891  -9.610  13.958
  469   2HB   PRO  58          1HB       PRO  58   8.161  -9.900  13.770
  470   1HG   PRO  58          2HG       PRO  58  10.450 -11.729  13.317
  471   2HG   PRO  58          1HG       PRO  58   8.799 -12.098  13.843
  472   1HD   PRO  58          2HD       PRO  58   9.645 -12.657  11.359
  473   2HD   PRO  58          1HD       PRO  58   7.981 -12.116  11.670
  474    H    TYR  59           H        TYR  59   9.112  -6.946  12.078
  475    HA   TYR  59           HA       TYR  59  11.686  -6.411  10.917
  476   1HB   TYR  59          2HB       TYR  59   9.741  -4.968  10.478
  477   2HB   TYR  59          1HB       TYR  59   9.654  -4.556  12.185
  478    HD1  TYR  59           HD1      TYR  59  11.032  -2.839  13.098
  479    HD2  TYR  59           HD2      TYR  59  11.665  -4.173   9.109
  480    HE1  TYR  59           HE1      TYR  59  12.504  -0.913  12.697
  481    HE2  TYR  59           HE2      TYR  59  13.144  -2.249   8.699
  482    HH   TYR  59           HH       TYR  59  13.516   0.007   9.583
  483    H    GLU  60           H        GLU  60  13.511  -6.526  12.026
  484    HA   GLU  60           HA       GLU  60  13.550  -6.368  14.910
  485   1HB   GLU  60          2HB       GLU  60  15.584  -6.931  12.786
  486   2HB   GLU  60          1HB       GLU  60  16.116  -6.525  14.412
  487   1HG   GLU  60          2HG       GLU  60  14.228  -8.771  13.755
  488   2HG   GLU  60          1HG       GLU  60  15.970  -8.955  13.958
  Start of MODEL    5
    1   1H    MET   1          1H        MET   1  -9.795  -4.567   6.470
    2   2H    MET   1          2H        MET   1  -8.657  -4.855   7.694
    3   3H    MET   1          3H        MET   1  -9.154  -6.123   6.690
    4    HA   MET   1           HA       MET   1  -6.945  -5.276   6.131
    5   1HB   MET   1          2HB       MET   1  -8.364  -6.351   4.427
    6   2HB   MET   1          1HB       MET   1  -9.081  -4.793   4.041
    7   1HG   MET   1          2HG       MET   1  -6.871  -3.973   3.342
    8   2HG   MET   1          1HG       MET   1  -6.195  -5.566   3.670
    9   1HE   MET   1          1HE       MET   1  -5.202  -5.712   1.200
   10   2HE   MET   1          2HE       MET   1  -5.828  -4.090   0.904
   11   3HE   MET   1          3HE       MET   1  -6.160  -5.387  -0.244
   12    H    ILE   2           H        ILE   2  -6.041  -3.476   7.007
   13    HA   ILE   2           HA       ILE   2  -7.090  -0.854   6.278
   14    HB   ILE   2           HB       ILE   2  -4.858  -1.671   8.133
   15   1HG1  ILE   2          2HG1      ILE   2  -6.349  -0.427   9.793
   16   2HG1  ILE   2          1HG1      ILE   2  -7.589  -0.456   8.548
   17   1HG2  ILE   2          1HG2      ILE   2  -4.643   0.702   8.719
   18   2HG2  ILE   2          2HG2      ILE   2  -5.749   1.104   7.405
   19   3HG2  ILE   2          3HG2      ILE   2  -4.181   0.374   7.050
   20   1HD1  ILE   2          1HD1      ILE   2  -7.935  -2.222  10.151
   21   2HD1  ILE   2          2HD1      ILE   2  -6.315  -2.849   9.848
   22   3HD1  ILE   2          3HD1      ILE   2  -7.532  -2.901   8.574
   23    H    LEU   3           H        LEU   3  -6.373   0.263   4.625
   24    HA   LEU   3           HA       LEU   3  -4.572  -0.749   2.747
   25   1HB   LEU   3          2HB       LEU   3  -6.265   1.561   3.123
   26   2HB   LEU   3          1HB       LEU   3  -4.780   1.988   2.314
   27    HG   LEU   3           HG       LEU   3  -6.525   1.513   0.705
   28   1HD1  LEU   3          1HD1      LEU   3  -5.379  -0.179  -0.642
   29   2HD1  LEU   3          2HD1      LEU   3  -4.416  -0.634   0.764
   30   3HD1  LEU   3          3HD1      LEU   3  -4.251   0.977   0.064
   31   1HD2  LEU   3          1HD2      LEU   3  -6.621  -1.240   1.929
   32   2HD2  LEU   3          2HD2      LEU   3  -7.500  -0.713   0.493
   33   3HD2  LEU   3          3HD2      LEU   3  -7.872  -0.004   2.064
   34    H    TYR   4           H        TYR   4  -4.127   1.409   5.419
   35    HA   TYR   4           HA       TYR   4  -1.865   2.808   4.740
   36   1HB   TYR   4          2HB       TYR   4  -3.005   3.362   6.746
   37   2HB   TYR   4          1HB       TYR   4  -2.797   1.742   7.399
   38    HD1  TYR   4           HD1      TYR   4  -1.093   1.355   8.920
   39    HD2  TYR   4           HD2      TYR   4  -0.777   4.694   6.304
   40    HE1  TYR   4           HE1      TYR   4   0.948   2.067  10.087
   41    HE2  TYR   4           HE2      TYR   4   1.265   5.417   7.471
   42    HH   TYR   4           HH       TYR   4   2.906   3.408   9.723
   43    H    ASP   5           H        ASP   5  -2.000  -0.438   6.181
   44    HA   ASP   5           HA       ASP   5   0.773  -0.724   6.542
   45   1HB   ASP   5          2HB       ASP   5  -1.460  -2.719   6.251
   46   2HB   ASP   5          1HB       ASP   5   0.204  -3.212   6.529
   47    H    ALA   6           H        ALA   6  -1.346  -1.860   3.955
   48    HA   ALA   6           HA       ALA   6   0.593  -3.082   2.364
   49   1HB   ALA   6          1HB       ALA   6  -1.970  -1.763   1.485
   50   2HB   ALA   6          2HB       ALA   6  -1.813  -3.419   2.071
   51   3HB   ALA   6          3HB       ALA   6  -1.035  -2.943   0.563
   52    H    ILE   7           H        ILE   7  -0.655   0.246   2.275
   53    HA   ILE   7           HA       ILE   7   0.825   1.071   0.020
   54    HB   ILE   7           HB       ILE   7  -0.165   2.777   2.314
   55   1HG1  ILE   7          2HG1      ILE   7  -1.452   2.158  -0.361
   56   2HG1  ILE   7          1HG1      ILE   7  -1.943   1.470   1.189
   57   1HG2  ILE   7          1HG2      ILE   7   0.650   3.550  -0.488
   58   2HG2  ILE   7          2HG2      ILE   7   1.537   3.910   0.992
   59   3HG2  ILE   7          3HG2      ILE   7  -0.049   4.631   0.718
   60   1HD1  ILE   7          1HD1      ILE   7  -2.028   4.389   0.446
   61   2HD1  ILE   7          2HD1      ILE   7  -2.538   3.695   1.984
   62   3HD1  ILE   7          3HD1      ILE   7  -3.408   3.290   0.506
   63    H    MET   8           H        MET   8   1.556   1.164   3.477
   64    HA   MET   8           HA       MET   8   3.917   2.693   3.278
   65   1HB   MET   8          2HB       MET   8   2.637   2.273   5.378
   66   2HB   MET   8          1HB       MET   8   3.235   0.622   5.368
   67   1HG   MET   8          2HG       MET   8   4.740   1.545   6.784
   68   2HG   MET   8          1HG       MET   8   5.574   1.839   5.261
   69   1HE   MET   8          1HE       MET   8   4.846   5.654   4.654
   70   2HE   MET   8          2HE       MET   8   3.815   4.351   4.070
   71   3HE   MET   8          3HE       MET   8   5.569   4.180   4.009
   72    H    TYR   9           H        TYR   9   3.260  -0.698   2.809
   73    HA   TYR   9           HA       TYR   9   6.001  -1.519   2.906
   74   1HB   TYR   9          2HB       TYR   9   4.143  -3.075   3.394
   75   2HB   TYR   9          1HB       TYR   9   3.595  -2.936   1.728
   76    HD1  TYR   9           HD1      TYR   9   6.571  -3.953   3.746
   77    HD2  TYR   9           HD2      TYR   9   4.368  -4.446   0.135
   78    HE1  TYR   9           HE1      TYR   9   8.030  -5.829   3.117
   79    HE2  TYR   9           HE2      TYR   9   5.820  -6.326  -0.499
   80    HH   TYR   9           HH       TYR   9   8.059  -7.159  -0.020
   81    H    LYS  10           H        LYS  10   3.726  -0.599   0.374
   82    HA   LYS  10           HA       LYS  10   5.491  -1.276  -1.783
   83   1HB   LYS  10          2HB       LYS  10   3.036  -1.247  -2.045
   84   2HB   LYS  10          1HB       LYS  10   3.037   0.483  -1.763
   85   1HG   LYS  10          2HG       LYS  10   2.866   0.273  -4.072
   86   2HG   LYS  10          1HG       LYS  10   4.565   0.652  -3.796
   87   1HD   LYS  10          2HD       LYS  10   5.133  -1.707  -4.003
   88   2HD   LYS  10          1HD       LYS  10   3.433  -2.109  -4.246
   89   1HE   LYS  10          2HE       LYS  10   3.529  -0.485  -6.226
   90   2HE   LYS  10          1HE       LYS  10   5.281  -0.584  -6.060
   91   1HZ   LYS  10          1HZ       LYS  10   3.389  -2.779  -6.706
   92   2HZ   LYS  10          2HZ       LYS  10   4.999  -3.061  -6.245
   93   3HZ   LYS  10          3HZ       LYS  10   4.663  -2.183  -7.655
   94    H    TYR  11           H        TYR  11   4.533   1.738  -0.173
   95    HA   TYR  11           HA       TYR  11   6.847   3.043  -1.438
   96   1HB   TYR  11          2HB       TYR  11   4.141   4.284  -0.904
   97   2HB   TYR  11          1HB       TYR  11   5.552   5.143  -1.508
   98    HD1  TYR  11           HD1      TYR  11   2.578   3.566  -2.430
   99    HD2  TYR  11           HD2      TYR  11   6.604   4.056  -3.712
  100    HE1  TYR  11           HE1      TYR  11   1.908   2.999  -4.730
  101    HE2  TYR  11           HE2      TYR  11   5.947   3.500  -6.014
  102    HH   TYR  11           HH       TYR  11   2.723   3.377  -7.038
  103    HA   PRO  12           HA       PRO  12   7.343   3.423   3.141
  104   1HB   PRO  12          2HB       PRO  12  10.181   3.325   2.363
  105   2HB   PRO  12          1HB       PRO  12   9.310   2.360   3.554
  106   1HG   PRO  12          2HG       PRO  12  10.140   1.301   1.241
  107   2HG   PRO  12          1HG       PRO  12   8.608   0.812   1.988
  108   1HD   PRO  12          2HD       PRO  12   9.085   2.703  -0.290
  109   2HD   PRO  12          1HD       PRO  12   7.840   1.448  -0.111
  110    H    ASN  13           H        ASN  13   8.581   5.057   0.359
  111    HA   ASN  13           HA       ASN  13   9.700   7.265   1.871
  112   1HB   ASN  13          2HB       ASN  13   9.513   6.713  -1.094
  113   2HB   ASN  13          1HB       ASN  13  10.254   8.150  -0.409
  114   1HD2  ASN  13          1HD2      ASN  13  11.401   6.005  -2.031
  115   2HD2  ASN  13          2HD2      ASN  13  12.718   5.366  -1.101
  116    H    ALA  14           H        ALA  14   6.654   6.467   1.189
  117    HA   ALA  14           HA       ALA  14   5.785   9.171   0.459
  118   1HB   ALA  14          1HB       ALA  14   4.801   7.327  -0.811
  119   2HB   ALA  14          2HB       ALA  14   3.576   8.185   0.124
  120   3HB   ALA  14          3HB       ALA  14   4.180   6.626   0.683
  121    H    VAL  15           H        VAL  15   4.620  10.454   1.854
  122    HA   VAL  15           HA       VAL  15   4.682   9.582   4.649
  123    HB   VAL  15           HB       VAL  15   4.230  12.363   3.550
  124   1HG1  VAL  15          1HG1      VAL  15   4.752  11.382   6.357
  125   2HG1  VAL  15          2HG1      VAL  15   3.253  12.089   5.751
  126   3HG1  VAL  15          3HG1      VAL  15   4.710  13.076   5.868
  127   1HG2  VAL  15          1HG2      VAL  15   6.468  11.550   3.014
  128   2HG2  VAL  15          2HG2      VAL  15   6.725  11.118   4.704
  129   3HG2  VAL  15          3HG2      VAL  15   6.536  12.810   4.248
  130    H    SER  16           H        SER  16   2.914   8.907   5.604
  131    HA   SER  16           HA       SER  16   0.368   8.876   4.436
  132   1HB   SER  16          2HB       SER  16   0.775   8.708   7.409
  133   2HB   SER  16          1HB       SER  16  -0.337   7.801   6.388
  134    HG   SER  16           HG       SER  16   2.009   7.018   7.218
  135    H    ARG  17           H        ARG  17  -1.391  10.168   4.620
  136    HA   ARG  17           HA       ARG  17  -2.700  11.956   5.076
  137   1HB   ARG  17          2HB       ARG  17  -0.909  12.187   7.493
  138   2HB   ARG  17          1HB       ARG  17  -2.247  13.287   7.191
  139   1HG   ARG  17          2HG       ARG  17  -3.789  11.362   7.195
  140   2HG   ARG  17          1HG       ARG  17  -2.434  10.307   7.588
  141   1HD   ARG  17          2HD       ARG  17  -3.261  12.659   9.276
  142   2HD   ARG  17          1HD       ARG  17  -3.845  11.019   9.540
  143    HE   ARG  17           HE       ARG  17  -1.220  10.628   9.619
  144   1HH1  ARG  17          1HH1      ARG  17  -3.162  13.131  11.108
  145   2HH1  ARG  17          2HH1      ARG  17  -2.124  13.293  12.491
  146   1HH2  ARG  17          1HH2      ARG  17   0.140  10.825  11.425
  147   2HH2  ARG  17          2HH2      ARG  17  -0.236  11.978  12.670
  148    H    LYS  18           H        LYS  18   0.124  12.087   3.767
  149    HA   LYS  18           HA       LYS  18   0.185  15.024   3.608
  150   1HB   LYS  18          2HB       LYS  18   2.266  14.277   4.507
  151   2HB   LYS  18          1HB       LYS  18   2.409  13.010   3.298
  152   1HG   LYS  18          2HG       LYS  18   3.925  14.889   2.885
  153   2HG   LYS  18          1HG       LYS  18   2.779  14.647   1.567
  154   1HD   LYS  18          2HD       LYS  18   1.374  16.454   2.535
  155   2HD   LYS  18          1HD       LYS  18   2.640  16.746   3.730
  156   1HE   LYS  18          2HE       LYS  18   2.800  18.305   1.848
  157   2HE   LYS  18          1HE       LYS  18   4.223  17.271   1.963
  158   1HZ   LYS  18          1HZ       LYS  18   1.964  16.972   0.050
  159   2HZ   LYS  18          2HZ       LYS  18   3.224  15.851   0.217
  160   3HZ   LYS  18          3HZ       LYS  18   3.556  17.427  -0.314
  161    H    ASP  19           H        ASP  19   1.398  12.385   1.516
  162    HA   ASP  19           HA       ASP  19   0.149  13.799  -0.731
  163   1HB   ASP  19          2HB       ASP  19   2.473  11.906  -0.569
  164   2HB   ASP  19          1HB       ASP  19   1.661  12.209  -2.101
  165    H    PHE  20           H        PHE  20  -0.481  11.293   1.280
  166    HA   PHE  20           HA       PHE  20  -2.669  10.578  -0.456
  167   1HB   PHE  20          2HB       PHE  20  -2.462   8.168  -0.130
  168   2HB   PHE  20          1HB       PHE  20  -1.046   8.804  -0.951
  169    HD1  PHE  20           HD1      PHE  20   1.103   8.999   0.283
  170    HD2  PHE  20           HD2      PHE  20  -2.302   7.069   1.951
  171    HE1  PHE  20           HE1      PHE  20   2.549   7.872   1.922
  172    HE2  PHE  20           HE2      PHE  20  -0.862   5.941   3.598
  173    HZ   PHE  20           HZ       PHE  20   1.570   6.344   3.583
  174    H    GLU  21           H        GLU  21  -4.485  10.664   0.637
  175    HA   GLU  21           HA       GLU  21  -4.297  10.688   3.570
  176   1HB   GLU  21          2HB       GLU  21  -4.908  12.845   2.557
  177   2HB   GLU  21          1HB       GLU  21  -6.280  12.086   1.767
  178   1HG   GLU  21          2HG       GLU  21  -7.400  11.753   3.813
  179   2HG   GLU  21          1HG       GLU  21  -5.951  12.121   4.748
  180    H    LEU  22           H        LEU  22  -5.419   9.256   4.691
  181    HA   LEU  22           HA       LEU  22  -7.007   7.328   3.147
  182   1HB   LEU  22          2HB       LEU  22  -5.792   6.921   5.873
  183   2HB   LEU  22          1HB       LEU  22  -6.423   5.698   4.787
  184    HG   LEU  22           HG       LEU  22  -3.932   7.341   4.321
  185   1HD1  LEU  22          1HD1      LEU  22  -2.751   5.225   4.656
  186   2HD1  LEU  22          2HD1      LEU  22  -4.278   4.436   5.051
  187   3HD1  LEU  22          3HD1      LEU  22  -3.644   5.705   6.099
  188   1HD2  LEU  22          1HD2      LEU  22  -3.553   5.836   2.432
  189   2HD2  LEU  22          2HD2      LEU  22  -5.035   6.772   2.231
  190   3HD2  LEU  22          3HD2      LEU  22  -5.120   5.079   2.721
  191    H    ARG  23           H        ARG  23  -8.906   6.454   4.042
  192    HA   ARG  23           HA       ARG  23 -10.094   7.923   6.296
  193   1HB   ARG  23          2HB       ARG  23 -11.064   7.842   3.528
  194   2HB   ARG  23          1HB       ARG  23 -12.274   7.400   4.724
  195   1HG   ARG  23          2HG       ARG  23 -12.474   9.718   4.346
  196   2HG   ARG  23          1HG       ARG  23 -11.733   9.516   5.929
  197   1HD   ARG  23          2HD       ARG  23  -9.549   9.979   5.014
  198   2HD   ARG  23          1HD       ARG  23 -10.218  10.073   3.386
  199    HE   ARG  23           HE       ARG  23 -11.366  12.089   4.046
  200   1HH1  ARG  23          1HH1      ARG  23  -8.895  10.913   6.217
  201   2HH1  ARG  23          2HH1      ARG  23  -8.615  12.454   6.963
  202   1HH2  ARG  23          1HH2      ARG  23 -11.018  14.138   5.011
  203   2HH2  ARG  23          2HH2      ARG  23  -9.808  14.306   6.251
  204    H    ASN  24           H        ASN  24 -12.223   6.809   6.906
  205    HA   ASN  24           HA       ASN  24 -11.588   3.989   7.272
  206   1HB   ASN  24          2HB       ASN  24 -12.335   5.458   9.180
  207   2HB   ASN  24          1HB       ASN  24 -13.921   5.531   8.423
  208   1HD2  ASN  24          1HD2      ASN  24 -15.274   3.781   8.522
  209   2HD2  ASN  24          2HD2      ASN  24 -14.939   2.392   9.501
  210    H    ASP  25           H        ASP  25 -12.399   2.455   6.037
  211    HA   ASP  25           HA       ASP  25 -14.461   3.031   4.090
  212   1HB   ASP  25          2HB       ASP  25 -12.606   1.633   3.404
  213   2HB   ASP  25          1HB       ASP  25 -12.893   0.524   4.739
  214    H    GLY  26           H        GLY  26 -14.078   1.193   7.029
  215   1HA   GLY  26          2HA       GLY  26 -16.462   1.204   8.156
  216   2HA   GLY  26          1HA       GLY  26 -16.765   0.073   6.840
  217    H    ASN  27           H        ASN  27 -14.729  -1.504   6.641
  218    HA   ASN  27           HA       ASN  27 -14.516  -2.785   9.261
  219   1HB   ASN  27          2HB       ASN  27 -15.342  -4.085   7.273
  220   2HB   ASN  27          1HB       ASN  27 -13.747  -3.891   6.556
  221   1HD2  ASN  27          1HD2      ASN  27 -13.333  -6.077   6.513
  222   2HD2  ASN  27          2HD2      ASN  27 -13.028  -7.001   7.951
  223    H    GLY  28           H        GLY  28 -12.798  -0.822   7.199
  224   1HA   GLY  28          2HA       GLY  28 -10.465  -0.889   8.838
  225   2HA   GLY  28          1HA       GLY  28 -10.182  -1.630   7.270
  226    H    SER  29           H        SER  29  -8.603   0.199   7.161
  227    HA   SER  29           HA       SER  29  -9.871   2.746   6.438
  228   1HB   SER  29          2HB       SER  29  -6.950   2.112   6.931
  229   2HB   SER  29          1HB       SER  29  -7.623   3.713   6.626
  230    HG   SER  29           HG       SER  29  -8.882   2.431   8.682
  231    H    TYR  30           H        TYR  30  -9.627   3.637   4.409
  232    HA   TYR  30           HA       TYR  30  -8.030   2.148   2.455
  233   1HB   TYR  30          2HB       TYR  30  -9.766   2.098   0.817
  234   2HB   TYR  30          1HB       TYR  30 -10.438   1.437   2.296
  235    HD1  TYR  30           HD1      TYR  30 -11.599   2.890  -0.334
  236    HD2  TYR  30           HD2      TYR  30 -11.131   3.955   3.756
  237    HE1  TYR  30           HE1      TYR  30 -13.489   4.451  -0.531
  238    HE2  TYR  30           HE2      TYR  30 -13.020   5.513   3.570
  239    HH   TYR  30           HH       TYR  30 -14.144   6.834   1.644
  240    H    ILE  31           H        ILE  31  -8.211   3.512   0.255
  241    HA   ILE  31           HA       ILE  31  -6.990   6.055   0.970
  242    HB   ILE  31           HB       ILE  31  -7.366   4.866  -1.786
  243   1HG1  ILE  31          2HG1      ILE  31  -4.977   4.631   0.061
  244   2HG1  ILE  31          1HG1      ILE  31  -6.122   3.334  -0.272
  245   1HG2  ILE  31          1HG2      ILE  31  -5.489   6.336  -2.381
  246   2HG2  ILE  31          2HG2      ILE  31  -5.466   6.954  -0.730
  247   3HG2  ILE  31          3HG2      ILE  31  -6.865   7.251  -1.761
  248   1HD1  ILE  31          1HD1      ILE  31  -4.372   4.673  -2.322
  249   2HD1  ILE  31          2HD1      ILE  31  -5.474   3.327  -2.605
  250   3HD1  ILE  31          3HD1      ILE  31  -4.060   3.108  -1.571
  251    H    GLU  32           H        GLU  32  -7.958   8.000   0.797
  252    HA   GLU  32           HA       GLU  32 -10.453   8.144  -0.763
  253   1HB   GLU  32          2HB       GLU  32 -10.730   8.634   1.651
  254   2HB   GLU  32          1HB       GLU  32  -9.561   9.940   1.504
  255   1HG   GLU  32          2HG       GLU  32 -11.419  10.460  -0.481
  256   2HG   GLU  32          1HG       GLU  32 -12.381   9.896   0.883
  257    H    LYS  33           H        LYS  33  -7.654  10.076   0.257
  258    HA   LYS  33           HA       LYS  33  -7.944  11.647  -2.203
  259   1HB   LYS  33          2HB       LYS  33  -8.200  12.840  -0.044
  260   2HB   LYS  33          1HB       LYS  33  -6.570  12.355   0.390
  261   1HG   LYS  33          2HG       LYS  33  -5.684  13.643  -1.471
  262   2HG   LYS  33          1HG       LYS  33  -7.318  14.113  -1.925
  263   1HD   LYS  33          2HD       LYS  33  -6.244  14.643   0.804
  264   2HD   LYS  33          1HD       LYS  33  -5.927  15.738  -0.529
  265   1HE   LYS  33          2HE       LYS  33  -7.822  16.576   0.617
  266   2HE   LYS  33          1HE       LYS  33  -8.404  15.872  -0.884
  267   1HZ   LYS  33          1HZ       LYS  33  -9.136  13.925   0.321
  268   2HZ   LYS  33          2HZ       LYS  33  -9.798  15.305   1.030
  269   3HZ   LYS  33          3HZ       LYS  33  -8.491  14.524   1.772
  270    H    TRP  34           H        TRP  34  -6.597  10.963  -3.706
  271    HA   TRP  34           HA       TRP  34  -3.947   9.955  -2.931
  272   1HB   TRP  34          2HB       TRP  34  -5.457   8.437  -4.234
  273   2HB   TRP  34          1HB       TRP  34  -5.427   9.602  -5.550
  274    HD1  TRP  34           HD1      TRP  34  -3.469   9.442  -7.230
  275    HE1  TRP  34           HE1      TRP  34  -1.407   7.917  -7.454
  276    HE3  TRP  34           HE3      TRP  34  -3.655   7.167  -2.659
  277    HZ2  TRP  34           HZ2      TRP  34  -0.033   6.012  -5.886
  278    HZ3  TRP  34           HZ3      TRP  34  -1.929   5.504  -2.096
  279    HH2  TRP  34           HH2      TRP  34  -0.156   4.940  -3.678
  280    H    ASN  35           H        ASN  35  -2.383  11.418  -3.110
  281    HA   ASN  35           HA       ASN  35  -2.673  13.533  -5.150
  282   1HB   ASN  35          2HB       ASN  35  -2.757  13.967  -2.509
  283   2HB   ASN  35          1HB       ASN  35  -1.011  13.977  -2.716
  284   1HD2  ASN  35          1HD2      ASN  35  -2.769  16.109  -1.930
  285   2HD2  ASN  35          2HD2      ASN  35  -2.567  17.371  -3.095
  286    H    LEU  36           H        LEU  36  -1.091  10.808  -4.656
  287    HA   LEU  36           HA       LEU  36   1.631  11.655  -5.088
  288   1HB   LEU  36          2HB       LEU  36   0.275   8.971  -4.992
  289   2HB   LEU  36          1HB       LEU  36   1.951   9.139  -5.469
  290    HG   LEU  36           HG       LEU  36   0.873  10.065  -2.816
  291   1HD1  LEU  36          1HD1      LEU  36   1.938   8.079  -1.874
  292   2HD1  LEU  36          2HD1      LEU  36   2.363   7.533  -3.497
  293   3HD1  LEU  36          3HD1      LEU  36   0.670   7.638  -3.017
  294   1HD2  LEU  36          1HD2      LEU  36   3.681   9.688  -3.844
  295   2HD2  LEU  36          2HD2      LEU  36   3.241  10.153  -2.202
  296   3HD2  LEU  36          3HD2      LEU  36   2.878  11.230  -3.549
  297    H    ARG  37           H        ARG  37   2.856  11.320  -6.954
  298    HA   ARG  37           HA       ARG  37   1.357  11.519  -9.424
  299   1HB   ARG  37          2HB       ARG  37   4.336  11.558  -8.895
  300   2HB   ARG  37          1HB       ARG  37   3.594  11.858 -10.460
  301   1HG   ARG  37          2HG       ARG  37   2.473  13.825  -9.570
  302   2HG   ARG  37          1HG       ARG  37   3.180  13.516  -7.983
  303   1HD   ARG  37          2HD       ARG  37   5.422  13.751  -8.959
  304   2HD   ARG  37          1HD       ARG  37   4.691  14.112 -10.521
  305    HE   ARG  37           HE       ARG  37   3.614  15.927  -8.750
  306   1HH1  ARG  37          1HH1      ARG  37   6.828  15.078  -9.872
  307   2HH1  ARG  37          2HH1      ARG  37   7.451  16.687  -9.678
  308   1HH2  ARG  37          1HH2      ARG  37   4.435  18.048  -8.512
  309   2HH2  ARG  37          2HH2      ARG  37   6.102  18.372  -8.908
  310    H    ALA  38           H        ALA  38   0.987   9.090  -8.216
  311    HA   ALA  38           HA       ALA  38   2.308   7.238 -10.083
  312   1HB   ALA  38          1HB       ALA  38   1.691   6.704  -7.170
  313   2HB   ALA  38          2HB       ALA  38   3.295   6.956  -7.855
  314   3HB   ALA  38          3HB       ALA  38   2.355   5.535  -8.311
  315    HA   PRO  39           HA       PRO  39  -1.827   5.965 -11.052
  316   1HB   PRO  39          2HB       PRO  39  -1.443   3.336 -11.657
  317   2HB   PRO  39          1HB       PRO  39  -0.972   4.656 -12.733
  318   1HG   PRO  39          2HG       PRO  39   0.704   3.063 -10.838
  319   2HG   PRO  39          1HG       PRO  39   1.074   3.587 -12.493
  320   1HD   PRO  39          2HD       PRO  39   2.050   4.863 -10.314
  321   2HD   PRO  39          1HD       PRO  39   1.660   5.718 -11.819
  322    H    LEU  40           H        LEU  40  -3.597   4.762 -10.265
  323    HA   LEU  40           HA       LEU  40  -3.474   4.137  -7.495
  324   1HB   LEU  40          2HB       LEU  40  -5.588   4.037  -9.611
  325   2HB   LEU  40          1HB       LEU  40  -5.872   3.259  -8.073
  326    HG   LEU  40           HG       LEU  40  -6.884   5.438  -8.048
  327   1HD1  LEU  40          1HD1      LEU  40  -5.788   6.428  -6.106
  328   2HD1  LEU  40          2HD1      LEU  40  -4.370   5.419  -6.390
  329   3HD1  LEU  40          3HD1      LEU  40  -5.909   4.673  -5.961
  330   1HD2  LEU  40          1HD2      LEU  40  -4.148   6.524  -8.717
  331   2HD2  LEU  40          2HD2      LEU  40  -5.570   7.489  -8.317
  332   3HD2  LEU  40          3HD2      LEU  40  -5.554   6.508  -9.782
  333    HA   PRO  41           HA       PRO  41  -2.128  -0.094  -7.939
  334   1HB   PRO  41          2HB       PRO  41  -2.811  -0.860  -5.388
  335   2HB   PRO  41          1HB       PRO  41  -1.313  -0.025  -5.814
  336   1HG   PRO  41          2HG       PRO  41  -3.856   1.092  -4.702
  337   2HG   PRO  41          1HG       PRO  41  -2.180   1.480  -4.273
  338   1HD   PRO  41          2HD       PRO  41  -3.618   3.090  -5.860
  339   2HD   PRO  41          1HD       PRO  41  -1.882   2.830  -6.135
  340    H    THR  42           H        THR  42  -3.042  -2.239  -7.860
  341    HA   THR  42           HA       THR  42  -5.916  -2.163  -8.389
  342    HB   THR  42           HB       THR  42  -5.570  -4.431  -9.342
  343    HG1  THR  42           HG1      THR  42  -3.363  -5.113  -9.614
  344   1HG2  THR  42          1HG2      THR  42  -3.720  -2.301 -10.424
  345   2HG2  THR  42          2HG2      THR  42  -5.434  -2.479 -10.801
  346   3HG2  THR  42          3HG2      THR  42  -4.284  -3.715 -11.315
  347    H    GLN  43           H        GLN  43  -7.307  -3.771  -7.522
  348    HA   GLN  43           HA       GLN  43  -7.204  -4.209  -4.796
  349   1HB   GLN  43          2HB       GLN  43  -9.165  -4.465  -6.402
  350   2HB   GLN  43          1HB       GLN  43  -8.544  -6.058  -6.772
  351   1HG   GLN  43          2HG       GLN  43  -9.193  -5.255  -3.961
  352   2HG   GLN  43          1HG       GLN  43 -10.427  -5.867  -5.059
  353   1HE2  GLN  43          1HE2      GLN  43  -9.340  -6.977  -2.574
  354   2HE2  GLN  43          2HE2      GLN  43  -8.741  -8.551  -2.975
  355    H    ALA  44           H        ALA  44  -6.232  -6.323  -7.439
  356    HA   ALA  44           HA       ALA  44  -5.467  -8.570  -5.958
  357   1HB   ALA  44          1HB       ALA  44  -4.203  -9.251  -7.911
  358   2HB   ALA  44          2HB       ALA  44  -4.281  -7.615  -8.563
  359   3HB   ALA  44          3HB       ALA  44  -5.755  -8.571  -8.400
  360    H    GLU  45           H        GLU  45  -3.414  -5.856  -7.093
  361    HA   GLU  45           HA       GLU  45  -1.067  -6.916  -5.970
  362   1HB   GLU  45          2HB       GLU  45  -1.696  -4.708  -7.570
  363   2HB   GLU  45          1HB       GLU  45  -0.975  -4.031  -6.113
  364   1HG   GLU  45          2HG       GLU  45   0.883  -5.689  -6.392
  365   2HG   GLU  45          1HG       GLU  45   0.213  -6.071  -7.970
  366    H    LEU  46           H        LEU  46  -3.540  -4.764  -4.684
  367    HA   LEU  46           HA       LEU  46  -2.307  -3.922  -2.354
  368   1HB   LEU  46          2HB       LEU  46  -5.180  -4.696  -2.835
  369   2HB   LEU  46          1HB       LEU  46  -4.617  -3.872  -1.399
  370    HG   LEU  46           HG       LEU  46  -4.470  -2.782  -4.207
  371   1HD1  LEU  46          1HD1      LEU  46  -6.247  -2.026  -1.894
  372   2HD1  LEU  46          2HD1      LEU  46  -6.748  -2.898  -3.344
  373   3HD1  LEU  46          3HD1      LEU  46  -6.188  -1.231  -3.468
  374   1HD2  LEU  46          1HD2      LEU  46  -3.779  -1.505  -1.563
  375   2HD2  LEU  46          2HD2      LEU  46  -3.799  -0.693  -3.128
  376   3HD2  LEU  46          3HD2      LEU  46  -2.636  -1.979  -2.818
  377    H    GLU  47           H        GLU  47  -4.108  -6.928  -2.951
  378    HA   GLU  47           HA       GLU  47  -3.626  -7.933  -0.329
  379   1HB   GLU  47          2HB       GLU  47  -4.662  -9.241  -2.830
  380   2HB   GLU  47          1HB       GLU  47  -4.470 -10.101  -1.307
  381   1HG   GLU  47          2HG       GLU  47  -5.957  -8.393  -0.256
  382   2HG   GLU  47          1HG       GLU  47  -6.262  -7.762  -1.873
  383    H    THR  48           H        THR  48  -1.947  -8.074  -3.368
  384    HA   THR  48           HA       THR  48  -0.257 -10.264  -2.812
  385    HB   THR  48           HB       THR  48   0.385  -7.819  -4.484
  386    HG1  THR  48           HG1      THR  48  -1.527  -9.583  -4.859
  387   1HG2  THR  48          1HG2      THR  48   1.888  -9.358  -5.692
  388   2HG2  THR  48          2HG2      THR  48   1.516 -10.622  -4.518
  389   3HG2  THR  48          3HG2      THR  48   2.357  -9.159  -4.003
  390    H    TRP  49           H        TRP  49   0.162  -6.750  -2.271
  391    HA   TRP  49           HA       TRP  49   2.684  -6.932  -1.009
  392   1HB   TRP  49          2HB       TRP  49   0.581  -4.871  -0.337
  393   2HB   TRP  49          1HB       TRP  49   2.326  -4.703  -0.219
  394    HD1  TRP  49           HD1      TRP  49   2.669  -5.954  -3.338
  395    HE1  TRP  49           HE1      TRP  49   2.248  -4.289  -5.263
  396    HE3  TRP  49           HE3      TRP  49   0.032  -2.402  -0.780
  397    HZ2  TRP  49           HZ2      TRP  49   0.983  -1.803  -5.632
  398    HZ3  TRP  49           HZ3      TRP  49  -0.737  -0.407  -1.989
  399    HH2  TRP  49           HH2      TRP  49  -0.268  -0.113  -4.366
  400    H    TRP  50           H        TRP  50  -0.599  -7.229   0.144
  401    HA   TRP  50           HA       TRP  50  -0.162  -7.126   2.907
  402   1HB   TRP  50          2HB       TRP  50  -2.364  -7.127   1.538
  403   2HB   TRP  50          1HB       TRP  50  -2.250  -8.881   1.634
  404    HD1  TRP  50           HD1      TRP  50  -3.054 -10.001   3.845
  405    HE1  TRP  50           HE1      TRP  50  -4.017  -9.105   6.064
  406    HE3  TRP  50           HE3      TRP  50  -2.102  -5.033   3.172
  407    HZ2  TRP  50           HZ2      TRP  50  -4.320  -6.592   7.353
  408    HZ3  TRP  50           HZ3      TRP  50  -2.747  -3.452   4.940
  409    HH2  TRP  50           HH2      TRP  50  -3.831  -4.219   6.984
  410    H    GLU  51           H        GLU  51  -0.324  -9.936   0.722
  411    HA   GLU  51           HA       GLU  51   0.240 -11.875   2.619
  412   1HB   GLU  51          2HB       GLU  51  -0.658 -11.967   0.152
  413   2HB   GLU  51          1HB       GLU  51   1.050 -12.143  -0.238
  414   1HG   GLU  51          2HG       GLU  51   1.136 -13.980   1.379
  415   2HG   GLU  51          1HG       GLU  51  -0.609 -13.886   1.520
  416    H    GLU  52           H        GLU  52   2.313  -9.948   0.488
  417    HA   GLU  52           HA       GLU  52   4.745 -11.196   1.133
  418   1HB   GLU  52          2HB       GLU  52   4.096  -8.415   0.195
  419   2HB   GLU  52          1HB       GLU  52   5.748  -8.932   0.509
  420   1HG   GLU  52          2HG       GLU  52   5.436 -10.761  -1.122
  421   2HG   GLU  52          1HG       GLU  52   3.840 -10.109  -1.490
  422    H    LEU  53           H        LEU  53   3.170  -8.345   2.551
  423    HA   LEU  53           HA       LEU  53   5.131  -7.765   4.459
  424   1HB   LEU  53          2HB       LEU  53   3.310  -6.241   3.820
  425   2HB   LEU  53          1HB       LEU  53   2.148  -7.306   4.585
  426    HG   LEU  53           HG       LEU  53   3.224  -6.869   6.769
  427   1HD1  LEU  53          1HD1      LEU  53   4.812  -5.029   6.978
  428   2HD1  LEU  53          2HD1      LEU  53   4.839  -4.848   5.225
  429   3HD1  LEU  53          3HD1      LEU  53   5.461  -6.321   5.968
  430   1HD2  LEU  53          1HD2      LEU  53   1.279  -5.581   6.094
  431   2HD2  LEU  53          2HD2      LEU  53   2.315  -4.425   5.257
  432   3HD2  LEU  53          3HD2      LEU  53   2.397  -4.571   7.013
  433    H    GLN  54           H        GLN  54   2.742 -10.245   4.344
  434    HA   GLN  54           HA       GLN  54   2.919 -10.846   7.171
  435   1HB   GLN  54          2HB       GLN  54   1.084 -11.392   5.105
  436   2HB   GLN  54          1HB       GLN  54   1.718 -12.950   5.620
  437   1HG   GLN  54          2HG       GLN  54  -0.270 -12.430   6.863
  438   2HG   GLN  54          1HG       GLN  54   1.123 -12.405   7.940
  439   1HE2  GLN  54          1HE2      GLN  54   0.371  -9.835   5.685
  440   2HE2  GLN  54          2HE2      GLN  54  -0.045  -8.650   6.882
  441    H    LYS  55           H        LYS  55   3.989 -12.301   4.107
  442    HA   LYS  55           HA       LYS  55   5.190 -14.550   5.460
  443   1HB   LYS  55          2HB       LYS  55   5.077 -13.697   2.594
  444   2HB   LYS  55          1HB       LYS  55   5.975 -15.106   3.123
  445   1HG   LYS  55          2HG       LYS  55   3.958 -16.164   3.893
  446   2HG   LYS  55          1HG       LYS  55   3.019 -14.711   3.533
  447   1HD   LYS  55          2HD       LYS  55   3.520 -14.938   1.178
  448   2HD   LYS  55          1HD       LYS  55   4.549 -16.332   1.502
  449   1HE   LYS  55          2HE       LYS  55   2.613 -17.575   2.313
  450   2HE   LYS  55          1HE       LYS  55   1.581 -16.174   2.019
  451   1HZ   LYS  55          1HZ       LYS  55   3.154 -17.530  -0.105
  452   2HZ   LYS  55          2HZ       LYS  55   1.948 -16.349  -0.309
  453   3HZ   LYS  55          3HZ       LYS  55   1.535 -17.900   0.242
  454    H    ASN  56           H        ASN  56   6.198 -11.474   4.596
  455    HA   ASN  56           HA       ASN  56   9.033 -12.278   4.600
  456   1HB   ASN  56          2HB       ASN  56   8.258 -11.450   2.401
  457   2HB   ASN  56          1HB       ASN  56   7.766  -9.939   3.152
  458   1HD2  ASN  56          1HD2      ASN  56   9.098  -8.696   1.905
  459   2HD2  ASN  56          2HD2      ASN  56  10.825  -8.699   2.070
  460    HA   PRO  57           HA       PRO  57   8.916  -9.613   8.229
  461   1HB   PRO  57          2HB       PRO  57  11.199 -10.516   9.324
  462   2HB   PRO  57          1HB       PRO  57   9.702 -11.453   9.388
  463   1HG   PRO  57          2HG       PRO  57  12.050 -11.756   7.559
  464   2HG   PRO  57          1HG       PRO  57  11.101 -13.010   8.381
  465   1HD   PRO  57          2HD       PRO  57  10.750 -12.303   5.756
  466   2HD   PRO  57          1HD       PRO  57   9.472 -12.996   6.772
  467    HA   PRO  58           HA       PRO  58  11.601  -6.398   6.666
  468   1HB   PRO  58          2HB       PRO  58  11.238  -5.097   9.264
  469   2HB   PRO  58          1HB       PRO  58  10.706  -4.570   7.666
  470   1HG   PRO  58          2HG       PRO  58   8.973  -5.419   9.551
  471   2HG   PRO  58          1HG       PRO  58   8.698  -5.679   7.819
  472   1HD   PRO  58          2HD       PRO  58   9.722  -7.597   9.885
  473   2HD   PRO  58          1HD       PRO  58   8.561  -7.871   8.567
  474    H    TYR  59           H        TYR  59  13.706  -5.613   7.007
  475    HA   TYR  59           HA       TYR  59  15.398  -7.276   8.575
  476   1HB   TYR  59          2HB       TYR  59  16.180  -6.252   6.474
  477   2HB   TYR  59          1HB       TYR  59  16.043  -4.655   7.202
  478    HD1  TYR  59           HD1      TYR  59  17.942  -7.808   7.210
  479    HD2  TYR  59           HD2      TYR  59  17.709  -3.845   8.734
  480    HE1  TYR  59           HE1      TYR  59  20.240  -8.006   8.063
  481    HE2  TYR  59           HE2      TYR  59  20.008  -4.026   9.580
  482    HH   TYR  59           HH       TYR  59  22.124  -6.486   8.663
  483    H    GLU  60           H        GLU  60  15.562  -7.173  10.690
  484    HA   GLU  60           HA       GLU  60  15.054  -4.643  12.071
  485   1HB   GLU  60          2HB       GLU  60  13.835  -6.714  12.748
  486   2HB   GLU  60          1HB       GLU  60  15.375  -7.428  13.198
  487   1HG   GLU  60          2HG       GLU  60  15.679  -5.606  14.848
  488   2HG   GLU  60          1HG       GLU  60  14.061  -5.030  14.444
  Start of MODEL    6
    1   1H    MET   1          1H        MET   1  -9.304  -5.820   6.272
    2   2H    MET   1          2H        MET   1  -8.670  -6.036   7.829
    3   3H    MET   1          3H        MET   1  -8.676  -7.329   6.729
    4    HA   MET   1           HA       MET   1  -6.490  -6.252   7.047
    5   1HB   MET   1          2HB       MET   1  -5.936  -6.208   4.663
    6   2HB   MET   1          1HB       MET   1  -6.986  -7.565   5.039
    7   1HG   MET   1          2HG       MET   1  -7.958  -6.831   3.126
    8   2HG   MET   1          1HG       MET   1  -8.868  -5.890   4.303
    9   1HE   MET   1          1HE       MET   1  -5.173  -5.421   2.981
   10   2HE   MET   1          2HE       MET   1  -5.427  -4.226   1.709
   11   3HE   MET   1          3HE       MET   1  -6.099  -5.848   1.538
   12    H    ILE   2           H        ILE   2  -5.138  -4.452   6.466
   13    HA   ILE   2           HA       ILE   2  -6.650  -1.924   6.426
   14    HB   ILE   2           HB       ILE   2  -3.919  -2.455   7.629
   15   1HG1  ILE   2          2HG1      ILE   2  -5.223  -1.617   9.728
   16   2HG1  ILE   2          1HG1      ILE   2  -6.653  -2.086   8.819
   17   1HG2  ILE   2          1HG2      ILE   2  -4.029  -0.225   6.671
   18   2HG2  ILE   2          2HG2      ILE   2  -4.020  -0.143   8.433
   19   3HG2  ILE   2          3HG2      ILE   2  -5.528   0.093   7.548
   20   1HD1  ILE   2          1HD1      ILE   2  -5.818  -4.372   8.684
   21   2HD1  ILE   2          2HD1      ILE   2  -5.953  -3.831  10.359
   22   3HD1  ILE   2          3HD1      ILE   2  -4.373  -3.900   9.578
   23    H    LEU   3           H        LEU   3  -6.309  -0.558   4.762
   24    HA   LEU   3           HA       LEU   3  -4.775  -1.349   2.548
   25   1HB   LEU   3          2HB       LEU   3  -6.404   0.999   3.346
   26   2HB   LEU   3          1HB       LEU   3  -5.324   1.185   2.000
   27    HG   LEU   3           HG       LEU   3  -7.486   0.658   1.134
   28   1HD1  LEU   3          1HD1      LEU   3  -7.070  -1.426  -0.069
   29   2HD1  LEU   3          2HD1      LEU   3  -5.753  -1.803   1.041
   30   3HD1  LEU   3          3HD1      LEU   3  -5.633  -0.404  -0.024
   31   1HD2  LEU   3          1HD2      LEU   3  -7.451  -1.724   2.984
   32   2HD2  LEU   3          2HD2      LEU   3  -8.683  -1.397   1.763
   33   3HD2  LEU   3          3HD2      LEU   3  -8.480  -0.297   3.128
   34    H    TYR   4           H        TYR   4  -4.287   0.997   5.111
   35    HA   TYR   4           HA       TYR   4  -2.195   2.485   4.107
   36   1HB   TYR   4          2HB       TYR   4  -3.306   3.111   6.148
   37   2HB   TYR   4          1HB       TYR   4  -2.762   1.642   6.950
   38    HD1  TYR   4           HD1      TYR   4  -1.145   4.430   5.038
   39    HD2  TYR   4           HD2      TYR   4  -1.111   1.989   8.523
   40    HE1  TYR   4           HE1      TYR   4   0.837   5.629   5.854
   41    HE2  TYR   4           HE2      TYR   4   0.874   3.183   9.343
   42    HH   TYR   4           HH       TYR   4   2.728   4.515   8.446
   43    H    ASP   5           H        ASP   5  -1.988  -0.539   5.963
   44    HA   ASP   5           HA       ASP   5   0.794  -0.663   6.159
   45   1HB   ASP   5          2HB       ASP   5  -1.381  -2.715   6.265
   46   2HB   ASP   5          1HB       ASP   5   0.307  -3.215   6.301
   47    H    ALA   6           H        ALA   6  -1.374  -1.990   3.708
   48    HA   ALA   6           HA       ALA   6   0.612  -3.275   2.173
   49   1HB   ALA   6          1HB       ALA   6  -2.015  -2.166   1.199
   50   2HB   ALA   6          2HB       ALA   6  -1.831  -3.709   2.030
   51   3HB   ALA   6          3HB       ALA   6  -1.063  -3.457   0.465
   52    H    ILE   7           H        ILE   7  -0.876  -0.061   1.900
   53    HA   ILE   7           HA       ILE   7   0.468   0.834  -0.386
   54    HB   ILE   7           HB       ILE   7  -0.382   2.497   1.992
   55   1HG1  ILE   7          2HG1      ILE   7  -1.916   1.940  -0.552
   56   2HG1  ILE   7          1HG1      ILE   7  -2.189   1.079   0.962
   57   1HG2  ILE   7          1HG2      ILE   7  -0.493   4.343   0.371
   58   2HG2  ILE   7          2HG2      ILE   7   0.158   3.277  -0.874
   59   3HG2  ILE   7          3HG2      ILE   7   1.140   3.697   0.530
   60   1HD1  ILE   7          1HD1      ILE   7  -2.499   4.049   0.565
   61   2HD1  ILE   7          2HD1      ILE   7  -2.838   3.145   2.043
   62   3HD1  ILE   7          3HD1      ILE   7  -3.809   2.871   0.598
   63    H    MET   8           H        MET   8   1.320   1.148   3.044
   64    HA   MET   8           HA       MET   8   3.656   2.672   2.700
   65   1HB   MET   8          2HB       MET   8   2.362   2.274   4.846
   66   2HB   MET   8          1HB       MET   8   3.138   0.700   4.929
   67   1HG   MET   8          2HG       MET   8   4.549   1.862   6.255
   68   2HG   MET   8          1HG       MET   8   5.326   2.170   4.703
   69   1HE   MET   8          1HE       MET   8   5.140   4.440   3.378
   70   2HE   MET   8          2HE       MET   8   4.203   5.835   3.913
   71   3HE   MET   8          3HE       MET   8   3.376   4.377   3.364
   72    H    TYR   9           H        TYR   9   3.034  -0.733   2.376
   73    HA   TYR   9           HA       TYR   9   5.720  -1.619   2.574
   74   1HB   TYR   9          2HB       TYR   9   3.861  -3.177   2.836
   75   2HB   TYR   9          1HB       TYR   9   3.360  -2.889   1.172
   76    HD1  TYR   9           HD1      TYR   9   6.037  -4.330   3.275
   77    HD2  TYR   9           HD2      TYR   9   4.371  -4.058  -0.635
   78    HE1  TYR   9           HE1      TYR   9   7.513  -6.142   2.524
   79    HE2  TYR   9           HE2      TYR   9   5.844  -5.876  -1.392
   80    HH   TYR   9           HH       TYR   9   7.523  -7.873   0.695
   81    H    LYS  10           H        LYS  10   3.660  -0.880  -0.258
   82    HA   LYS  10           HA       LYS  10   5.838  -1.366  -2.078
   83   1HB   LYS  10          2HB       LYS  10   3.498  -1.757  -2.764
   84   2HB   LYS  10          1HB       LYS  10   3.182  -0.033  -2.630
   85   1HG   LYS  10          2HG       LYS  10   4.925   0.363  -4.363
   86   2HG   LYS  10          1HG       LYS  10   5.055  -1.385  -4.562
   87   1HD   LYS  10          2HD       LYS  10   2.694  -1.487  -5.189
   88   2HD   LYS  10          1HD       LYS  10   2.562   0.259  -4.984
   89   1HE   LYS  10          2HE       LYS  10   4.243   0.566  -6.760
   90   2HE   LYS  10          1HE       LYS  10   4.301  -1.184  -6.979
   91   1HZ   LYS  10          1HZ       LYS  10   2.864  -0.091  -8.605
   92   2HZ   LYS  10          2HZ       LYS  10   1.884   0.508  -7.364
   93   3HZ   LYS  10          3HZ       LYS  10   1.980  -1.163  -7.634
   94    H    TYR  11           H        TYR  11   4.372   1.458  -0.584
   95    HA   TYR  11           HA       TYR  11   6.402   3.125  -1.926
   96   1HB   TYR  11          2HB       TYR  11   3.706   4.031  -0.892
   97   2HB   TYR  11          1HB       TYR  11   4.877   5.011  -1.764
   98    HD1  TYR  11           HD1      TYR  11   2.044   2.865  -2.049
   99    HD2  TYR  11           HD2      TYR  11   5.440   4.311  -4.170
  100    HE1  TYR  11           HE1      TYR  11   0.976   2.239  -4.173
  101    HE2  TYR  11           HE2      TYR  11   4.382   3.688  -6.301
  102    HH   TYR  11           HH       TYR  11   1.092   2.835  -6.545
  103    HA   PRO  12           HA       PRO  12   7.294   3.323   2.610
  104   1HB   PRO  12          2HB       PRO  12  10.080   3.014   1.890
  105   2HB   PRO  12          1HB       PRO  12   9.063   1.940   2.848
  106   1HG   PRO  12          2HG       PRO  12  10.019   1.293   0.381
  107   2HG   PRO  12          1HG       PRO  12   8.509   0.644   1.046
  108   1HD   PRO  12          2HD       PRO  12   8.917   2.884  -0.907
  109   2HD   PRO  12          1HD       PRO  12   7.701   1.585  -0.918
  110    H    ASN  13           H        ASN  13   8.629   4.849  -0.191
  111    HA   ASN  13           HA       ASN  13   9.920   6.978   1.273
  112   1HB   ASN  13          2HB       ASN  13   9.540   6.433  -1.670
  113   2HB   ASN  13          1HB       ASN  13  10.303   7.892  -1.065
  114   1HD2  ASN  13          1HD2      ASN  13  11.354   5.724  -2.717
  115   2HD2  ASN  13          2HD2      ASN  13  12.754   5.137  -1.876
  116    H    ALA  14           H        ALA  14   6.796   6.285   0.421
  117    HA   ALA  14           HA       ALA  14   5.993   8.994  -0.220
  118   1HB   ALA  14          1HB       ALA  14   3.736   8.070  -0.370
  119   2HB   ALA  14          2HB       ALA  14   4.324   6.521   0.233
  120   3HB   ALA  14          3HB       ALA  14   4.879   7.128  -1.327
  121    H    VAL  15           H        VAL  15   5.322  10.462   1.205
  122    HA   VAL  15           HA       VAL  15   5.375   9.773   4.010
  123    HB   VAL  15           HB       VAL  15   4.759  12.459   2.761
  124   1HG1  VAL  15          1HG1      VAL  15   4.028  12.293   5.058
  125   2HG1  VAL  15          2HG1      VAL  15   5.445  13.340   4.955
  126   3HG1  VAL  15          3HG1      VAL  15   5.610  11.686   5.547
  127   1HG2  VAL  15          1HG2      VAL  15   7.411  11.378   3.720
  128   2HG2  VAL  15          2HG2      VAL  15   7.107  13.014   3.140
  129   3HG2  VAL  15          3HG2      VAL  15   6.953  11.646   2.038
  130    H    SER  16           H        SER  16   3.673   9.150   5.114
  131    HA   SER  16           HA       SER  16   1.059   9.084   4.010
  132   1HB   SER  16          2HB       SER  16   1.931   7.424   5.653
  133   2HB   SER  16          1HB       SER  16   1.906   8.679   6.893
  134    HG   SER  16           HG       SER  16   0.028   7.287   6.830
  135    H    ARG  17           H        ARG  17  -0.743  10.290   4.490
  136    HA   ARG  17           HA       ARG  17  -1.978  12.114   5.003
  137   1HB   ARG  17          2HB       ARG  17  -0.058  12.265   7.334
  138   2HB   ARG  17          1HB       ARG  17  -1.488  13.277   7.169
  139   1HG   ARG  17          2HG       ARG  17  -2.919  11.344   7.229
  140   2HG   ARG  17          1HG       ARG  17  -1.520  10.270   7.252
  141   1HD   ARG  17          2HD       ARG  17  -0.858  11.139   9.416
  142   2HD   ARG  17          1HD       ARG  17  -2.186  12.299   9.381
  143    HE   ARG  17           HE       ARG  17  -3.618  10.146   9.233
  144   1HH1  ARG  17          1HH1      ARG  17  -0.663  10.519  11.102
  145   2HH1  ARG  17          2HH1      ARG  17  -1.134   9.336  12.295
  146   1HH2  ARG  17          1HH2      ARG  17  -4.225   8.620  10.802
  147   2HH2  ARG  17          2HH2      ARG  17  -3.152   8.251  12.115
  148    H    LYS  18           H        LYS  18   0.597  12.261   3.424
  149    HA   LYS  18           HA       LYS  18   0.956  15.177   3.535
  150   1HB   LYS  18          2HB       LYS  18   3.014  13.747   3.754
  151   2HB   LYS  18          1HB       LYS  18   2.704  13.141   2.132
  152   1HG   LYS  18          2HG       LYS  18   4.392  14.883   2.112
  153   2HG   LYS  18          1HG       LYS  18   2.945  15.396   1.239
  154   1HD   LYS  18          2HD       LYS  18   2.225  16.726   3.101
  155   2HD   LYS  18          1HD       LYS  18   3.535  16.107   4.108
  156   1HE   LYS  18          2HE       LYS  18   5.167  17.161   2.607
  157   2HE   LYS  18          1HE       LYS  18   3.847  17.786   1.619
  158   1HZ   LYS  18          1HZ       LYS  18   3.140  19.185   3.341
  159   2HZ   LYS  18          2HZ       LYS  18   4.830  19.357   3.311
  160   3HZ   LYS  18          3HZ       LYS  18   4.096  18.401   4.504
  161    H    ASP  19           H        ASP  19   1.216  12.700   0.997
  162    HA   ASP  19           HA       ASP  19  -0.367  14.431  -0.755
  163   1HB   ASP  19          2HB       ASP  19   1.382  12.049  -1.375
  164   2HB   ASP  19          1HB       ASP  19   0.375  12.858  -2.571
  165    H    PHE  20           H        PHE  20  -0.181  11.063   0.353
  166    HA   PHE  20           HA       PHE  20  -2.979  10.745  -0.442
  167   1HB   PHE  20          2HB       PHE  20  -2.685   8.361  -0.197
  168   2HB   PHE  20          1HB       PHE  20  -1.383   8.993  -1.196
  169    HD1  PHE  20           HD1      PHE  20  -2.244   7.147   1.745
  170    HD2  PHE  20           HD2      PHE  20   0.894   9.322  -0.137
  171    HE1  PHE  20           HE1      PHE  20  -0.609   6.037   3.206
  172    HE2  PHE  20           HE2      PHE  20   2.536   8.213   1.325
  173    HZ   PHE  20           HZ       PHE  20   1.783   6.567   2.995
  174    H    GLU  21           H        GLU  21  -4.565  10.376   1.009
  175    HA   GLU  21           HA       GLU  21  -3.823  10.389   3.856
  176   1HB   GLU  21          2HB       GLU  21  -4.840  12.589   2.550
  177   2HB   GLU  21          1HB       GLU  21  -6.285  11.848   3.214
  178   1HG   GLU  21          2HG       GLU  21  -3.845  12.541   4.825
  179   2HG   GLU  21          1HG       GLU  21  -5.260  13.578   4.661
  180    H    LEU  22           H        LEU  22  -5.229   9.297   5.203
  181    HA   LEU  22           HA       LEU  22  -6.807   7.275   3.754
  182   1HB   LEU  22          2HB       LEU  22  -5.887   7.091   6.603
  183   2HB   LEU  22          1HB       LEU  22  -6.394   5.795   5.545
  184    HG   LEU  22           HG       LEU  22  -3.883   7.389   5.088
  185   1HD1  LEU  22          1HD1      LEU  22  -3.766   6.273   7.249
  186   2HD1  LEU  22          2HD1      LEU  22  -2.688   5.510   6.079
  187   3HD1  LEU  22          3HD1      LEU  22  -4.224   4.747   6.491
  188   1HD2  LEU  22          1HD2      LEU  22  -4.828   4.729   4.025
  189   2HD2  LEU  22          2HD2      LEU  22  -3.278   5.494   3.670
  190   3HD2  LEU  22          3HD2      LEU  22  -4.778   6.245   3.124
  191    H    ARG  23           H        ARG  23  -8.850   6.754   4.367
  192    HA   ARG  23           HA       ARG  23 -10.049   8.097   6.652
  193   1HB   ARG  23          2HB       ARG  23 -10.936   8.499   3.822
  194   2HB   ARG  23          1HB       ARG  23 -12.124   8.512   5.119
  195   1HG   ARG  23          2HG       ARG  23 -11.649  10.707   5.078
  196   2HG   ARG  23          1HG       ARG  23 -10.378  10.195   6.183
  197   1HD   ARG  23          2HD       ARG  23  -8.986   9.882   3.999
  198   2HD   ARG  23          1HD       ARG  23 -10.181  10.976   3.306
  199    HE   ARG  23           HE       ARG  23  -8.198  11.610   5.361
  200   1HH1  ARG  23          1HH1      ARG  23 -10.889  12.667   3.361
  201   2HH1  ARG  23          2HH1      ARG  23 -10.592  14.360   3.663
  202   1HH2  ARG  23          1HH2      ARG  23  -7.799  13.784   5.730
  203   2HH2  ARG  23          2HH2      ARG  23  -8.817  15.002   5.007
  204    H    ASN  24           H        ASN  24 -12.355   7.317   6.929
  205    HA   ASN  24           HA       ASN  24 -12.233   4.393   6.589
  206   1HB   ASN  24          2HB       ASN  24 -12.172   5.292   8.919
  207   2HB   ASN  24          1HB       ASN  24 -13.789   5.944   8.663
  208   1HD2  ASN  24          1HD2      ASN  24 -15.527   4.594   8.728
  209   2HD2  ASN  24          2HD2      ASN  24 -15.421   2.919   9.158
  210    H    ASP  25           H        ASP  25 -13.483   3.644   5.053
  211    HA   ASP  25           HA       ASP  25 -15.676   5.187   3.992
  212   1HB   ASP  25          2HB       ASP  25 -14.119   3.847   2.566
  213   2HB   ASP  25          1HB       ASP  25 -14.805   2.383   3.260
  214    H    GLY  26           H        GLY  26 -15.251   2.501   6.116
  215   1HA   GLY  26          2HA       GLY  26 -17.798   2.622   7.225
  216   2HA   GLY  26          1HA       GLY  26 -17.844   1.392   5.966
  217    H    ASN  27           H        ASN  27 -16.797  -0.545   6.274
  218    HA   ASN  27           HA       ASN  27 -15.962  -1.065   9.029
  219   1HB   ASN  27          2HB       ASN  27 -17.696  -2.488   7.810
  220   2HB   ASN  27          1HB       ASN  27 -16.368  -3.087   6.822
  221   1HD2  ASN  27          1HD2      ASN  27 -16.633  -5.177   7.534
  222   2HD2  ASN  27          2HD2      ASN  27 -16.178  -5.679   9.131
  223    H    GLY  28           H        GLY  28 -14.240   0.434   7.334
  224   1HA   GLY  28          2HA       GLY  28 -11.775  -0.769   7.794
  225   2HA   GLY  28          1HA       GLY  28 -12.213  -1.124   6.129
  226    H    SER  29           H        SER  29 -10.044   0.519   7.224
  227    HA   SER  29           HA       SER  29 -10.772   3.177   6.239
  228   1HB   SER  29          2HB       SER  29  -8.227   2.282   7.615
  229   2HB   SER  29          1HB       SER  29  -8.724   3.944   7.290
  230    HG   SER  29           HG       SER  29 -10.704   2.800   8.603
  231    H    TYR  30           H        TYR  30 -10.032   3.931   4.334
  232    HA   TYR  30           HA       TYR  30  -8.069   2.309   2.860
  233   1HB   TYR  30          2HB       TYR  30  -9.469   2.176   0.916
  234   2HB   TYR  30          1HB       TYR  30 -10.419   1.614   2.281
  235    HD1  TYR  30           HD1      TYR  30 -10.968   4.565   3.293
  236    HD2  TYR  30           HD2      TYR  30 -11.400   2.599  -0.454
  237    HE1  TYR  30           HE1      TYR  30 -12.745   6.146   2.674
  238    HE2  TYR  30           HE2      TYR  30 -13.178   4.173  -1.081
  239    HH   TYR  30           HH       TYR  30 -14.896   5.628   0.276
  240    H    ILE  31           H        ILE  31  -8.113   3.599   0.464
  241    HA   ILE  31           HA       ILE  31  -6.877   6.140   1.068
  242    HB   ILE  31           HB       ILE  31  -7.416   4.956  -1.659
  243   1HG1  ILE  31          2HG1      ILE  31  -4.940   4.591   0.043
  244   2HG1  ILE  31          1HG1      ILE  31  -6.170   3.356  -0.207
  245   1HG2  ILE  31          1HG2      ILE  31  -6.799   7.309  -1.646
  246   2HG2  ILE  31          2HG2      ILE  31  -5.513   6.328  -2.349
  247   3HG2  ILE  31          3HG2      ILE  31  -5.358   6.937  -0.701
  248   1HD1  ILE  31          1HD1      ILE  31  -4.246   2.979  -1.636
  249   2HD1  ILE  31          2HD1      ILE  31  -4.437   4.584  -2.342
  250   3HD1  ILE  31          3HD1      ILE  31  -5.674   3.354  -2.602
  251    H    GLU  32           H        GLU  32  -7.829   8.090   0.880
  252    HA   GLU  32           HA       GLU  32 -10.230   8.282  -0.812
  253   1HB   GLU  32          2HB       GLU  32 -10.834   8.487   1.577
  254   2HB   GLU  32          1HB       GLU  32  -9.701   9.823   1.738
  255   1HG   GLU  32          2HG       GLU  32 -10.998  11.138   0.161
  256   2HG   GLU  32          1HG       GLU  32 -12.118   9.796  -0.058
  257    H    LYS  33           H        LYS  33  -7.651  10.178   0.727
  258    HA   LYS  33           HA       LYS  33  -7.698  12.049  -1.515
  259   1HB   LYS  33          2HB       LYS  33  -7.669  13.049   0.691
  260   2HB   LYS  33          1HB       LYS  33  -6.264  12.100   1.148
  261   1HG   LYS  33          2HG       LYS  33  -4.867  13.339  -0.353
  262   2HG   LYS  33          1HG       LYS  33  -6.255  14.180  -1.028
  263   1HD   LYS  33          2HD       LYS  33  -6.678  15.244   1.092
  264   2HD   LYS  33          1HD       LYS  33  -5.363  14.347   1.831
  265   1HE   LYS  33          2HE       LYS  33  -4.974  16.231  -0.479
  266   2HE   LYS  33          1HE       LYS  33  -4.860  16.741   1.204
  267   1HZ   LYS  33          1HZ       LYS  33  -3.169  14.684  -0.113
  268   2HZ   LYS  33          2HZ       LYS  33  -3.088  15.110   1.527
  269   3HZ   LYS  33          3HZ       LYS  33  -2.687  16.248   0.336
  270    H    TRP  34           H        TRP  34  -6.321  11.860  -3.144
  271    HA   TRP  34           HA       TRP  34  -3.770  10.467  -2.717
  272   1HB   TRP  34          2HB       TRP  34  -5.441   8.860  -3.635
  273   2HB   TRP  34          1HB       TRP  34  -5.667   9.922  -5.017
  274    HD1  TRP  34           HD1      TRP  34  -3.910   9.777  -6.961
  275    HE1  TRP  34           HE1      TRP  34  -1.962   8.171  -7.464
  276    HE3  TRP  34           HE3      TRP  34  -3.544   7.482  -2.405
  277    HZ2  TRP  34           HZ2      TRP  34  -0.468   6.207  -6.115
  278    HZ3  TRP  34           HZ3      TRP  34  -1.824   5.747  -2.098
  279    HH2  TRP  34           HH2      TRP  34  -0.319   5.123  -3.917
  280    H    ASN  35           H        ASN  35  -2.321  12.019  -3.146
  281    HA   ASN  35           HA       ASN  35  -2.725  13.619  -5.585
  282   1HB   ASN  35          2HB       ASN  35  -1.365  14.355  -2.999
  283   2HB   ASN  35          1HB       ASN  35  -1.126  15.267  -4.481
  284   1HD2  ASN  35          1HD2      ASN  35  -2.201  16.239  -2.045
  285   2HD2  ASN  35          2HD2      ASN  35  -3.835  16.754  -2.366
  286    H    LEU  36           H        LEU  36  -1.108  11.041  -4.571
  287    HA   LEU  36           HA       LEU  36   1.564  11.636  -5.394
  288   1HB   LEU  36          2HB       LEU  36   0.099   9.031  -4.998
  289   2HB   LEU  36          1HB       LEU  36   1.781   9.118  -5.471
  290    HG   LEU  36           HG       LEU  36   0.664  10.236  -2.910
  291   1HD1  LEU  36          1HD1      LEU  36   0.553   7.789  -3.005
  292   2HD1  LEU  36          2HD1      LEU  36   1.723   8.358  -1.818
  293   3HD1  LEU  36          3HD1      LEU  36   2.276   7.737  -3.373
  294   1HD2  LEU  36          1HD2      LEU  36   3.508   9.885  -3.850
  295   2HD2  LEU  36          2HD2      LEU  36   3.010  10.448  -2.255
  296   3HD2  LEU  36          3HD2      LEU  36   2.654  11.419  -3.685
  297    H    ARG  37           H        ARG  37   2.482  11.441  -7.376
  298    HA   ARG  37           HA       ARG  37   0.726  11.123  -9.640
  299   1HB   ARG  37          2HB       ARG  37   3.700  11.606  -9.464
  300   2HB   ARG  37          1HB       ARG  37   2.811  11.501 -10.979
  301   1HG   ARG  37          2HG       ARG  37   1.394  13.390 -10.209
  302   2HG   ARG  37          1HG       ARG  37   2.441  13.537  -8.797
  303   1HD   ARG  37          2HD       ARG  37   4.355  13.966 -10.267
  304   2HD   ARG  37          1HD       ARG  37   3.303  13.820 -11.678
  305    HE   ARG  37           HE       ARG  37   2.376  15.774  -9.795
  306   1HH1  ARG  37          1HH1      ARG  37   4.578  15.256 -12.476
  307   2HH1  ARG  37          2HH1      ARG  37   4.621  16.935 -12.922
  308   1HH2  ARG  37          1HH2      ARG  37   2.444  17.957 -10.366
  309   2HH2  ARG  37          2HH2      ARG  37   3.426  18.481 -11.700
  310    H    ALA  38           H        ALA  38   0.341   8.926  -8.543
  311    HA   ALA  38           HA       ALA  38   1.714   6.951 -10.203
  312   1HB   ALA  38          1HB       ALA  38   1.780   5.361  -8.329
  313   2HB   ALA  38          2HB       ALA  38   1.162   6.612  -7.252
  314   3HB   ALA  38          3HB       ALA  38   2.752   6.793  -7.993
  315    HA   PRO  39           HA       PRO  39  -2.473   5.733 -10.952
  316   1HB   PRO  39          2HB       PRO  39  -2.148   3.148 -11.684
  317   2HB   PRO  39          1HB       PRO  39  -1.660   4.496 -12.720
  318   1HG   PRO  39          2HG       PRO  39   0.014   2.784 -10.921
  319   2HG   PRO  39          1HG       PRO  39   0.360   3.357 -12.563
  320   1HD   PRO  39          2HD       PRO  39   1.396   4.530 -10.343
  321   2HD   PRO  39          1HD       PRO  39   1.049   5.424 -11.835
  322    H    LEU  40           H        LEU  40  -4.191   4.771  -9.930
  323    HA   LEU  40           HA       LEU  40  -3.905   3.882  -7.283
  324   1HB   LEU  40          2HB       LEU  40  -6.135   3.906  -9.272
  325   2HB   LEU  40          1HB       LEU  40  -6.327   2.987  -7.799
  326    HG   LEU  40           HG       LEU  40  -7.354   5.160  -7.538
  327   1HD1  LEU  40          1HD1      LEU  40  -6.281   4.166  -5.580
  328   2HD1  LEU  40          2HD1      LEU  40  -6.224   5.927  -5.534
  329   3HD1  LEU  40          3HD1      LEU  40  -4.783   5.013  -5.972
  330   1HD2  LEU  40          1HD2      LEU  40  -6.045   7.231  -7.629
  331   2HD2  LEU  40          2HD2      LEU  40  -6.072   6.409  -9.190
  332   3HD2  LEU  40          3HD2      LEU  40  -4.638   6.314  -8.170
  333    HA   PRO  41           HA       PRO  41  -2.571  -0.259  -7.997
  334   1HB   PRO  41          2HB       PRO  41  -3.038  -1.233  -5.499
  335   2HB   PRO  41          1HB       PRO  41  -1.666  -0.196  -5.901
  336   1HG   PRO  41          2HG       PRO  41  -4.279   0.528  -4.635
  337   2HG   PRO  41          1HG       PRO  41  -2.643   1.067  -4.210
  338   1HD   PRO  41          2HD       PRO  41  -4.329   2.595  -5.653
  339   2HD   PRO  41          1HD       PRO  41  -2.575   2.620  -5.910
  340    H    THR  42           H        THR  42  -3.330  -2.493  -7.719
  341    HA   THR  42           HA       THR  42  -6.242  -2.621  -8.128
  342    HB   THR  42           HB       THR  42  -5.771  -4.832  -9.200
  343    HG1  THR  42           HG1      THR  42  -3.059  -4.098  -9.374
  344   1HG2  THR  42          1HG2      THR  42  -4.321  -2.464 -10.385
  345   2HG2  THR  42          2HG2      THR  42  -6.036  -2.829 -10.569
  346   3HG2  THR  42          3HG2      THR  42  -4.825  -3.904 -11.270
  347    H    GLN  43           H        GLN  43  -7.310  -4.637  -7.363
  348    HA   GLN  43           HA       GLN  43  -6.955  -5.132  -4.637
  349   1HB   GLN  43          2HB       GLN  43  -8.980  -5.654  -6.067
  350   2HB   GLN  43          1HB       GLN  43  -8.132  -7.080  -6.621
  351   1HG   GLN  43          2HG       GLN  43  -9.692  -7.634  -4.855
  352   2HG   GLN  43          1HG       GLN  43  -8.030  -7.931  -4.351
  353   1HE2  GLN  43          1HE2      GLN  43  -8.552  -7.824  -2.182
  354   2HE2  GLN  43          2HE2      GLN  43  -8.943  -6.337  -1.392
  355    H    ALA  44           H        ALA  44  -5.886  -6.930  -7.464
  356    HA   ALA  44           HA       ALA  44  -4.580  -9.053  -6.245
  357   1HB   ALA  44          1HB       ALA  44  -4.923  -8.886  -8.662
  358   2HB   ALA  44          2HB       ALA  44  -3.233  -9.214  -8.273
  359   3HB   ALA  44          3HB       ALA  44  -3.732  -7.589  -8.741
  360    H    GLU  45           H        GLU  45  -3.264  -5.852  -7.094
  361    HA   GLU  45           HA       GLU  45  -0.699  -6.180  -6.042
  362   1HB   GLU  45          2HB       GLU  45  -2.462  -3.811  -6.521
  363   2HB   GLU  45          1HB       GLU  45  -0.951  -3.589  -5.662
  364   1HG   GLU  45          2HG       GLU  45   0.232  -4.600  -7.584
  365   2HG   GLU  45          1HG       GLU  45  -1.307  -4.663  -8.446
  366    H    LEU  46           H        LEU  46  -3.589  -4.791  -4.483
  367    HA   LEU  46           HA       LEU  46  -2.500  -4.109  -2.048
  368   1HB   LEU  46          2HB       LEU  46  -5.260  -5.178  -2.616
  369   2HB   LEU  46          1HB       LEU  46  -4.789  -4.323  -1.165
  370    HG   LEU  46           HG       LEU  46  -4.746  -3.153  -3.944
  371   1HD1  LEU  46          1HD1      LEU  46  -6.668  -1.843  -3.189
  372   2HD1  LEU  46          2HD1      LEU  46  -6.676  -2.737  -1.670
  373   3HD1  LEU  46          3HD1      LEU  46  -7.016  -3.571  -3.184
  374   1HD2  LEU  46          1HD2      LEU  46  -4.322  -1.856  -1.252
  375   2HD2  LEU  46          2HD2      LEU  46  -4.372  -1.029  -2.808
  376   3HD2  LEU  46          3HD2      LEU  46  -3.071  -2.165  -2.455
  377    H    GLU  47           H        GLU  47  -4.009  -7.207  -2.939
  378    HA   GLU  47           HA       GLU  47  -3.598  -8.386  -0.402
  379   1HB   GLU  47          2HB       GLU  47  -4.125  -9.652  -3.084
  380   2HB   GLU  47          1HB       GLU  47  -4.131 -10.521  -1.552
  381   1HG   GLU  47          2HG       GLU  47  -5.925  -9.061  -0.751
  382   2HG   GLU  47          1HG       GLU  47  -5.943  -8.250  -2.315
  383    H    THR  48           H        THR  48  -1.644  -8.267  -3.331
  384    HA   THR  48           HA       THR  48   0.218 -10.265  -2.598
  385    HB   THR  48           HB       THR  48   0.697  -7.812  -4.323
  386    HG1  THR  48           HG1      THR  48  -0.946  -9.091  -5.202
  387   1HG2  THR  48          1HG2      THR  48   2.541  -9.077  -5.286
  388   2HG2  THR  48          2HG2      THR  48   2.204 -10.430  -4.210
  389   3HG2  THR  48          3HG2      THR  48   2.778  -8.900  -3.546
  390    H    TRP  49           H        TRP  49   0.187  -6.741  -2.068
  391    HA   TRP  49           HA       TRP  49   2.685  -6.598  -0.763
  392   1HB   TRP  49          2HB       TRP  49   0.307  -4.803  -0.244
  393   2HB   TRP  49          1HB       TRP  49   2.005  -4.417   0.010
  394    HD1  TRP  49           HD1      TRP  49   2.706  -5.731  -3.038
  395    HE1  TRP  49           HE1      TRP  49   2.278  -4.176  -5.046
  396    HE3  TRP  49           HE3      TRP  49  -0.421  -2.375  -0.805
  397    HZ2  TRP  49           HZ2      TRP  49   0.805  -1.822  -5.591
  398    HZ3  TRP  49           HZ3      TRP  49  -1.283  -0.498  -2.128
  399    HH2  TRP  49           HH2      TRP  49  -0.676  -0.228  -4.468
  400    H    TRP  50           H        TRP  50  -0.611  -7.056   0.420
  401    HA   TRP  50           HA       TRP  50  -0.015  -7.083   3.168
  402   1HB   TRP  50          2HB       TRP  50  -2.307  -6.902   2.129
  403   2HB   TRP  50          1HB       TRP  50  -2.220  -8.625   1.786
  404    HD1  TRP  50           HD1      TRP  50  -2.921 -10.247   3.690
  405    HE1  TRP  50           HE1      TRP  50  -3.699  -9.938   6.132
  406    HE3  TRP  50           HE3      TRP  50  -1.862  -5.279   4.252
  407    HZ2  TRP  50           HZ2      TRP  50  -3.832  -7.854   8.039
  408    HZ3  TRP  50           HZ3      TRP  50  -2.344  -4.206   6.413
  409    HH2  TRP  50           HH2      TRP  50  -3.307  -5.466   8.264
  410    H    GLU  51           H        GLU  51  -0.208  -9.684   0.761
  411    HA   GLU  51           HA       GLU  51   0.374 -11.807   2.480
  412   1HB   GLU  51          2HB       GLU  51   0.370 -11.336  -0.435
  413   2HB   GLU  51          1HB       GLU  51   1.349 -12.678   0.121
  414   1HG   GLU  51          2HG       GLU  51  -0.620 -13.574   1.310
  415   2HG   GLU  51          1HG       GLU  51  -1.581 -12.263   0.638
  416    H    GLU  52           H        GLU  52   2.550  -9.827   0.453
  417    HA   GLU  52           HA       GLU  52   4.902 -11.157   1.241
  418   1HB   GLU  52          2HB       GLU  52   4.436  -8.384   0.170
  419   2HB   GLU  52          1HB       GLU  52   6.042  -8.992   0.542
  420   1HG   GLU  52          2HG       GLU  52   5.657 -10.855  -1.033
  421   2HG   GLU  52          1HG       GLU  52   4.111 -10.128  -1.460
  422    H    LEU  53           H        LEU  53   3.145  -8.449   2.659
  423    HA   LEU  53           HA       LEU  53   5.100  -7.711   4.552
  424   1HB   LEU  53          2HB       LEU  53   3.195  -6.293   3.931
  425   2HB   LEU  53          1HB       LEU  53   2.095  -7.437   4.672
  426    HG   LEU  53           HG       LEU  53   3.183  -6.981   6.868
  427   1HD1  LEU  53          1HD1      LEU  53   4.554  -4.775   5.337
  428   2HD1  LEU  53          2HD1      LEU  53   5.335  -6.188   6.045
  429   3HD1  LEU  53          3HD1      LEU  53   4.575  -4.987   7.090
  430   1HD2  LEU  53          1HD2      LEU  53   2.013  -4.589   5.454
  431   2HD2  LEU  53          2HD2      LEU  53   2.099  -4.825   7.200
  432   3HD2  LEU  53          3HD2      LEU  53   1.098  -5.890   6.214
  433    H    GLN  54           H        GLN  54   2.696 -10.240   4.503
  434    HA   GLN  54           HA       GLN  54   3.023 -10.832   7.320
  435   1HB   GLN  54          2HB       GLN  54   1.297 -11.982   5.142
  436   2HB   GLN  54          1HB       GLN  54   1.347 -12.626   6.771
  437   1HG   GLN  54          2HG       GLN  54   0.598  -9.800   6.081
  438   2HG   GLN  54          1HG       GLN  54  -0.553 -11.106   6.366
  439   1HE2  GLN  54          1HE2      GLN  54   1.787  -8.970   7.824
  440   2HE2  GLN  54          2HE2      GLN  54   1.317  -9.264   9.460
  441    H    LYS  55           H        LYS  55   3.841 -12.242   4.184
  442    HA   LYS  55           HA       LYS  55   4.791 -14.679   5.436
  443   1HB   LYS  55          2HB       LYS  55   3.479 -14.469   3.221
  444   2HB   LYS  55          1HB       LYS  55   5.037 -14.041   2.525
  445   1HG   LYS  55          2HG       LYS  55   5.969 -16.153   3.225
  446   2HG   LYS  55          1HG       LYS  55   4.454 -16.584   4.024
  447   1HD   LYS  55          2HD       LYS  55   3.315 -16.408   1.817
  448   2HD   LYS  55          1HD       LYS  55   4.897 -16.158   1.076
  449   1HE   LYS  55          2HE       LYS  55   5.633 -18.330   1.769
  450   2HE   LYS  55          1HE       LYS  55   4.168 -18.572   2.721
  451   1HZ   LYS  55          1HZ       LYS  55   2.890 -18.464   0.637
  452   2HZ   LYS  55          2HZ       LYS  55   3.980 -19.761   0.666
  453   3HZ   LYS  55          3HZ       LYS  55   4.340 -18.370  -0.238
  454    H    ASN  56           H        ASN  56   6.048 -11.715   4.473
  455    HA   ASN  56           HA       ASN  56   8.793 -12.772   4.596
  456   1HB   ASN  56          2HB       ASN  56   8.434 -11.592   2.509
  457   2HB   ASN  56          1HB       ASN  56   7.762 -10.208   3.354
  458   1HD2  ASN  56          1HD2      ASN  56   9.097  -8.723   4.221
  459   2HD2  ASN  56          2HD2      ASN  56  10.815  -8.756   4.014
  460    HA   PRO  57           HA       PRO  57   8.763 -10.942   8.630
  461   1HB   PRO  57          2HB       PRO  57  11.626 -11.518   8.687
  462   2HB   PRO  57          1HB       PRO  57  10.330 -12.217   9.657
  463   1HG   PRO  57          2HG       PRO  57  11.635 -13.626   7.758
  464   2HG   PRO  57          1HG       PRO  57   9.926 -13.903   8.142
  465   1HD   PRO  57          2HD       PRO  57  11.138 -12.369   5.868
  466   2HD   PRO  57          1HD       PRO  57   9.755 -13.488   5.866
  467    HA   PRO  58           HA       PRO  58  10.571  -6.945   7.512
  468   1HB   PRO  58          2HB       PRO  58   9.020  -5.877   9.712
  469   2HB   PRO  58          1HB       PRO  58   8.821  -5.590   7.983
  470   1HG   PRO  58          2HG       PRO  58   7.029  -6.984   9.511
  471   2HG   PRO  58          1HG       PRO  58   7.234  -7.219   7.769
  472   1HD   PRO  58          2HD       PRO  58   8.284  -8.860  10.041
  473   2HD   PRO  58          1HD       PRO  58   7.647  -9.384   8.466
  474    H    TYR  59           H        TYR  59  12.321  -5.959   8.400
  475    HA   TYR  59           HA       TYR  59  13.335  -7.148  10.846
  476   1HB   TYR  59          2HB       TYR  59  14.797  -6.950   8.839
  477   2HB   TYR  59          1HB       TYR  59  14.706  -5.196   8.982
  478    HD1  TYR  59           HD1      TYR  59  15.765  -8.251  10.808
  479    HD2  TYR  59           HD2      TYR  59  16.208  -4.042  10.379
  480    HE1  TYR  59           HE1      TYR  59  17.657  -8.294  12.377
  481    HE2  TYR  59           HE2      TYR  59  18.103  -4.075  11.944
  482    HH   TYR  59           HH       TYR  59  19.002  -5.447  13.715
  483    H    GLU  60           H        GLU  60  13.111  -6.247  12.739
  484    HA   GLU  60           HA       GLU  60  12.485  -3.385  12.905
  485   1HB   GLU  60          2HB       GLU  60  10.934  -5.027  13.966
  486   2HB   GLU  60          1HB       GLU  60  12.243  -5.536  15.024
  487   1HG   GLU  60          2HG       GLU  60  12.336  -3.320  16.007
  488   2HG   GLU  60          1HG       GLU  60  11.074  -2.763  14.909
  Start of MODEL    7
    1   1H    MET   1          1H        MET   1  -9.948  -4.003   5.254
    2   2H    MET   1          2H        MET   1  -9.558  -4.428   6.848
    3   3H    MET   1          3H        MET   1  -9.813  -5.640   5.684
    4    HA   MET   1           HA       MET   1  -7.469  -5.376   6.119
    5   1HB   MET   1          2HB       MET   1  -8.151  -6.052   3.875
    6   2HB   MET   1          1HB       MET   1  -8.361  -4.371   3.408
    7   1HG   MET   1          2HG       MET   1  -5.940  -4.015   3.772
    8   2HG   MET   1          1HG       MET   1  -5.772  -5.737   4.106
    9   1HE   MET   1          1HE       MET   1  -4.124  -5.298   0.556
   10   2HE   MET   1          2HE       MET   1  -3.877  -5.854   2.212
   11   3HE   MET   1          3HE       MET   1  -4.098  -4.135   1.883
   12    H    ILE   2           H        ILE   2  -5.775  -4.085   6.620
   13    HA   ILE   2           HA       ILE   2  -6.279  -1.226   6.767
   14    HB   ILE   2           HB       ILE   2  -3.817  -2.740   7.655
   15   1HG1  ILE   2          2HG1      ILE   2  -4.843  -2.191   9.988
   16   2HG1  ILE   2          1HG1      ILE   2  -6.353  -2.011   9.107
   17   1HG2  ILE   2          1HG2      ILE   2  -3.350  -0.417   7.246
   18   2HG2  ILE   2          2HG2      ILE   2  -3.366  -0.706   8.987
   19   3HG2  ILE   2          3HG2      ILE   2  -4.745   0.071   8.207
   20   1HD1  ILE   2          1HD1      ILE   2  -6.171  -4.223  10.089
   21   2HD1  ILE   2          2HD1      ILE   2  -4.664  -4.501   9.217
   22   3HD1  ILE   2          3HD1      ILE   2  -6.177  -4.322   8.327
   23    H    LEU   3           H        LEU   3  -5.861  -0.025   5.067
   24    HA   LEU   3           HA       LEU   3  -4.339  -0.902   2.854
   25   1HB   LEU   3          2HB       LEU   3  -5.972   1.409   3.632
   26   2HB   LEU   3          1HB       LEU   3  -4.687   1.776   2.513
   27    HG   LEU   3           HG       LEU   3  -6.748   1.344   1.319
   28   1HD1  LEU   3          1HD1      LEU   3  -4.774  -0.904   0.974
   29   2HD1  LEU   3          2HD1      LEU   3  -4.664   0.698   0.245
   30   3HD1  LEU   3          3HD1      LEU   3  -5.974  -0.390  -0.211
   31   1HD2  LEU   3          1HD2      LEU   3  -6.685  -1.375   2.626
   32   2HD2  LEU   3          2HD2      LEU   3  -7.812  -0.864   1.369
   33   3HD2  LEU   3          3HD2      LEU   3  -7.846  -0.088   2.953
   34    H    TYR   4           H        TYR   4  -3.681   1.159   5.576
   35    HA   TYR   4           HA       TYR   4  -1.592   2.711   4.702
   36   1HB   TYR   4          2HB       TYR   4  -2.598   3.066   6.860
   37   2HB   TYR   4          1HB       TYR   4  -2.084   1.478   7.415
   38    HD1  TYR   4           HD1      TYR   4   0.155   1.098   8.208
   39    HD2  TYR   4           HD2      TYR   4  -0.976   4.896   6.659
   40    HE1  TYR   4           HE1      TYR   4   2.202   2.082   9.147
   41    HE2  TYR   4           HE2      TYR   4   1.070   5.889   7.589
   42    HH   TYR   4           HH       TYR   4   3.665   4.038   8.690
   43    H    ASP   5           H        ASP   5  -1.378  -0.523   6.147
   44    HA   ASP   5           HA       ASP   5   1.413  -0.709   6.190
   45   1HB   ASP   5          2HB       ASP   5  -0.745  -2.809   6.105
   46   2HB   ASP   5          1HB       ASP   5   0.960  -3.205   6.260
   47    H    ALA   6           H        ALA   6  -0.918  -1.951   3.821
   48    HA   ALA   6           HA       ALA   6   0.921  -3.188   2.113
   49   1HB   ALA   6          1HB       ALA   6  -1.491  -3.593   2.012
   50   2HB   ALA   6          2HB       ALA   6  -0.844  -3.138   0.435
   51   3HB   ALA   6          3HB       ALA   6  -1.736  -1.958   1.394
   52    H    ILE   7           H        ILE   7  -0.371   0.107   2.072
   53    HA   ILE   7           HA       ILE   7   0.815   0.924  -0.351
   54    HB   ILE   7           HB       ILE   7   0.077   2.620   2.038
   55   1HG1  ILE   7          2HG1      ILE   7  -1.523   2.045  -0.462
   56   2HG1  ILE   7          1HG1      ILE   7  -1.773   1.226   1.076
   57   1HG2  ILE   7          1HG2      ILE   7   0.532   3.394  -0.844
   58   2HG2  ILE   7          2HG2      ILE   7   1.575   3.789   0.523
   59   3HG2  ILE   7          3HG2      ILE   7  -0.051   4.465   0.434
   60   1HD1  ILE   7          1HD1      ILE   7  -3.396   2.995   0.758
   61   2HD1  ILE   7          2HD1      ILE   7  -2.099   4.176   0.573
   62   3HD1  ILE   7          3HD1      ILE   7  -2.334   3.361   2.118
   63    H    MET   8           H        MET   8   1.921   1.230   3.028
   64    HA   MET   8           HA       MET   8   4.243   2.728   2.247
   65   1HB   MET   8          2HB       MET   8   3.129   3.089   4.411
   66   2HB   MET   8          1HB       MET   8   3.564   1.462   4.906
   67   1HG   MET   8          2HG       MET   8   5.837   1.983   5.043
   68   2HG   MET   8          1HG       MET   8   5.637   3.470   4.119
   69   1HE   MET   8          1HE       MET   8   3.848   5.826   6.620
   70   2HE   MET   8          2HE       MET   8   3.140   4.828   5.352
   71   3HE   MET   8          3HE       MET   8   4.649   5.690   5.056
   72    H    TYR   9           H        TYR   9   3.473  -0.591   2.493
   73    HA   TYR   9           HA       TYR   9   6.103  -1.612   2.815
   74   1HB   TYR   9          2HB       TYR   9   4.150  -3.025   3.198
   75   2HB   TYR   9          1HB       TYR   9   3.654  -2.840   1.522
   76    HD1  TYR   9           HD1      TYR   9   4.406  -4.340  -0.110
   77    HD2  TYR   9           HD2      TYR   9   6.375  -4.205   3.660
   78    HE1  TYR   9           HE1      TYR   9   5.692  -6.341  -0.721
   79    HE2  TYR   9           HE2      TYR   9   7.677  -6.204   3.055
   80    HH   TYR   9           HH       TYR   9   7.613  -7.535  -0.173
   81    H    LYS  10           H        LYS  10   4.094  -0.855  -0.006
   82    HA   LYS  10           HA       LYS  10   6.200  -1.571  -1.850
   83   1HB   LYS  10          2HB       LYS  10   3.828  -1.923  -2.428
   84   2HB   LYS  10          1HB       LYS  10   3.562  -0.189  -2.363
   85   1HG   LYS  10          2HG       LYS  10   3.780  -0.998  -4.657
   86   2HG   LYS  10          1HG       LYS  10   5.054   0.147  -4.241
   87   1HD   LYS  10          2HD       LYS  10   6.608  -1.693  -3.870
   88   2HD   LYS  10          1HD       LYS  10   5.333  -2.858  -4.228
   89   1HE   LYS  10          2HE       LYS  10   6.284  -0.765  -6.180
   90   2HE   LYS  10          1HE       LYS  10   6.936  -2.402  -6.112
   91   1HZ   LYS  10          1HZ       LYS  10   4.802  -3.295  -6.654
   92   2HZ   LYS  10          2HZ       LYS  10   5.172  -2.101  -7.798
   93   3HZ   LYS  10          3HZ       LYS  10   4.066  -1.773  -6.563
   94    H    TYR  11           H        TYR  11   4.826   1.405  -0.534
   95    HA   TYR  11           HA       TYR  11   7.055   2.856  -1.801
   96   1HB   TYR  11          2HB       TYR  11   4.224   3.823  -1.362
   97   2HB   TYR  11          1HB       TYR  11   5.554   4.868  -1.846
   98    HD1  TYR  11           HD1      TYR  11   6.795   4.236  -4.021
   99    HD2  TYR  11           HD2      TYR  11   2.953   2.719  -2.987
  100    HE1  TYR  11           HE1      TYR  11   6.387   3.672  -6.378
  101    HE2  TYR  11           HE2      TYR  11   2.539   2.151  -5.344
  102    HH   TYR  11           HH       TYR  11   3.344   2.901  -7.591
  103    HA   PRO  12           HA       PRO  12   7.795   3.397   2.653
  104   1HB   PRO  12          2HB       PRO  12  10.431   4.223   1.628
  105   2HB   PRO  12          1HB       PRO  12  10.029   2.982   2.816
  106   1HG   PRO  12          2HG       PRO  12  10.887   2.337   0.366
  107   2HG   PRO  12          1HG       PRO  12   9.656   1.368   1.202
  108   1HD   PRO  12          2HD       PRO  12   9.312   3.416  -0.960
  109   2HD   PRO  12          1HD       PRO  12   8.515   1.838  -0.767
  110    H    ASN  13           H        ASN  13   8.407   5.557  -0.048
  111    HA   ASN  13           HA       ASN  13   8.747   7.856   1.683
  112   1HB   ASN  13          2HB       ASN  13   8.898   7.433  -1.284
  113   2HB   ASN  13          1HB       ASN  13   8.764   9.059  -0.624
  114   1HD2  ASN  13          1HD2      ASN  13  10.789   6.319  -1.086
  115   2HD2  ASN  13          2HD2      ASN  13  12.242   7.022  -0.459
  116    H    ALA  14           H        ALA  14   6.124   6.199   1.034
  117    HA   ALA  14           HA       ALA  14   4.360   8.271   0.095
  118   1HB   ALA  14          1HB       ALA  14   3.882   5.932  -0.417
  119   2HB   ALA  14          2HB       ALA  14   2.570   6.649   0.515
  120   3HB   ALA  14          3HB       ALA  14   3.726   5.575   1.303
  121    H    VAL  15           H        VAL  15   3.995   9.965   1.368
  122    HA   VAL  15           HA       VAL  15   4.045   9.677   4.260
  123    HB   VAL  15           HB       VAL  15   3.496  12.189   2.681
  124   1HG1  VAL  15          1HG1      VAL  15   4.485  11.753   5.502
  125   2HG1  VAL  15          2HG1      VAL  15   2.866  12.276   5.041
  126   3HG1  VAL  15          3HG1      VAL  15   4.252  13.319   4.723
  127   1HG2  VAL  15          1HG2      VAL  15   6.151  11.143   3.670
  128   2HG2  VAL  15          2HG2      VAL  15   5.871  12.720   2.933
  129   3HG2  VAL  15          3HG2      VAL  15   5.644  11.252   1.984
  130    H    SER  16           H        SER  16   2.275   8.862   5.127
  131    HA   SER  16           HA       SER  16  -0.304   9.056   3.973
  132   1HB   SER  16          2HB       SER  16   0.443   8.235   6.788
  133   2HB   SER  16          1HB       SER  16  -1.052   7.845   5.935
  134    HG   SER  16           HG       SER  16   0.974   7.081   4.405
  135    H    ARG  17           H        ARG  17  -2.017  10.310   4.450
  136    HA   ARG  17           HA       ARG  17  -3.327  11.935   5.321
  137   1HB   ARG  17          2HB       ARG  17  -1.360  11.868   7.608
  138   2HB   ARG  17          1HB       ARG  17  -2.797  12.879   7.587
  139   1HG   ARG  17          2HG       ARG  17  -4.171  10.826   7.333
  140   2HG   ARG  17          1HG       ARG  17  -2.700   9.874   7.529
  141   1HD   ARG  17          2HD       ARG  17  -3.883  10.028   9.639
  142   2HD   ARG  17          1HD       ARG  17  -2.350  10.895   9.736
  143    HE   ARG  17           HE       ARG  17  -4.139  12.824   9.045
  144   1HH1  ARG  17          1HH1      ARG  17  -3.986  10.454  11.616
  145   2HH1  ARG  17          2HH1      ARG  17  -4.881  11.428  12.747
  146   1HH2  ARG  17          1HH2      ARG  17  -5.316  14.116  10.522
  147   2HH2  ARG  17          2HH2      ARG  17  -5.626  13.524  12.128
  148    H    LYS  18           H        LYS  18  -0.562  12.367   3.892
  149    HA   LYS  18           HA       LYS  18  -0.698  15.298   4.144
  150   1HB   LYS  18          2HB       LYS  18   1.506  14.455   4.785
  151   2HB   LYS  18          1HB       LYS  18   1.646  13.601   3.254
  152   1HG   LYS  18          2HG       LYS  18   1.572  15.777   2.077
  153   2HG   LYS  18          1HG       LYS  18   1.544  16.586   3.646
  154   1HD   LYS  18          2HD       LYS  18   3.712  15.702   4.200
  155   2HD   LYS  18          1HD       LYS  18   3.725  14.708   2.743
  156   1HE   LYS  18          2HE       LYS  18   5.114  16.660   2.418
  157   2HE   LYS  18          1HE       LYS  18   3.698  16.748   1.371
  158   1HZ   LYS  18          1HZ       LYS  18   4.002  18.167   3.967
  159   2HZ   LYS  18          2HZ       LYS  18   2.676  18.285   2.916
  160   3HZ   LYS  18          3HZ       LYS  18   4.188  18.874   2.436
  161    H    ASP  19           H        ASP  19   0.632  13.139   1.668
  162    HA   ASP  19           HA       ASP  19  -0.745  14.721  -0.353
  163   1HB   ASP  19          2HB       ASP  19   1.416  12.626  -0.522
  164   2HB   ASP  19          1HB       ASP  19   0.624  13.293  -1.947
  165    H    PHE  20           H        PHE  20  -0.707  11.477   0.968
  166    HA   PHE  20           HA       PHE  20  -3.305  11.132  -0.347
  167   1HB   PHE  20          2HB       PHE  20  -2.966   8.837  -0.740
  168   2HB   PHE  20          1HB       PHE  20  -1.460   9.588  -1.247
  169    HD1  PHE  20           HD1      PHE  20   0.535   9.445   0.266
  170    HD2  PHE  20           HD2      PHE  20  -3.030   7.227   0.949
  171    HE1  PHE  20           HE1      PHE  20   1.770   7.913   1.739
  172    HE2  PHE  20           HE2      PHE  20  -1.802   5.695   2.426
  173    HZ   PHE  20           HZ       PHE  20   0.600   6.034   2.823
  174    H    GLU  21           H        GLU  21  -4.944  10.511   0.979
  175    HA   GLU  21           HA       GLU  21  -4.229   9.994   3.779
  176   1HB   GLU  21          2HB       GLU  21  -4.831  12.388   3.481
  177   2HB   GLU  21          1HB       GLU  21  -6.413  11.888   2.898
  178   1HG   GLU  21          2HG       GLU  21  -6.979  10.951   5.019
  179   2HG   GLU  21          1HG       GLU  21  -5.337  11.180   5.615
  180    H    LEU  22           H        LEU  22  -5.476   8.582   4.842
  181    HA   LEU  22           HA       LEU  22  -7.381   7.074   3.233
  182   1HB   LEU  22          2HB       LEU  22  -6.447   6.423   6.015
  183   2HB   LEU  22          1HB       LEU  22  -7.177   5.343   4.850
  184    HG   LEU  22           HG       LEU  22  -4.415   6.542   4.625
  185   1HD1  LEU  22          1HD1      LEU  22  -5.324   3.745   5.281
  186   2HD1  LEU  22          2HD1      LEU  22  -4.532   4.875   6.380
  187   3HD1  LEU  22          3HD1      LEU  22  -3.656   4.233   4.991
  188   1HD2  LEU  22          1HD2      LEU  22  -5.810   4.510   2.885
  189   2HD2  LEU  22          2HD2      LEU  22  -4.141   5.053   2.716
  190   3HD2  LEU  22          3HD2      LEU  22  -5.467   6.182   2.442
  191    H    ARG  23           H        ARG  23  -9.479   6.733   3.877
  192    HA   ARG  23           HA       ARG  23 -10.431   8.211   6.227
  193   1HB   ARG  23          2HB       ARG  23 -11.491   8.390   3.433
  194   2HB   ARG  23          1HB       ARG  23 -12.600   8.542   4.789
  195   1HG   ARG  23          2HG       ARG  23 -12.097  10.717   4.583
  196   2HG   ARG  23          1HG       ARG  23 -10.714  10.270   5.575
  197   1HD   ARG  23          2HD       ARG  23  -9.446   9.878   3.429
  198   2HD   ARG  23          1HD       ARG  23 -10.799  10.627   2.584
  199    HE   ARG  23           HE       ARG  23  -9.114  12.001   4.586
  200   1HH1  ARG  23          1HH1      ARG  23 -11.133  12.086   1.694
  201   2HH1  ARG  23          2HH1      ARG  23 -10.796  13.767   1.395
  202   1HH2  ARG  23          1HH2      ARG  23  -8.673  14.168   4.144
  203   2HH2  ARG  23          2HH2      ARG  23  -9.416  14.948   2.768
  204    H    ASN  24           H        ASN  24 -12.752   7.524   6.710
  205    HA   ASN  24           HA       ASN  24 -12.566   4.616   6.938
  206   1HB   ASN  24          2HB       ASN  24 -12.861   5.741   9.032
  207   2HB   ASN  24          1HB       ASN  24 -14.232   6.658   8.414
  208   1HD2  ASN  24          1HD2      ASN  24 -16.229   5.756   8.411
  209   2HD2  ASN  24          2HD2      ASN  24 -16.588   4.203   9.081
  210    H    ASP  25           H        ASP  25 -13.593   3.398   5.548
  211    HA   ASP  25           HA       ASP  25 -15.991   4.313   4.190
  212   1HB   ASP  25          2HB       ASP  25 -15.803   2.358   2.871
  213   2HB   ASP  25          1HB       ASP  25 -14.137   2.849   3.156
  214    H    GLY  26           H        GLY  26 -15.041   2.450   6.904
  215   1HA   GLY  26          2HA       GLY  26 -16.977   2.100   8.512
  216   2HA   GLY  26          1HA       GLY  26 -17.721   1.258   7.158
  217    H    ASN  27           H        ASN  27 -15.384   0.010   6.148
  218    HA   ASN  27           HA       ASN  27 -15.142  -2.130   8.084
  219   1HB   ASN  27          2HB       ASN  27 -15.574  -2.569   5.652
  220   2HB   ASN  27          1HB       ASN  27 -13.952  -1.978   5.314
  221   1HD2  ASN  27          1HD2      ASN  27 -12.194  -3.274   5.776
  222   2HD2  ASN  27          2HD2      ASN  27 -12.362  -4.929   6.255
  223    H    GLY  28           H        GLY  28 -13.345   0.507   6.915
  224   1HA   GLY  28          2HA       GLY  28 -11.508   0.531   8.989
  225   2HA   GLY  28          1HA       GLY  28 -10.750  -0.360   7.678
  226    H    SER  29           H        SER  29  -9.182   1.377   7.747
  227    HA   SER  29           HA       SER  29 -10.076   3.872   6.498
  228   1HB   SER  29          2HB       SER  29  -7.305   3.180   7.510
  229   2HB   SER  29          1HB       SER  29  -7.941   4.782   7.135
  230    HG   SER  29           HG       SER  29  -9.600   4.041   8.858
  231    H    TYR  30           H        TYR  30 -10.096   3.876   4.337
  232    HA   TYR  30           HA       TYR  30  -8.047   2.285   2.933
  233   1HB   TYR  30          2HB       TYR  30  -9.588   1.773   1.211
  234   2HB   TYR  30          1HB       TYR  30 -10.466   1.515   2.707
  235    HD1  TYR  30           HD1      TYR  30 -11.652   3.890   3.518
  236    HD2  TYR  30           HD2      TYR  30 -10.818   2.675  -0.466
  237    HE1  TYR  30           HE1      TYR  30 -13.421   5.386   2.698
  238    HE2  TYR  30           HE2      TYR  30 -12.584   4.166  -1.304
  239    HH   TYR  30           HH       TYR  30 -14.681   5.228  -0.421
  240    H    ILE  31           H        ILE  31  -7.863   3.117   0.573
  241    HA   ILE  31           HA       ILE  31  -6.798   5.760   0.719
  242    HB   ILE  31           HB       ILE  31  -7.301   4.107  -1.760
  243   1HG1  ILE  31          2HG1      ILE  31  -4.817   4.232  -0.040
  244   2HG1  ILE  31          1HG1      ILE  31  -5.941   2.881  -0.090
  245   1HG2  ILE  31          1HG2      ILE  31  -6.853   6.444  -2.234
  246   2HG2  ILE  31          2HG2      ILE  31  -5.477   5.450  -2.716
  247   3HG2  ILE  31          3HG2      ILE  31  -5.404   6.392  -1.227
  248   1HD1  ILE  31          1HD1      ILE  31  -3.937   2.464  -1.422
  249   2HD1  ILE  31          2HD1      ILE  31  -4.310   3.873  -2.416
  250   3HD1  ILE  31          3HD1      ILE  31  -5.391   2.481  -2.420
  251    H    GLU  32           H        GLU  32  -8.003   7.545   0.668
  252    HA   GLU  32           HA       GLU  32 -10.362   7.536  -1.099
  253   1HB   GLU  32          2HB       GLU  32 -10.691   7.607   1.484
  254   2HB   GLU  32          1HB       GLU  32 -10.173   9.278   1.341
  255   1HG   GLU  32          2HG       GLU  32 -12.446   8.158  -0.264
  256   2HG   GLU  32          1HG       GLU  32 -12.668   8.821   1.351
  257    H    LYS  33           H        LYS  33  -8.030   9.699   0.522
  258    HA   LYS  33           HA       LYS  33  -8.254  11.552  -1.734
  259   1HB   LYS  33          2HB       LYS  33  -8.453  12.384   0.637
  260   2HB   LYS  33          1HB       LYS  33  -6.775  11.924   0.878
  261   1HG   LYS  33          2HG       LYS  33  -6.858  14.270   0.465
  262   2HG   LYS  33          1HG       LYS  33  -6.151  13.492  -0.948
  263   1HD   LYS  33          2HD       LYS  33  -9.083  13.951  -0.911
  264   2HD   LYS  33          1HD       LYS  33  -8.025  15.331  -1.176
  265   1HE   LYS  33          2HE       LYS  33  -7.060  14.307  -3.109
  266   2HE   LYS  33          1HE       LYS  33  -7.882  12.783  -2.777
  267   1HZ   LYS  33          1HZ       LYS  33  -8.969  14.043  -4.539
  268   2HZ   LYS  33          2HZ       LYS  33  -9.223  15.338  -3.478
  269   3HZ   LYS  33          3HZ       LYS  33  -9.993  13.856  -3.198
  270    H    TRP  34           H        TRP  34  -6.834  11.310  -3.340
  271    HA   TRP  34           HA       TRP  34  -4.086  10.475  -2.661
  272   1HB   TRP  34          2HB       TRP  34  -5.451   8.638  -3.683
  273   2HB   TRP  34          1HB       TRP  34  -5.652   9.639  -5.113
  274    HD1  TRP  34           HD1      TRP  34  -3.582   9.833  -6.781
  275    HE1  TRP  34           HE1      TRP  34  -1.448   8.414  -7.050
  276    HE3  TRP  34           HE3      TRP  34  -3.676   7.361  -2.304
  277    HZ2  TRP  34           HZ2      TRP  34   0.008   6.511  -5.555
  278    HZ3  TRP  34           HZ3      TRP  34  -1.880   5.755  -1.802
  279    HH2  TRP  34           HH2      TRP  34  -0.078   5.340  -3.396
  280    H    ASN  35           H        ASN  35  -2.831  12.205  -3.047
  281    HA   ASN  35           HA       ASN  35  -3.438  13.889  -5.394
  282   1HB   ASN  35          2HB       ASN  35  -1.920  14.648  -2.885
  283   2HB   ASN  35          1HB       ASN  35  -2.304  15.715  -4.226
  284   1HD2  ASN  35          1HD2      ASN  35  -2.955  15.973  -1.433
  285   2HD2  ASN  35          2HD2      ASN  35  -4.685  16.060  -1.335
  286    H    LEU  36           H        LEU  36  -1.513  11.463  -4.572
  287    HA   LEU  36           HA       LEU  36   1.085  12.453  -5.182
  288   1HB   LEU  36          2HB       LEU  36  -0.058   9.666  -5.086
  289   2HB   LEU  36          1HB       LEU  36   1.619   9.991  -5.469
  290    HG   LEU  36           HG       LEU  36   0.267  10.745  -2.885
  291   1HD1  LEU  36          1HD1      LEU  36   0.498   8.328  -3.107
  292   2HD1  LEU  36          2HD1      LEU  36   1.599   8.964  -1.885
  293   3HD1  LEU  36          3HD1      LEU  36   2.210   8.520  -3.480
  294   1HD2  LEU  36          1HD2      LEU  36   2.074  12.259  -3.466
  295   2HD2  LEU  36          2HD2      LEU  36   3.152  10.892  -3.746
  296   3HD2  LEU  36          3HD2      LEU  36   2.552  11.221  -2.121
  297    H    ARG  37           H        ARG  37   2.278  12.283  -7.062
  298    HA   ARG  37           HA       ARG  37   0.762  12.270  -9.523
  299   1HB   ARG  37          2HB       ARG  37   3.724  12.627  -9.001
  300   2HB   ARG  37          1HB       ARG  37   2.957  12.814 -10.570
  301   1HG   ARG  37          2HG       ARG  37   1.639  14.678  -9.720
  302   2HG   ARG  37          1HG       ARG  37   2.386  14.485  -8.131
  303   1HD   ARG  37          2HD       ARG  37   4.583  14.942  -9.115
  304   2HD   ARG  37          1HD       ARG  37   3.832  15.143 -10.698
  305    HE   ARG  37           HE       ARG  37   2.505  16.941  -9.196
  306   1HH1  ARG  37          1HH1      ARG  37   5.938  16.311  -9.617
  307   2HH1  ARG  37          2HH1      ARG  37   6.396  17.972  -9.359
  308   1HH2  ARG  37          1HH2      ARG  37   3.108  19.093  -8.818
  309   2HH2  ARG  37          2HH2      ARG  37   4.781  19.560  -8.909
  310    H    ALA  38           H        ALA  38   0.446   9.844  -8.508
  311    HA   ALA  38           HA       ALA  38   1.944   8.106 -10.300
  312   1HB   ALA  38          1HB       ALA  38   3.250   8.045  -8.248
  313   2HB   ALA  38          2HB       ALA  38   2.438   6.501  -8.502
  314   3HB   ALA  38          3HB       ALA  38   1.808   7.648  -7.317
  315    HA   PRO  39           HA       PRO  39  -2.106   6.397 -10.833
  316   1HB   PRO  39          2HB       PRO  39  -0.667   3.898 -11.495
  317   2HB   PRO  39          1HB       PRO  39  -1.801   4.836 -12.472
  318   1HG   PRO  39          2HG       PRO  39   0.813   4.835 -13.010
  319   2HG   PRO  39          1HG       PRO  39  -0.164   6.302 -13.199
  320   1HD   PRO  39          2HD       PRO  39   1.724   5.549 -11.005
  321   2HD   PRO  39          1HD       PRO  39   1.464   7.125 -11.781
  322    H    LEU  40           H        LEU  40  -3.540   5.090  -9.775
  323    HA   LEU  40           HA       LEU  40  -2.859   4.176  -7.185
  324   1HB   LEU  40          2HB       LEU  40  -5.308   4.110  -8.894
  325   2HB   LEU  40          1HB       LEU  40  -5.246   3.108  -7.464
  326    HG   LEU  40           HG       LEU  40  -6.405   5.164  -6.968
  327   1HD1  LEU  40          1HD1      LEU  40  -3.664   5.121  -5.715
  328   2HD1  LEU  40          2HD1      LEU  40  -5.074   4.205  -5.182
  329   3HD1  LEU  40          3HD1      LEU  40  -5.075   5.966  -5.078
  330   1HD2  LEU  40          1HD2      LEU  40  -5.305   7.338  -7.110
  331   2HD2  LEU  40          2HD2      LEU  40  -5.426   6.573  -8.694
  332   3HD2  LEU  40          3HD2      LEU  40  -3.887   6.577  -7.833
  333    HA   PRO  41           HA       PRO  41  -1.916  -0.114  -8.145
  334   1HB   PRO  41          2HB       PRO  41  -2.237  -1.115  -5.646
  335   2HB   PRO  41          1HB       PRO  41  -0.806  -0.191  -6.119
  336   1HG   PRO  41          2HG       PRO  41  -3.238   0.717  -4.626
  337   2HG   PRO  41          1HG       PRO  41  -1.531   1.075  -4.304
  338   1HD   PRO  41          2HD       PRO  41  -3.173   2.818  -5.568
  339   2HD   PRO  41          1HD       PRO  41  -1.438   2.706  -5.924
  340    H    THR  42           H        THR  42  -3.044  -2.245  -7.773
  341    HA   THR  42           HA       THR  42  -5.956  -1.826  -7.873
  342    HB   THR  42           HB       THR  42  -5.982  -4.127  -8.929
  343    HG1  THR  42           HG1      THR  42  -3.192  -3.671  -9.294
  344   1HG2  THR  42          1HG2      THR  42  -4.413  -1.964 -10.342
  345   2HG2  THR  42          2HG2      THR  42  -6.170  -2.105 -10.284
  346   3HG2  THR  42          3HG2      THR  42  -5.213  -3.324 -11.127
  347    H    GLN  43           H        GLN  43  -7.265  -3.707  -7.032
  348    HA   GLN  43           HA       GLN  43  -6.828  -4.121  -4.311
  349   1HB   GLN  43          2HB       GLN  43  -8.990  -4.413  -5.582
  350   2HB   GLN  43          1HB       GLN  43  -8.382  -5.963  -6.132
  351   1HG   GLN  43          2HG       GLN  43  -9.859  -6.289  -4.268
  352   2HG   GLN  43          1HG       GLN  43  -8.212  -6.709  -3.799
  353   1HE2  GLN  43          1HE2      GLN  43  -8.552  -6.414  -1.642
  354   2HE2  GLN  43          2HE2      GLN  43  -8.809  -4.852  -0.929
  355    H    ALA  44           H        ALA  44  -6.275  -6.284  -7.044
  356    HA   ALA  44           HA       ALA  44  -5.178  -8.458  -5.719
  357   1HB   ALA  44          1HB       ALA  44  -4.399  -7.397  -8.429
  358   2HB   ALA  44          2HB       ALA  44  -5.762  -8.465  -8.094
  359   3HB   ALA  44          3HB       ALA  44  -4.112  -9.031  -7.831
  360    H    GLU  45           H        GLU  45  -3.473  -5.625  -7.051
  361    HA   GLU  45           HA       GLU  45  -0.889  -6.317  -6.275
  362   1HB   GLU  45          2HB       GLU  45  -2.244  -3.676  -6.730
  363   2HB   GLU  45          1HB       GLU  45  -0.567  -3.746  -6.216
  364   1HG   GLU  45          2HG       GLU  45   0.033  -4.992  -8.184
  365   2HG   GLU  45          1HG       GLU  45  -1.657  -5.086  -8.676
  366    H    LEU  46           H        LEU  46  -3.300  -4.377  -4.515
  367    HA   LEU  46           HA       LEU  46  -1.790  -3.746  -2.275
  368   1HB   LEU  46          2HB       LEU  46  -4.750  -4.268  -2.542
  369   2HB   LEU  46          1HB       LEU  46  -4.004  -3.559  -1.128
  370    HG   LEU  46           HG       LEU  46  -3.873  -2.329  -3.878
  371   1HD1  LEU  46          1HD1      LEU  46  -5.693  -1.672  -1.564
  372   2HD1  LEU  46          2HD1      LEU  46  -6.183  -2.411  -3.089
  373   3HD1  LEU  46          3HD1      LEU  46  -5.561  -0.760  -3.068
  374   1HD2  LEU  46          1HD2      LEU  46  -3.155  -0.341  -2.657
  375   2HD2  LEU  46          2HD2      LEU  46  -2.058  -1.692  -2.371
  376   3HD2  LEU  46          3HD2      LEU  46  -3.236  -1.237  -1.140
  377    H    GLU  47           H        GLU  47  -3.878  -6.562  -2.840
  378    HA   GLU  47           HA       GLU  47  -3.326  -7.649  -0.260
  379   1HB   GLU  47          2HB       GLU  47  -4.757  -8.766  -2.661
  380   2HB   GLU  47          1HB       GLU  47  -4.584  -9.646  -1.145
  381   1HG   GLU  47          2HG       GLU  47  -5.692  -7.776   0.024
  382   2HG   GLU  47          1HG       GLU  47  -5.950  -6.991  -1.530
  383    H    THR  48           H        THR  48  -1.761  -7.819  -3.314
  384    HA   THR  48           HA       THR  48  -0.271 -10.188  -2.916
  385    HB   THR  48           HB       THR  48   0.551  -7.668  -4.385
  386    HG1  THR  48           HG1      THR  48  -1.374  -8.758  -5.181
  387   1HG2  THR  48          1HG2      THR  48   2.101  -9.172  -5.600
  388   2HG2  THR  48          2HG2      THR  48   1.676 -10.469  -4.483
  389   3HG2  THR  48          3HG2      THR  48   2.493  -9.025  -3.886
  390    H    TRP  49           H        TRP  49   0.431  -6.781  -2.164
  391    HA   TRP  49           HA       TRP  49   2.888  -7.293  -0.853
  392   1HB   TRP  49          2HB       TRP  49   1.032  -4.935  -0.459
  393   2HB   TRP  49          1HB       TRP  49   2.753  -4.993  -0.086
  394    HD1  TRP  49           HD1      TRP  49   3.909  -6.193  -2.729
  395    HE1  TRP  49           HE1      TRP  49   3.828  -4.859  -4.929
  396    HE3  TRP  49           HE3      TRP  49   0.144  -2.947  -1.552
  397    HZ2  TRP  49           HZ2      TRP  49   2.359  -2.705  -6.010
  398    HZ3  TRP  49           HZ3      TRP  49  -0.530  -1.272  -3.226
  399    HH2  TRP  49           HH2      TRP  49   0.555  -1.157  -5.406
  400    H    TRP  50           H        TRP  50  -0.445  -7.185   0.195
  401    HA   TRP  50           HA       TRP  50  -0.026  -7.256   2.970
  402   1HB   TRP  50          2HB       TRP  50  -2.231  -6.867   1.863
  403   2HB   TRP  50          1HB       TRP  50  -2.273  -8.569   1.419
  404    HD1  TRP  50           HD1      TRP  50  -3.240 -10.218   3.163
  405    HE1  TRP  50           HE1      TRP  50  -4.099 -10.002   5.582
  406    HE3  TRP  50           HE3      TRP  50  -1.723  -5.430   4.131
  407    HZ2  TRP  50           HZ2      TRP  50  -4.121  -8.058   7.624
  408    HZ3  TRP  50           HZ3      TRP  50  -2.201  -4.470   6.347
  409    HH2  TRP  50           HH2      TRP  50  -3.375  -5.758   8.054
  410    H    GLU  51           H        GLU  51  -0.327  -9.897   0.587
  411    HA   GLU  51           HA       GLU  51   0.022 -12.021   2.306
  412   1HB   GLU  51          2HB       GLU  51  -0.613 -11.895  -0.215
  413   2HB   GLU  51          1HB       GLU  51   1.125 -11.983  -0.472
  414   1HG   GLU  51          2HG       GLU  51   1.019 -13.971   1.098
  415   2HG   GLU  51          1HG       GLU  51  -0.700 -13.973   0.747
  416    H    GLU  52           H        GLU  52   2.400 -10.122   0.464
  417    HA   GLU  52           HA       GLU  52   4.660 -11.585   1.280
  418   1HB   GLU  52          2HB       GLU  52   4.384  -8.730   0.348
  419   2HB   GLU  52          1HB       GLU  52   5.933  -9.517   0.621
  420   1HG   GLU  52          2HG       GLU  52   5.359 -11.204  -1.057
  421   2HG   GLU  52          1HG       GLU  52   3.826 -10.385  -1.340
  422    H    LEU  53           H        LEU  53   2.983  -8.848   2.713
  423    HA   LEU  53           HA       LEU  53   4.840  -8.293   4.764
  424   1HB   LEU  53          2HB       LEU  53   3.087  -6.729   4.151
  425   2HB   LEU  53          1HB       LEU  53   1.853  -7.877   4.633
  426    HG   LEU  53           HG       LEU  53   2.683  -7.701   6.979
  427   1HD1  LEU  53          1HD1      LEU  53   4.343  -5.446   5.862
  428   2HD1  LEU  53          2HD1      LEU  53   4.958  -6.970   6.502
  429   3HD1  LEU  53          3HD1      LEU  53   4.137  -5.831   7.571
  430   1HD2  LEU  53          1HD2      LEU  53   1.813  -5.120   5.683
  431   2HD2  LEU  53          2HD2      LEU  53   1.686  -5.511   7.398
  432   3HD2  LEU  53          3HD2      LEU  53   0.751  -6.425   6.215
  433    H    GLN  54           H        GLN  54   2.110 -10.515   4.547
  434    HA   GLN  54           HA       GLN  54   2.354 -11.367   7.286
  435   1HB   GLN  54          2HB       GLN  54   0.385 -11.523   5.322
  436   2HB   GLN  54          1HB       GLN  54   0.906 -13.188   5.541
  437   1HG   GLN  54          2HG       GLN  54  -0.978 -12.644   6.978
  438   2HG   GLN  54          1HG       GLN  54   0.459 -13.036   7.922
  439   1HE2  GLN  54          1HE2      GLN  54  -0.222 -11.922   9.735
  440   2HE2  GLN  54          2HE2      GLN  54  -0.320 -10.197   9.793
  441    H    LYS  55           H        LYS  55   3.623 -12.290   4.219
  442    HA   LYS  55           HA       LYS  55   4.619 -14.863   5.105
  443   1HB   LYS  55          2HB       LYS  55   3.819 -14.097   2.728
  444   2HB   LYS  55          1HB       LYS  55   5.461 -13.491   2.586
  445   1HG   LYS  55          2HG       LYS  55   6.331 -15.732   2.987
  446   2HG   LYS  55          1HG       LYS  55   4.682 -16.341   3.155
  447   1HD   LYS  55          2HD       LYS  55   4.214 -15.553   0.848
  448   2HD   LYS  55          1HD       LYS  55   5.915 -15.111   0.699
  449   1HE   LYS  55          2HE       LYS  55   4.848 -17.883   1.228
  450   2HE   LYS  55          1HE       LYS  55   5.448 -17.292  -0.322
  451   1HZ   LYS  55          1HZ       LYS  55   7.619 -16.935   0.738
  452   2HZ   LYS  55          2HZ       LYS  55   7.141 -18.561   0.784
  453   3HZ   LYS  55          3HZ       LYS  55   7.021 -17.610   2.178
  454    H    ASN  56           H        ASN  56   5.433 -12.146   6.210
  455    HA   ASN  56           HA       ASN  56   7.244 -11.369   7.322
  456   1HB   ASN  56          2HB       ASN  56   8.123 -13.604   7.636
  457   2HB   ASN  56          1HB       ASN  56   8.758 -13.629   5.998
  458   1HD2  ASN  56          1HD2      ASN  56  10.681 -12.704   5.591
  459   2HD2  ASN  56          2HD2      ASN  56  11.678 -11.990   6.805
  460    HA   PRO  57           HA       PRO  57   8.262  -8.644   3.917
  461   1HB   PRO  57          2HB       PRO  57   8.883  -6.530   5.521
  462   2HB   PRO  57          1HB       PRO  57   7.228  -6.957   5.077
  463   1HG   PRO  57          2HG       PRO  57   8.728  -7.547   7.594
  464   2HG   PRO  57          1HG       PRO  57   7.041  -7.041   7.385
  465   1HD   PRO  57          2HD       PRO  57   7.747  -9.611   7.860
  466   2HD   PRO  57          1HD       PRO  57   6.329  -9.171   6.887
  467    HA   PRO  58           HA       PRO  58  12.662  -9.425   4.125
  468   1HB   PRO  58          2HB       PRO  58  12.806  -7.979   1.592
  469   2HB   PRO  58          1HB       PRO  58  13.119  -9.683   1.922
  470   1HG   PRO  58          2HG       PRO  58  10.970  -8.831   0.512
  471   2HG   PRO  58          1HG       PRO  58  10.949 -10.298   1.506
  472   1HD   PRO  58          2HD       PRO  58   9.851  -7.582   2.110
  473   2HD   PRO  58          1HD       PRO  58   9.167  -9.184   2.463
  474    H    TYR  59           H        TYR  59  14.672  -8.144   3.931
  475    HA   TYR  59           HA       TYR  59  14.213  -5.338   4.697
  476   1HB   TYR  59          2HB       TYR  59  15.334  -6.791   6.387
  477   2HB   TYR  59          1HB       TYR  59  16.630  -7.081   5.233
  478    HD1  TYR  59           HD1      TYR  59  14.965  -4.451   7.239
  479    HD2  TYR  59           HD2      TYR  59  18.408  -5.536   4.987
  480    HE1  TYR  59           HE1      TYR  59  16.113  -2.428   8.030
  481    HE2  TYR  59           HE2      TYR  59  19.572  -3.521   5.783
  482    HH   TYR  59           HH       TYR  59  18.948  -1.259   6.634
  483    H    GLU  60           H        GLU  60  15.080  -3.748   3.485
  484    HA   GLU  60           HA       GLU  60  16.283  -4.496   0.960
  485   1HB   GLU  60          2HB       GLU  60  14.460  -2.739   1.233
  486   2HB   GLU  60          1HB       GLU  60  15.687  -1.706   1.957
  487   1HG   GLU  60          2HG       GLU  60  15.345  -1.189  -0.399
  488   2HG   GLU  60          1HG       GLU  60  16.982  -1.765  -0.087
  Start of MODEL    8
    1   1H    MET   1          1H        MET   1  -8.947  -4.892   7.044
    2   2H    MET   1          2H        MET   1  -9.435  -6.061   5.916
    3   3H    MET   1          3H        MET   1  -9.882  -4.442   5.706
    4    HA   MET   1           HA       MET   1  -7.093  -5.439   5.665
    5   1HB   MET   1          2HB       MET   1  -8.630  -6.175   3.755
    6   2HB   MET   1          1HB       MET   1  -8.740  -4.478   3.319
    7   1HG   MET   1          2HG       MET   1  -6.121  -5.933   3.517
    8   2HG   MET   1          1HG       MET   1  -7.075  -5.877   2.039
    9   1HE   MET   1          1HE       MET   1  -5.064  -4.868   0.693
   10   2HE   MET   1          2HE       MET   1  -4.045  -4.917   2.132
   11   3HE   MET   1          3HE       MET   1  -4.155  -3.437   1.179
   12    H    ILE   2           H        ILE   2  -5.633  -3.856   5.906
   13    HA   ILE   2           HA       ILE   2  -6.639  -1.097   5.907
   14    HB   ILE   2           HB       ILE   2  -4.117  -2.141   7.197
   15   1HG1  ILE   2          2HG1      ILE   2  -5.469  -1.453   9.328
   16   2HG1  ILE   2          1HG1      ILE   2  -6.873  -1.657   8.284
   17   1HG2  ILE   2          1HG2      ILE   2  -5.453   0.551   7.364
   18   2HG2  ILE   2          2HG2      ILE   2  -3.932   0.177   6.553
   19   3HG2  ILE   2          3HG2      ILE   2  -4.050   0.045   8.308
   20   1HD1  ILE   2          1HD1      ILE   2  -4.820  -3.772   8.902
   21   2HD1  ILE   2          2HD1      ILE   2  -6.251  -3.976   7.892
   22   3HD1  ILE   2          3HD1      ILE   2  -6.428  -3.645   9.615
   23    H    LEU   3           H        LEU   3  -6.181   0.018   4.158
   24    HA   LEU   3           HA       LEU   3  -4.400  -0.800   2.147
   25   1HB   LEU   3          2HB       LEU   3  -6.336   1.216   2.563
   26   2HB   LEU   3          1HB       LEU   3  -4.870   2.019   2.050
   27    HG   LEU   3           HG       LEU   3  -6.255   1.573   0.140
   28   1HD1  LEU   3          1HD1      LEU   3  -3.852   1.417  -0.191
   29   2HD1  LEU   3          2HD1      LEU   3  -4.709   0.291  -1.242
   30   3HD1  LEU   3          3HD1      LEU   3  -3.899  -0.300   0.209
   31   1HD2  LEU   3          1HD2      LEU   3  -7.563  -0.274   0.994
   32   2HD2  LEU   3          2HD2      LEU   3  -6.141  -1.316   0.993
   33   3HD2  LEU   3          3HD2      LEU   3  -6.807  -0.732  -0.533
   34    H    TYR   4           H        TYR   4  -4.032   1.285   4.898
   35    HA   TYR   4           HA       TYR   4  -1.843   2.819   4.200
   36   1HB   TYR   4          2HB       TYR   4  -3.288   2.880   6.339
   37   2HB   TYR   4          1HB       TYR   4  -2.173   1.676   6.973
   38    HD1  TYR   4           HD1      TYR   4   0.049   2.305   7.692
   39    HD2  TYR   4           HD2      TYR   4  -2.501   5.154   5.834
   40    HE1  TYR   4           HE1      TYR   4   1.561   4.115   8.397
   41    HE2  TYR   4           HE2      TYR   4  -1.000   6.964   6.531
   42    HH   TYR   4           HH       TYR   4   2.134   6.384   7.782
   43    H    ASP   5           H        ASP   5  -1.861  -0.373   5.736
   44    HA   ASP   5           HA       ASP   5   0.908  -0.662   6.013
   45   1HB   ASP   5          2HB       ASP   5  -1.328  -2.673   5.808
   46   2HB   ASP   5          1HB       ASP   5   0.344  -3.140   6.089
   47    H    ALA   6           H        ALA   6  -1.265  -1.843   3.477
   48    HA   ALA   6           HA       ALA   6   0.637  -3.069   1.855
   49   1HB   ALA   6          1HB       ALA   6  -0.975  -2.855   0.050
   50   2HB   ALA   6          2HB       ALA   6  -1.878  -1.654   0.976
   51   3HB   ALA   6          3HB       ALA   6  -1.776  -3.320   1.548
   52    H    ILE   7           H        ILE   7  -0.471   0.309   1.869
   53    HA   ILE   7           HA       ILE   7   1.094   1.116  -0.352
   54    HB   ILE   7           HB       ILE   7   0.049   2.815   1.924
   55   1HG1  ILE   7          2HG1      ILE   7  -1.134   2.259  -0.807
   56   2HG1  ILE   7          1HG1      ILE   7  -1.703   1.567   0.708
   57   1HG2  ILE   7          1HG2      ILE   7   1.049   3.589  -0.822
   58   2HG2  ILE   7          2HG2      ILE   7   1.810   3.964   0.726
   59   3HG2  ILE   7          3HG2      ILE   7   0.251   4.675   0.314
   60   1HD1  ILE   7          1HD1      ILE   7  -2.308   3.779   1.506
   61   2HD1  ILE   7          2HD1      ILE   7  -3.101   3.420  -0.026
   62   3HD1  ILE   7          3HD1      ILE   7  -1.705   4.499   0.012
   63    H    MET   8           H        MET   8   1.691   1.036   3.121
   64    HA   MET   8           HA       MET   8   4.155   2.438   3.045
   65   1HB   MET   8          2HB       MET   8   2.995   0.546   5.081
   66   2HB   MET   8          1HB       MET   8   4.536   1.359   5.299
   67   1HG   MET   8          2HG       MET   8   2.010   2.888   4.782
   68   2HG   MET   8          1HG       MET   8   2.463   2.365   6.402
   69   1HE   MET   8          1HE       MET   8   2.852   4.843   3.592
   70   2HE   MET   8          2HE       MET   8   4.441   4.142   3.280
   71   3HE   MET   8          3HE       MET   8   4.311   5.766   3.948
   72    H    TYR   9           H        TYR   9   3.300  -0.824   2.326
   73    HA   TYR   9           HA       TYR   9   5.965  -1.856   2.643
   74   1HB   TYR   9          2HB       TYR   9   3.933  -3.295   2.864
   75   2HB   TYR   9          1HB       TYR   9   3.642  -3.085   1.138
   76    HD1  TYR   9           HD1      TYR   9   4.870  -4.345  -0.476
   77    HD2  TYR   9           HD2      TYR   9   5.952  -4.519   3.633
   78    HE1  TYR   9           HE1      TYR   9   6.376  -6.230  -0.956
   79    HE2  TYR   9           HE2      TYR   9   7.457  -6.403   3.165
   80    HH   TYR   9           HH       TYR   9   8.424  -7.247   0.058
   81    H    LYS  10           H        LYS  10   3.962  -0.661   0.005
   82    HA   LYS  10           HA       LYS  10   5.926  -1.301  -2.014
   83   1HB   LYS  10          2HB       LYS  10   3.271  -1.001  -2.150
   84   2HB   LYS  10          1HB       LYS  10   3.731   0.651  -2.527
   85   1HG   LYS  10          2HG       LYS  10   4.643  -1.797  -4.026
   86   2HG   LYS  10          1HG       LYS  10   3.358  -0.705  -4.533
   87   1HD   LYS  10          2HD       LYS  10   5.024   1.135  -4.586
   88   2HD   LYS  10          1HD       LYS  10   6.283  -0.043  -4.221
   89   1HE   LYS  10          2HE       LYS  10   6.251   0.346  -6.591
   90   2HE   LYS  10          1HE       LYS  10   5.645  -1.279  -6.276
   91   1HZ   LYS  10          1HZ       LYS  10   4.001   1.126  -6.891
   92   2HZ   LYS  10          2HZ       LYS  10   3.378  -0.397  -6.494
   93   3HZ   LYS  10          3HZ       LYS  10   4.276  -0.200  -7.912
   94    H    TYR  11           H        TYR  11   4.639   1.660  -0.546
   95    HA   TYR  11           HA       TYR  11   7.085   3.075  -1.388
   96   1HB   TYR  11          2HB       TYR  11   4.402   4.372  -0.865
   97   2HB   TYR  11          1HB       TYR  11   5.825   5.105  -1.594
   98    HD1  TYR  11           HD1      TYR  11   2.792   3.285  -2.178
   99    HD2  TYR  11           HD2      TYR  11   6.550   4.301  -3.895
  100    HE1  TYR  11           HE1      TYR  11   1.930   2.684  -4.400
  101    HE2  TYR  11           HE2      TYR  11   5.699   3.707  -6.126
  102    HH   TYR  11           HH       TYR  11   2.428   3.237  -6.802
  103    HA   PRO  12           HA       PRO  12   7.001   2.831   3.203
  104   1HB   PRO  12          2HB       PRO  12   9.677   2.658   3.543
  105   2HB   PRO  12          1HB       PRO  12   8.679   1.271   3.109
  106   1HG   PRO  12          2HG       PRO  12  10.380   2.994   1.352
  107   2HG   PRO  12          1HG       PRO  12  10.210   1.228   1.361
  108   1HD   PRO  12          2HD       PRO  12   8.927   2.828  -0.419
  109   2HD   PRO  12          1HD       PRO  12   8.260   1.285   0.148
  110    H    ASN  13           H        ASN  13   8.612   4.990   1.048
  111    HA   ASN  13           HA       ASN  13   9.409   6.825   3.157
  112   1HB   ASN  13          2HB       ASN  13  10.827   6.345   1.135
  113   2HB   ASN  13          1HB       ASN  13   9.642   7.229   0.192
  114   1HD2  ASN  13          1HD2      ASN  13  10.861   7.903   3.418
  115   2HD2  ASN  13          2HD2      ASN  13  11.574   9.422   3.023
  116    H    ALA  14           H        ALA  14   6.641   6.215   1.435
  117    HA   ALA  14           HA       ALA  14   5.780   8.805   0.704
  118   1HB   ALA  14          1HB       ALA  14   3.571   7.814   0.456
  119   2HB   ALA  14          2HB       ALA  14   4.106   6.372   1.318
  120   3HB   ALA  14          3HB       ALA  14   4.807   6.772  -0.251
  121    H    VAL  15           H        VAL  15   4.482  10.287   1.724
  122    HA   VAL  15           HA       VAL  15   4.342   9.995   4.652
  123    HB   VAL  15           HB       VAL  15   4.126  12.530   3.020
  124   1HG1  VAL  15          1HG1      VAL  15   4.553  12.084   5.971
  125   2HG1  VAL  15          2HG1      VAL  15   3.076  12.674   5.208
  126   3HG1  VAL  15          3HG1      VAL  15   4.544  13.649   5.159
  127   1HG2  VAL  15          1HG2      VAL  15   6.519  11.371   4.441
  128   2HG2  VAL  15          2HG2      VAL  15   6.431  12.996   3.762
  129   3HG2  VAL  15          3HG2      VAL  15   6.331  11.589   2.703
  130    H    SER  16           H        SER  16   2.441   9.813   5.623
  131    HA   SER  16           HA       SER  16   0.014   9.795   4.145
  132   1HB   SER  16          2HB       SER  16  -0.955   9.693   6.573
  133   2HB   SER  16          1HB       SER  16  -0.017   8.333   5.954
  134    HG   SER  16           HG       SER  16   1.153   8.639   7.672
  135    H    ARG  17           H        ARG  17  -1.645  11.252   4.110
  136    HA   ARG  17           HA       ARG  17  -2.656  13.265   4.042
  137   1HB   ARG  17          2HB       ARG  17  -1.091  13.618   6.583
  138   2HB   ARG  17          1HB       ARG  17  -2.101  14.908   5.934
  139   1HG   ARG  17          2HG       ARG  17  -4.031  13.389   5.975
  140   2HG   ARG  17          1HG       ARG  17  -3.011  12.139   6.686
  141   1HD   ARG  17          2HD       ARG  17  -2.791  13.304   8.697
  142   2HD   ARG  17          1HD       ARG  17  -3.311  14.829   7.973
  143    HE   ARG  17           HE       ARG  17  -5.554  13.743   7.749
  144   1HH1  ARG  17          1HH1      ARG  17  -3.288  12.637  10.203
  145   2HH1  ARG  17          2HH1      ARG  17  -4.545  12.080  11.272
  146   1HH2  ARG  17          1HH2      ARG  17  -7.180  13.014   9.146
  147   2HH2  ARG  17          2HH2      ARG  17  -6.763  12.297  10.671
  148    H    LYS  18           H        LYS  18  -0.035  12.689   2.807
  149    HA   LYS  18           HA       LYS  18   0.334  15.412   1.828
  150   1HB   LYS  18          2HB       LYS  18   2.210  15.002   3.374
  151   2HB   LYS  18          1HB       LYS  18   2.626  13.544   2.482
  152   1HG   LYS  18          2HG       LYS  18   3.251  14.800   0.561
  153   2HG   LYS  18          1HG       LYS  18   2.593  16.286   1.248
  154   1HD   LYS  18          2HD       LYS  18   4.283  16.132   3.060
  155   2HD   LYS  18          1HD       LYS  18   4.976  14.728   2.244
  156   1HE   LYS  18          2HE       LYS  18   5.485  16.061   0.296
  157   2HE   LYS  18          1HE       LYS  18   4.676  17.458   1.004
  158   1HZ   LYS  18          1HZ       LYS  18   6.348  17.419   2.794
  159   2HZ   LYS  18          2HZ       LYS  18   7.031  17.679   1.262
  160   3HZ   LYS  18          3HZ       LYS  18   7.157  16.158   1.997
  161    H    ASP  19           H        ASP  19   1.558  12.102   1.303
  162    HA   ASP  19           HA       ASP  19   1.214  12.395  -1.565
  163   1HB   ASP  19          2HB       ASP  19   2.145  10.034   0.089
  164   2HB   ASP  19          1HB       ASP  19   2.145  10.098  -1.669
  165    H    PHE  20           H        PHE  20  -0.225  10.668   1.134
  166    HA   PHE  20           HA       PHE  20  -2.667  10.285  -0.376
  167   1HB   PHE  20          2HB       PHE  20  -2.797   7.883   0.034
  168   2HB   PHE  20          1HB       PHE  20  -1.341   8.247  -0.886
  169    HD1  PHE  20           HD1      PHE  20  -2.685   6.811   2.123
  170    HD2  PHE  20           HD2      PHE  20   0.874   8.283   0.313
  171    HE1  PHE  20           HE1      PHE  20  -1.342   5.634   3.815
  172    HE2  PHE  20           HE2      PHE  20   2.220   7.101   1.997
  173    HZ   PHE  20           HZ       PHE  20   1.116   5.777   3.748
  174    H    GLU  21           H        GLU  21  -4.482   9.976   0.975
  175    HA   GLU  21           HA       GLU  21  -3.987   9.838   3.864
  176   1HB   GLU  21          2HB       GLU  21  -4.333  12.211   3.374
  177   2HB   GLU  21          1HB       GLU  21  -5.825  11.838   2.523
  178   1HG   GLU  21          2HG       GLU  21  -6.847  11.080   4.577
  179   2HG   GLU  21          1HG       GLU  21  -5.340  11.341   5.450
  180    H    LEU  22           H        LEU  22  -5.476   8.613   4.967
  181    HA   LEU  22           HA       LEU  22  -7.352   7.172   3.215
  182   1HB   LEU  22          2HB       LEU  22  -5.843   6.036   5.560
  183   2HB   LEU  22          1HB       LEU  22  -6.854   5.155   4.433
  184    HG   LEU  22           HG       LEU  22  -4.201   6.459   3.813
  185   1HD1  LEU  22          1HD1      LEU  22  -3.454   4.174   3.436
  186   2HD1  LEU  22          2HD1      LEU  22  -5.044   3.570   3.901
  187   3HD1  LEU  22          3HD1      LEU  22  -4.031   4.391   5.088
  188   1HD2  LEU  22          1HD2      LEU  22  -5.719   6.640   1.909
  189   2HD2  LEU  22          2HD2      LEU  22  -6.056   4.912   2.007
  190   3HD2  LEU  22          3HD2      LEU  22  -4.437   5.471   1.590
  191    H    ARG  23           H        ARG  23  -9.213   6.286   4.164
  192    HA   ARG  23           HA       ARG  23 -10.011   7.409   6.773
  193   1HB   ARG  23          2HB       ARG  23 -11.337   7.600   4.177
  194   2HB   ARG  23          1HB       ARG  23 -12.379   6.934   5.427
  195   1HG   ARG  23          2HG       ARG  23 -12.736   9.257   5.412
  196   2HG   ARG  23          1HG       ARG  23 -11.771   8.908   6.842
  197   1HD   ARG  23          2HD       ARG  23  -9.784   9.691   5.795
  198   2HD   ARG  23          1HD       ARG  23 -10.589   9.823   4.233
  199    HE   ARG  23           HE       ARG  23 -12.034  11.548   5.494
  200   1HH1  ARG  23          1HH1      ARG  23  -8.638  10.960   6.078
  201   2HH1  ARG  23          2HH1      ARG  23  -8.273  12.615   6.459
  202   1HH2  ARG  23          1HH2      ARG  23 -11.584  13.726   6.015
  203   2HH2  ARG  23          2HH2      ARG  23  -9.958  14.185   6.440
  204    H    ASN  24           H        ASN  24 -11.988   6.153   7.607
  205    HA   ASN  24           HA       ASN  24 -11.332   3.306   7.384
  206   1HB   ASN  24          2HB       ASN  24 -11.360   4.222   9.653
  207   2HB   ASN  24          1HB       ASN  24 -13.021   4.762   9.430
  208   1HD2  ASN  24          1HD2      ASN  24 -13.830   3.529  11.105
  209   2HD2  ASN  24          2HD2      ASN  24 -13.934   1.800  11.027
  210    H    ASP  25           H        ASP  25 -12.511   2.072   6.129
  211    HA   ASP  25           HA       ASP  25 -15.083   2.934   5.120
  212   1HB   ASP  25          2HB       ASP  25 -13.680   1.776   3.563
  213   2HB   ASP  25          1HB       ASP  25 -13.403   0.454   4.693
  214    H    GLY  26           H        GLY  26 -13.835   0.808   7.549
  215   1HA   GLY  26          2HA       GLY  26 -15.402   0.030   9.292
  216   2HA   GLY  26          1HA       GLY  26 -16.532  -0.323   7.986
  217    H    ASN  27           H        ASN  27 -14.691  -1.368   6.156
  218    HA   ASN  27           HA       ASN  27 -14.015  -3.937   7.377
  219   1HB   ASN  27          2HB       ASN  27 -14.019  -3.039   4.483
  220   2HB   ASN  27          1HB       ASN  27 -13.591  -4.655   5.025
  221   1HD2  ASN  27          1HD2      ASN  27 -16.151  -2.372   4.549
  222   2HD2  ASN  27          2HD2      ASN  27 -17.462  -3.496   4.746
  223    H    GLY  28           H        GLY  28 -12.604  -1.132   7.361
  224   1HA   GLY  28          2HA       GLY  28 -10.180  -1.390   8.119
  225   2HA   GLY  28          1HA       GLY  28  -9.943  -2.058   6.508
  226    H    SER  29           H        SER  29  -8.350  -0.119   6.782
  227    HA   SER  29           HA       SER  29  -9.534   2.465   6.245
  228   1HB   SER  29          2HB       SER  29  -6.613   1.681   6.142
  229   2HB   SER  29          1HB       SER  29  -7.282   3.302   6.327
  230    HG   SER  29           HG       SER  29  -6.815   2.740   8.359
  231    H    TYR  30           H        TYR  30  -9.820   3.359   4.281
  232    HA   TYR  30           HA       TYR  30  -8.661   1.951   1.964
  233   1HB   TYR  30          2HB       TYR  30 -10.649   2.435   0.678
  234   2HB   TYR  30          1HB       TYR  30 -11.128   1.627   2.160
  235    HD1  TYR  30           HD1      TYR  30 -11.767   4.350   0.025
  236    HD2  TYR  30           HD2      TYR  30 -11.832   3.237   4.127
  237    HE1  TYR  30           HE1      TYR  30 -13.335   6.190   0.492
  238    HE2  TYR  30           HE2      TYR  30 -13.396   5.066   4.607
  239    HH   TYR  30           HH       TYR  30 -15.157   6.632   2.365
  240    H    ILE  31           H        ILE  31  -8.790   3.446  -0.046
  241    HA   ILE  31           HA       ILE  31  -7.180   5.749   0.644
  242    HB   ILE  31           HB       ILE  31  -7.974   4.714  -2.086
  243   1HG1  ILE  31          2HG1      ILE  31  -5.418   4.327  -0.508
  244   2HG1  ILE  31          1HG1      ILE  31  -6.639   3.092  -0.790
  245   1HG2  ILE  31          1HG2      ILE  31  -5.849   6.706  -1.282
  246   2HG2  ILE  31          2HG2      ILE  31  -7.353   7.073  -2.127
  247   3HG2  ILE  31          3HG2      ILE  31  -6.122   6.089  -2.914
  248   1HD1  ILE  31          1HD1      ILE  31  -4.726   2.815  -2.263
  249   2HD1  ILE  31          2HD1      ILE  31  -4.985   4.435  -2.909
  250   3HD1  ILE  31          3HD1      ILE  31  -6.191   3.178  -3.178
  251    H    GLU  32           H        GLU  32  -7.949   7.702   0.931
  252    HA   GLU  32           HA       GLU  32 -10.473   8.463  -0.387
  253   1HB   GLU  32          2HB       GLU  32 -10.041   8.553   2.231
  254   2HB   GLU  32          1HB       GLU  32  -9.236  10.061   1.829
  255   1HG   GLU  32          2HG       GLU  32 -12.092   9.408   1.135
  256   2HG   GLU  32          1HG       GLU  32 -11.586  10.329   2.548
  257    H    LYS  33           H        LYS  33  -7.377   9.867   0.680
  258    HA   LYS  33           HA       LYS  33  -7.490  11.775  -1.550
  259   1HB   LYS  33          2HB       LYS  33  -5.582  11.668   0.794
  260   2HB   LYS  33          1HB       LYS  33  -5.711  12.964  -0.384
  261   1HG   LYS  33          2HG       LYS  33  -7.981  12.187   1.405
  262   2HG   LYS  33          1HG       LYS  33  -6.760  13.359   1.874
  263   1HD   LYS  33          2HD       LYS  33  -7.329  14.581  -0.254
  264   2HD   LYS  33          1HD       LYS  33  -8.730  13.519  -0.367
  265   1HE   LYS  33          2HE       LYS  33  -9.312  15.634   0.714
  266   2HE   LYS  33          1HE       LYS  33  -9.495  14.273   1.819
  267   1HZ   LYS  33          1HZ       LYS  33  -8.406  16.161   2.882
  268   2HZ   LYS  33          2HZ       LYS  33  -7.166  16.115   1.731
  269   3HZ   LYS  33          3HZ       LYS  33  -7.363  14.821   2.814
  270    H    TRP  34           H        TRP  34  -6.175  11.581  -3.263
  271    HA   TRP  34           HA       TRP  34  -3.734   9.973  -2.998
  272   1HB   TRP  34          2HB       TRP  34  -5.552   8.662  -4.155
  273   2HB   TRP  34          1HB       TRP  34  -5.558   9.888  -5.417
  274    HD1  TRP  34           HD1      TRP  34  -3.868   9.569  -7.353
  275    HE1  TRP  34           HE1      TRP  34  -1.956   7.913  -7.845
  276    HE3  TRP  34           HE3      TRP  34  -3.612   7.254  -2.797
  277    HZ2  TRP  34           HZ2      TRP  34  -0.534   5.905  -6.480
  278    HZ3  TRP  34           HZ3      TRP  34  -1.945   5.475  -2.479
  279    HH2  TRP  34           HH2      TRP  34  -0.439   4.814  -4.284
  280    H    ASN  35           H        ASN  35  -2.115  11.371  -3.300
  281    HA   ASN  35           HA       ASN  35  -2.553  13.600  -5.177
  282   1HB   ASN  35          2HB       ASN  35  -0.794  13.481  -2.719
  283   2HB   ASN  35          1HB       ASN  35  -0.887  14.848  -3.821
  284   1HD2  ASN  35          1HD2      ASN  35  -1.478  14.634  -0.964
  285   2HD2  ASN  35          2HD2      ASN  35  -3.118  15.172  -0.769
  286    H    LEU  36           H        LEU  36  -1.089  10.736  -5.051
  287    HA   LEU  36           HA       LEU  36   1.573  11.434  -5.890
  288   1HB   LEU  36          2HB       LEU  36   0.083   8.821  -5.719
  289   2HB   LEU  36          1HB       LEU  36   1.710   8.934  -6.356
  290    HG   LEU  36           HG       LEU  36   0.907   9.750  -3.571
  291   1HD1  LEU  36          1HD1      LEU  36   2.318   7.277  -4.558
  292   2HD1  LEU  36          2HD1      LEU  36   0.699   7.349  -3.862
  293   3HD1  LEU  36          3HD1      LEU  36   2.105   7.729  -2.867
  294   1HD2  LEU  36          1HD2      LEU  36   2.833  10.978  -4.448
  295   2HD2  LEU  36          2HD2      LEU  36   3.618   9.452  -4.860
  296   3HD2  LEU  36          3HD2      LEU  36   3.311   9.860  -3.172
  297    H    ARG  37           H        ARG  37   2.480  11.163  -7.911
  298    HA   ARG  37           HA       ARG  37   0.634  11.416 -10.142
  299   1HB   ARG  37          2HB       ARG  37   3.633  11.644  -9.915
  300   2HB   ARG  37          1HB       ARG  37   2.782  11.746 -11.449
  301   1HG   ARG  37          2HG       ARG  37   1.528  13.685 -10.584
  302   2HG   ARG  37          1HG       ARG  37   2.485  13.606  -9.101
  303   1HD   ARG  37          2HD       ARG  37   3.324  15.268 -10.750
  304   2HD   ARG  37          1HD       ARG  37   4.509  14.037 -10.317
  305    HE   ARG  37           HE       ARG  37   3.077  13.229 -12.617
  306   1HH1  ARG  37          1HH1      ARG  37   5.501  15.541 -11.617
  307   2HH1  ARG  37          2HH1      ARG  37   6.292  15.583 -13.164
  308   1HH2  ARG  37          1HH2      ARG  37   4.106  13.256 -14.644
  309   2HH2  ARG  37          2HH2      ARG  37   5.483  14.282 -14.901
  310    H    ALA  38           H        ALA  38   0.634   8.941  -8.878
  311    HA   ALA  38           HA       ALA  38   1.760   7.198 -10.960
  312   1HB   ALA  38          1HB       ALA  38   2.159   5.490  -9.243
  313   2HB   ALA  38          2HB       ALA  38   1.639   6.627  -8.000
  314   3HB   ALA  38          3HB       ALA  38   3.093   6.954  -8.943
  315    HA   PRO  39           HA       PRO  39  -2.408   5.857 -11.499
  316   1HB   PRO  39          2HB       PRO  39  -1.908   3.318 -12.418
  317   2HB   PRO  39          1HB       PRO  39  -1.798   4.776 -13.410
  318   1HG   PRO  39          2HG       PRO  39   0.375   3.239 -12.048
  319   2HG   PRO  39          1HG       PRO  39   0.360   3.968 -13.665
  320   1HD   PRO  39          2HD       PRO  39   1.612   5.143 -11.594
  321   2HD   PRO  39          1HD       PRO  39   0.787   6.094 -12.846
  322    H    LEU  40           H        LEU  40  -3.974   4.658 -10.473
  323    HA   LEU  40           HA       LEU  40  -3.372   3.622  -7.914
  324   1HB   LEU  40          2HB       LEU  40  -5.823   3.708  -9.630
  325   2HB   LEU  40          1HB       LEU  40  -5.816   2.761  -8.164
  326    HG   LEU  40           HG       LEU  40  -6.829   4.879  -7.700
  327   1HD1  LEU  40          1HD1      LEU  40  -5.423   3.936  -5.943
  328   2HD1  LEU  40          2HD1      LEU  40  -5.422   5.699  -5.901
  329   3HD1  LEU  40          3HD1      LEU  40  -4.038   4.834  -6.569
  330   1HD2  LEU  40          1HD2      LEU  40  -5.883   6.172  -9.533
  331   2HD2  LEU  40          2HD2      LEU  40  -4.303   6.146  -8.750
  332   3HD2  LEU  40          3HD2      LEU  40  -5.648   6.999  -7.993
  333    HA   PRO  41           HA       PRO  41  -2.349  -0.549  -9.170
  334   1HB   PRO  41          2HB       PRO  41  -2.203  -1.598  -6.673
  335   2HB   PRO  41          1HB       PRO  41  -0.921  -0.594  -7.363
  336   1HG   PRO  41          2HG       PRO  41  -3.105   0.165  -5.461
  337   2HG   PRO  41          1HG       PRO  41  -1.390   0.615  -5.434
  338   1HD   PRO  41          2HD       PRO  41  -3.316   2.274  -6.361
  339   2HD   PRO  41          1HD       PRO  41  -1.666   2.262  -7.014
  340    H    THR  42           H        THR  42  -3.228  -2.782  -8.598
  341    HA   THR  42           HA       THR  42  -6.147  -2.531  -8.615
  342    HB   THR  42           HB       THR  42  -6.108  -4.930  -9.362
  343    HG1  THR  42           HG1      THR  42  -3.305  -4.487  -9.674
  344   1HG2  THR  42          1HG2      THR  42  -5.315  -4.447 -11.630
  345   2HG2  THR  42          2HG2      THR  42  -4.506  -2.996 -11.040
  346   3HG2  THR  42          3HG2      THR  42  -6.266  -3.108 -10.989
  347    H    GLN  43           H        GLN  43  -7.409  -4.272  -7.496
  348    HA   GLN  43           HA       GLN  43  -6.898  -4.303  -4.783
  349   1HB   GLN  43          2HB       GLN  43  -8.733  -5.678  -6.628
  350   2HB   GLN  43          1HB       GLN  43  -8.609  -6.293  -5.007
  351   1HG   GLN  43          2HG       GLN  43  -9.313  -3.474  -5.765
  352   2HG   GLN  43          1HG       GLN  43 -10.457  -4.712  -5.251
  353   1HE2  GLN  43          1HE2      GLN  43  -8.694  -5.807  -3.223
  354   2HE2  GLN  43          2HE2      GLN  43  -8.677  -4.656  -1.926
  355    H    ALA  44           H        ALA  44  -6.231  -6.717  -7.267
  356    HA   ALA  44           HA       ALA  44  -5.262  -8.747  -5.588
  357   1HB   ALA  44          1HB       ALA  44  -4.411  -8.110  -8.414
  358   2HB   ALA  44          2HB       ALA  44  -5.802  -9.091  -7.956
  359   3HB   ALA  44          3HB       ALA  44  -4.173  -9.642  -7.570
  360    H    GLU  45           H        GLU  45  -3.610  -6.074  -7.218
  361    HA   GLU  45           HA       GLU  45  -1.002  -6.585  -6.361
  362   1HB   GLU  45          2HB       GLU  45  -2.479  -4.092  -7.142
  363   2HB   GLU  45          1HB       GLU  45  -0.821  -3.995  -6.584
  364   1HG   GLU  45          2HG       GLU  45  -0.073  -5.393  -8.386
  365   2HG   GLU  45          1HG       GLU  45  -1.738  -5.692  -8.885
  366    H    LEU  46           H        LEU  46  -3.524  -4.558  -4.887
  367    HA   LEU  46           HA       LEU  46  -2.129  -3.665  -2.668
  368   1HB   LEU  46          2HB       LEU  46  -5.055  -4.363  -2.917
  369   2HB   LEU  46          1HB       LEU  46  -4.359  -3.427  -1.616
  370    HG   LEU  46           HG       LEU  46  -4.378  -2.620  -4.520
  371   1HD1  LEU  46          1HD1      LEU  46  -6.596  -2.527  -3.555
  372   2HD1  LEU  46          2HD1      LEU  46  -5.963  -0.896  -3.778
  373   3HD1  LEU  46          3HD1      LEU  46  -5.980  -1.623  -2.172
  374   1HD2  LEU  46          1HD2      LEU  46  -3.552  -0.471  -3.703
  375   2HD2  LEU  46          2HD2      LEU  46  -2.424  -1.774  -3.326
  376   3HD2  LEU  46          3HD2      LEU  46  -3.469  -1.121  -2.066
  377    H    GLU  47           H        GLU  47  -4.067  -6.635  -3.013
  378    HA   GLU  47           HA       GLU  47  -3.623  -7.491  -0.351
  379   1HB   GLU  47          2HB       GLU  47  -4.548  -8.970  -2.800
  380   2HB   GLU  47          1HB       GLU  47  -4.429  -9.719  -1.213
  381   1HG   GLU  47          2HG       GLU  47  -5.966  -7.959  -0.352
  382   2HG   GLU  47          1HG       GLU  47  -6.175  -7.416  -2.015
  383    H    THR  48           H        THR  48  -1.806  -7.866  -3.299
  384    HA   THR  48           HA       THR  48  -0.216 -10.061  -2.540
  385    HB   THR  48           HB       THR  48   0.504  -7.754  -4.363
  386    HG1  THR  48           HG1      THR  48  -1.397  -9.056  -4.922
  387   1HG2  THR  48          1HG2      THR  48   1.709 -10.519  -4.159
  388   2HG2  THR  48          2HG2      THR  48   2.482  -9.020  -3.639
  389   3HG2  THR  48          3HG2      THR  48   2.133  -9.291  -5.348
  390    H    TRP  49           H        TRP  49   0.416  -6.550  -2.282
  391    HA   TRP  49           HA       TRP  49   2.853  -6.818  -0.876
  392   1HB   TRP  49          2HB       TRP  49   0.898  -4.509  -0.805
  393   2HB   TRP  49          1HB       TRP  49   2.584  -4.450  -0.306
  394    HD1  TRP  49           HD1      TRP  49   4.091  -5.695  -2.676
  395    HE1  TRP  49           HE1      TRP  49   4.083  -4.605  -5.013
  396    HE3  TRP  49           HE3      TRP  49  -0.151  -2.867  -2.233
  397    HZ2  TRP  49           HZ2      TRP  49   2.487  -2.798  -6.465
  398    HZ3  TRP  49           HZ3      TRP  49  -0.844  -1.483  -4.149
  399    HH2  TRP  49           HH2      TRP  49   0.448  -1.451  -6.219
  400    H    TRP  50           H        TRP  50  -0.493  -6.503   0.157
  401    HA   TRP  50           HA       TRP  50  -0.118  -6.293   2.913
  402   1HB   TRP  50          2HB       TRP  50  -2.279  -5.908   1.940
  403   2HB   TRP  50          1HB       TRP  50  -2.336  -7.535   1.278
  404    HD1  TRP  50           HD1      TRP  50  -3.417  -9.367   2.744
  405    HE1  TRP  50           HE1      TRP  50  -4.423  -9.436   5.107
  406    HE3  TRP  50           HE3      TRP  50  -1.903  -4.773   4.399
  407    HZ2  TRP  50           HZ2      TRP  50  -4.558  -7.764   7.376
  408    HZ3  TRP  50           HZ3      TRP  50  -2.512  -4.085   6.682
  409    HH2  TRP  50           HH2      TRP  50  -3.814  -5.552   8.139
  410    H    GLU  51           H        GLU  51  -0.548  -9.213   0.912
  411    HA   GLU  51           HA       GLU  51  -0.391 -11.095   2.910
  412   1HB   GLU  51          2HB       GLU  51  -1.178 -11.324   0.530
  413   2HB   GLU  51          1HB       GLU  51   0.518 -11.363   0.064
  414   1HG   GLU  51          2HG       GLU  51   0.845 -13.248   1.529
  415   2HG   GLU  51          1HG       GLU  51  -0.868 -13.252   1.892
  416    H    GLU  52           H        GLU  52   2.166  -9.714   0.854
  417    HA   GLU  52           HA       GLU  52   4.222 -11.322   1.922
  418   1HB   GLU  52          2HB       GLU  52   4.299  -8.655   0.518
  419   2HB   GLU  52          1HB       GLU  52   5.748  -9.535   0.994
  420   1HG   GLU  52          2HG       GLU  52   4.965 -11.458  -0.353
  421   2HG   GLU  52          1HG       GLU  52   3.613 -10.475  -0.902
  422    H    LEU  53           H        LEU  53   3.031  -8.094   2.785
  423    HA   LEU  53           HA       LEU  53   4.878  -7.549   4.820
  424   1HB   LEU  53          2HB       LEU  53   3.327  -5.891   3.845
  425   2HB   LEU  53          1HB       LEU  53   1.983  -6.697   4.626
  426    HG   LEU  53           HG       LEU  53   4.200  -5.704   6.354
  427   1HD1  LEU  53          1HD1      LEU  53   3.807  -3.834   4.838
  428   2HD1  LEU  53          2HD1      LEU  53   3.181  -3.483   6.449
  429   3HD1  LEU  53          3HD1      LEU  53   2.074  -3.935   5.153
  430   1HD2  LEU  53          1HD2      LEU  53   2.318  -6.947   7.314
  431   2HD2  LEU  53          2HD2      LEU  53   1.197  -5.759   6.648
  432   3HD2  LEU  53          3HD2      LEU  53   2.353  -5.281   7.890
  433    H    GLN  54           H        GLN  54   1.857  -9.368   4.847
  434    HA   GLN  54           HA       GLN  54   1.774  -9.783   7.644
  435   1HB   GLN  54          2HB       GLN  54   0.472 -11.125   5.294
  436   2HB   GLN  54          1HB       GLN  54   0.243 -11.713   6.928
  437   1HG   GLN  54          2HG       GLN  54  -0.437  -8.950   5.958
  438   2HG   GLN  54          1HG       GLN  54  -1.582 -10.267   6.214
  439   1HE2  GLN  54          1HE2      GLN  54   0.422  -7.878   7.732
  440   2HE2  GLN  54          2HE2      GLN  54  -0.195  -8.074   9.337
  441    H    LYS  55           H        LYS  55   3.165 -11.615   4.957
  442    HA   LYS  55           HA       LYS  55   3.860 -13.841   6.643
  443   1HB   LYS  55          2HB       LYS  55   3.338 -14.003   4.185
  444   2HB   LYS  55          1HB       LYS  55   4.908 -13.268   3.880
  445   1HG   LYS  55          2HG       LYS  55   5.953 -15.141   5.135
  446   2HG   LYS  55          1HG       LYS  55   4.363 -15.897   5.235
  447   1HD   LYS  55          2HD       LYS  55   4.233 -16.005   2.814
  448   2HD   LYS  55          1HD       LYS  55   5.788 -15.180   2.679
  449   1HE   LYS  55          2HE       LYS  55   6.869 -17.038   3.845
  450   2HE   LYS  55          1HE       LYS  55   5.315 -17.858   3.978
  451   1HZ   LYS  55          1HZ       LYS  55   5.215 -17.999   1.576
  452   2HZ   LYS  55          2HZ       LYS  55   6.644 -18.710   2.144
  453   3HZ   LYS  55          3HZ       LYS  55   6.687 -17.174   1.432
  454    H    ASN  56           H        ASN  56   5.242 -10.841   6.147
  455    HA   ASN  56           HA       ASN  56   7.977 -11.807   6.542
  456   1HB   ASN  56          2HB       ASN  56   6.859  -9.162   5.656
  457   2HB   ASN  56          1HB       ASN  56   8.528  -9.309   6.198
  458   1HD2  ASN  56          1HD2      ASN  56   7.498  -8.603   3.578
  459   2HD2  ASN  56          2HD2      ASN  56   8.132  -9.765   2.466
  460    HA   PRO  57           HA       PRO  57   8.155 -10.432  10.765
  461   1HB   PRO  57          2HB       PRO  57  10.982  -9.852  10.506
  462   2HB   PRO  57          1HB       PRO  57  10.210 -11.222  11.306
  463   1HG   PRO  57          2HG       PRO  57  11.693 -11.444   9.023
  464   2HG   PRO  57          1HG       PRO  57  10.389 -12.561   9.463
  465   1HD   PRO  57          2HD       PRO  57  10.352 -10.264   7.545
  466   2HD   PRO  57          1HD       PRO  57   9.612 -11.873   7.394
  467    HA   PRO  58           HA       PRO  58   8.172  -5.999  10.900
  468   1HB   PRO  58          2HB       PRO  58   9.528  -6.041  13.507
  469   2HB   PRO  58          1HB       PRO  58   7.897  -5.505  13.103
  470   1HG   PRO  58          2HG       PRO  58   8.348  -7.760  14.498
  471   2HG   PRO  58          1HG       PRO  58   6.995  -7.609  13.364
  472   1HD   PRO  58          2HD       PRO  58   9.631  -8.977  12.996
  473   2HD   PRO  58          1HD       PRO  58   8.010  -9.496  12.488
  474    H    TYR  59           H        TYR  59   9.476  -4.263  10.460
  475    HA   TYR  59           HA       TYR  59  12.277  -4.810   9.968
  476   1HB   TYR  59          2HB       TYR  59  10.644  -3.450   8.473
  477   2HB   TYR  59          1HB       TYR  59  10.923  -2.142   9.615
  478    HD1  TYR  59           HD1      TYR  59  12.778  -0.723   9.329
  479    HD2  TYR  59           HD2      TYR  59  12.701  -4.489   7.346
  480    HE1  TYR  59           HE1      TYR  59  14.799  -0.099   8.069
  481    HE2  TYR  59           HE2      TYR  59  14.723  -3.878   6.094
  482    HH   TYR  59           HH       TYR  59  16.632  -1.146   6.889
  483    H    GLU  60           H        GLU  60  13.992  -3.723  10.988
  484    HA   GLU  60           HA       GLU  60  13.461  -2.971  13.725
  485   1HB   GLU  60          2HB       GLU  60  15.371  -4.369  13.273
  486   2HB   GLU  60          1HB       GLU  60  16.013  -3.203  12.125
  487   1HG   GLU  60          2HG       GLU  60  16.175  -1.586  14.064
  488   2HG   GLU  60          1HG       GLU  60  15.849  -2.964  15.115
  Start of MODEL    9
    1   1H    MET   1          1H        MET   1 -10.771  -3.323   4.937
    2   2H    MET   1          2H        MET   1 -10.341  -3.963   6.448
    3   3H    MET   1          3H        MET   1 -10.796  -5.003   5.190
    4    HA   MET   1           HA       MET   1  -8.397  -4.999   5.528
    5   1HB   MET   1          2HB       MET   1  -9.365  -5.404   3.283
    6   2HB   MET   1          1HB       MET   1  -9.290  -3.678   2.950
    7   1HG   MET   1          2HG       MET   1  -6.842  -3.761   3.155
    8   2HG   MET   1          1HG       MET   1  -6.936  -5.498   3.445
    9   1HE   MET   1          1HE       MET   1  -5.079  -4.278   1.173
   10   2HE   MET   1          2HE       MET   1  -5.437  -5.371  -0.164
   11   3HE   MET   1          3HE       MET   1  -5.244  -6.009   1.471
   12    H    ILE   2           H        ILE   2  -6.471  -3.832   5.736
   13    HA   ILE   2           HA       ILE   2  -6.840  -0.938   6.044
   14    HB   ILE   2           HB       ILE   2  -4.580  -2.626   7.117
   15   1HG1  ILE   2          2HG1      ILE   2  -5.700  -1.952   9.363
   16   2HG1  ILE   2          1HG1      ILE   2  -7.138  -1.683   8.388
   17   1HG2  ILE   2          1HG2      ILE   2  -4.067  -0.637   8.466
   18   2HG2  ILE   2          2HG2      ILE   2  -5.338   0.242   7.615
   19   3HG2  ILE   2          3HG2      ILE   2  -3.926  -0.341   6.733
   20   1HD1  ILE   2          1HD1      ILE   2  -5.637  -4.277   8.639
   21   2HD1  ILE   2          2HD1      ILE   2  -7.084  -4.009   7.665
   22   3HD1  ILE   2          3HD1      ILE   2  -7.164  -3.872   9.421
   23    H    LEU   3           H        LEU   3  -6.256   0.163   4.334
   24    HA   LEU   3           HA       LEU   3  -4.545  -0.781   2.287
   25   1HB   LEU   3          2HB       LEU   3  -6.142   1.597   2.913
   26   2HB   LEU   3          1HB       LEU   3  -4.747   1.901   1.917
   27    HG   LEU   3           HG       LEU   3  -6.667   1.567   0.509
   28   1HD1  LEU   3          1HD1      LEU   3  -5.915  -0.320  -0.858
   29   2HD1  LEU   3          2HD1      LEU   3  -4.858  -0.839   0.457
   30   3HD1  LEU   3          3HD1      LEU   3  -4.574   0.705  -0.347
   31   1HD2  LEU   3          1HD2      LEU   3  -8.054   0.301   2.051
   32   2HD2  LEU   3          2HD2      LEU   3  -6.976  -1.088   1.906
   33   3HD2  LEU   3          3HD2      LEU   3  -7.914  -0.547   0.513
   34    H    TYR   4           H        TYR   4  -4.144   1.163   5.096
   35    HA   TYR   4           HA       TYR   4  -1.905   2.667   4.628
   36   1HB   TYR   4          2HB       TYR   4  -3.182   2.908   6.652
   37   2HB   TYR   4          1HB       TYR   4  -2.815   1.261   7.142
   38    HD1  TYR   4           HD1      TYR   4  -1.434   4.666   6.787
   39    HD2  TYR   4           HD2      TYR   4  -0.799   0.742   8.302
   40    HE1  TYR   4           HE1      TYR   4   0.436   5.498   8.151
   41    HE2  TYR   4           HE2      TYR   4   1.077   1.560   9.660
   42    HH   TYR   4           HH       TYR   4   1.663   4.858  10.192
   43    H    ASP   5           H        ASP   5  -2.037  -0.747   5.551
   44    HA   ASP   5           HA       ASP   5   0.731  -1.040   6.014
   45   1HB   ASP   5          2HB       ASP   5  -1.402  -3.076   5.362
   46   2HB   ASP   5          1HB       ASP   5   0.246  -3.495   5.791
   47    H    ALA   6           H        ALA   6  -1.267  -2.018   3.258
   48    HA   ALA   6           HA       ALA   6   0.779  -3.127   1.725
   49   1HB   ALA   6          1HB       ALA   6  -1.620  -3.453   1.294
   50   2HB   ALA   6          2HB       ALA   6  -0.741  -2.956  -0.150
   51   3HB   ALA   6          3HB       ALA   6  -1.731  -1.787   0.724
   52    H    ILE   7           H        ILE   7  -0.460   0.189   1.820
   53    HA   ILE   7           HA       ILE   7   1.007   1.141  -0.393
   54    HB   ILE   7           HB       ILE   7   0.017   2.745   1.969
   55   1HG1  ILE   7          2HG1      ILE   7  -1.299   2.222  -0.703
   56   2HG1  ILE   7          1HG1      ILE   7  -1.751   1.431   0.805
   57   1HG2  ILE   7          1HG2      ILE   7   0.771   3.604  -0.831
   58   2HG2  ILE   7          2HG2      ILE   7   1.689   3.935   0.639
   59   3HG2  ILE   7          3HG2      ILE   7   0.091   4.643   0.424
   60   1HD1  ILE   7          1HD1      ILE   7  -3.273   3.235   0.266
   61   2HD1  ILE   7          2HD1      ILE   7  -1.928   4.377   0.222
   62   3HD1  ILE   7          3HD1      ILE   7  -2.373   3.596   1.739
   63    H    MET   8           H        MET   8   1.752   1.117   3.090
   64    HA   MET   8           HA       MET   8   4.214   2.556   2.611
   65   1HB   MET   8          2HB       MET   8   3.014   1.374   5.107
   66   2HB   MET   8          1HB       MET   8   4.585   2.163   5.076
   67   1HG   MET   8          2HG       MET   8   3.401   4.183   4.121
   68   2HG   MET   8          1HG       MET   8   1.893   3.371   4.535
   69   1HE   MET   8          1HE       MET   8   5.191   5.000   5.885
   70   2HE   MET   8          2HE       MET   8   5.329   3.349   6.487
   71   3HE   MET   8          3HE       MET   8   5.074   4.680   7.615
   72    H    TYR   9           H        TYR   9   3.275  -0.667   2.430
   73    HA   TYR   9           HA       TYR   9   5.822  -1.798   3.097
   74   1HB   TYR   9          2HB       TYR   9   3.817  -3.177   3.235
   75   2HB   TYR   9          1HB       TYR   9   3.510  -2.943   1.517
   76    HD1  TYR   9           HD1      TYR   9   4.091  -4.691   0.131
   77    HD2  TYR   9           HD2      TYR   9   6.318  -4.107   3.709
   78    HE1  TYR   9           HE1      TYR   9   5.443  -6.674  -0.394
   79    HE2  TYR   9           HE2      TYR   9   7.671  -6.097   3.198
   80    HH   TYR   9           HH       TYR   9   7.325  -7.815   0.132
   81    H    LYS  10           H        LYS  10   4.176  -0.757   0.143
   82    HA   LYS  10           HA       LYS  10   6.430  -1.464  -1.518
   83   1HB   LYS  10          2HB       LYS  10   4.072  -1.464  -2.360
   84   2HB   LYS  10          1HB       LYS  10   4.063   0.288  -2.207
   85   1HG   LYS  10          2HG       LYS  10   5.896   0.433  -3.833
   86   2HG   LYS  10          1HG       LYS  10   5.872  -1.325  -3.998
   87   1HD   LYS  10          2HD       LYS  10   3.465  -1.122  -4.681
   88   2HD   LYS  10          1HD       LYS  10   3.700   0.624  -4.737
   89   1HE   LYS  10          2HE       LYS  10   5.343  -1.349  -6.309
   90   2HE   LYS  10          1HE       LYS  10   3.913  -0.541  -6.942
   91   1HZ   LYS  10          1HZ       LYS  10   5.016   1.593  -6.597
   92   2HZ   LYS  10          2HZ       LYS  10   5.924   0.593  -7.619
   93   3HZ   LYS  10          3HZ       LYS  10   6.399   0.803  -6.006
   94    H    TYR  11           H        TYR  11   5.119   1.453  -0.025
   95    HA   TYR  11           HA       TYR  11   7.566   2.865  -0.865
   96   1HB   TYR  11          2HB       TYR  11   4.828   4.065  -0.387
   97   2HB   TYR  11          1HB       TYR  11   6.279   4.957  -0.831
   98    HD1  TYR  11           HD1      TYR  11   3.434   3.165  -2.014
   99    HD2  TYR  11           HD2      TYR  11   7.348   4.433  -3.089
  100    HE1  TYR  11           HE1      TYR  11   2.879   2.836  -4.383
  101    HE2  TYR  11           HE2      TYR  11   6.805   4.112  -5.466
  102    HH   TYR  11           HH       TYR  11   3.618   3.587  -6.580
  103    HA   PRO  12           HA       PRO  12   7.955   2.713   3.682
  104   1HB   PRO  12          2HB       PRO  12  10.683   3.595   2.953
  105   2HB   PRO  12          1HB       PRO  12  10.170   2.242   3.961
  106   1HG   PRO  12          2HG       PRO  12  11.180   1.841   1.524
  107   2HG   PRO  12          1HG       PRO  12   9.863   0.833   2.155
  108   1HD   PRO  12          2HD       PRO  12   9.743   3.108   0.206
  109   2HD   PRO  12          1HD       PRO  12   8.876   1.556   0.183
  110    H    ASN  13           H        ASN  13   8.701   5.178   1.334
  111    HA   ASN  13           HA       ASN  13   8.843   7.242   3.396
  112   1HB   ASN  13          2HB       ASN  13   9.477   7.236   0.446
  113   2HB   ASN  13          1HB       ASN  13   9.458   8.700   1.415
  114   1HD2  ASN  13          1HD2      ASN  13  11.644   7.400  -0.023
  115   2HD2  ASN  13          2HD2      ASN  13  12.879   7.116   1.157
  116    H    ALA  14           H        ALA  14   6.371   5.762   2.318
  117    HA   ALA  14           HA       ALA  14   4.854   7.944   1.160
  118   1HB   ALA  14          1HB       ALA  14   4.472   5.694   0.321
  119   2HB   ALA  14          2HB       ALA  14   3.006   6.339   1.061
  120   3HB   ALA  14          3HB       ALA  14   3.990   5.162   1.931
  121    H    VAL  15           H        VAL  15   4.465   9.504   2.610
  122    HA   VAL  15           HA       VAL  15   3.628   8.839   5.308
  123    HB   VAL  15           HB       VAL  15   3.890  11.578   4.054
  124   1HG1  VAL  15          1HG1      VAL  15   3.807  10.726   6.947
  125   2HG1  VAL  15          2HG1      VAL  15   2.494  11.497   6.060
  126   3HG1  VAL  15          3HG1      VAL  15   3.994  12.378   6.351
  127   1HG2  VAL  15          1HG2      VAL  15   5.903  10.029   5.683
  128   2HG2  VAL  15          2HG2      VAL  15   6.075  11.700   5.142
  129   3HG2  VAL  15          3HG2      VAL  15   6.016  10.390   3.962
  130    H    SER  16           H        SER  16   1.566   8.470   5.767
  131    HA   SER  16           HA       SER  16  -0.528   9.062   3.931
  132   1HB   SER  16          2HB       SER  16  -1.998   8.206   5.807
  133   2HB   SER  16          1HB       SER  16  -0.757   7.085   5.251
  134    HG   SER  16           HG       SER  16   0.218   7.220   7.123
  135    H    ARG  17           H        ARG  17  -2.298  10.446   4.236
  136    HA   ARG  17           HA       ARG  17  -3.331  12.407   4.699
  137   1HB   ARG  17          2HB       ARG  17  -1.792  12.325   7.303
  138   2HB   ARG  17          1HB       ARG  17  -3.171  13.358   6.950
  139   1HG   ARG  17          2HG       ARG  17  -4.554  11.332   6.639
  140   2HG   ARG  17          1HG       ARG  17  -3.170  10.355   7.129
  141   1HD   ARG  17          2HD       ARG  17  -3.129  11.620   9.274
  142   2HD   ARG  17          1HD       ARG  17  -4.625  12.411   8.776
  143    HE   ARG  17           HE       ARG  17  -4.377   9.492   9.141
  144   1HH1  ARG  17          1HH1      ARG  17  -6.177  12.482   9.386
  145   2HH1  ARG  17          2HH1      ARG  17  -7.514  11.764  10.238
  146   1HH2  ARG  17          1HH2      ARG  17  -6.132   8.532  10.244
  147   2HH2  ARG  17          2HH2      ARG  17  -7.481   9.505  10.740
  148    H    LYS  18           H        LYS  18  -0.576  12.173   3.545
  149    HA   LYS  18           HA       LYS  18   0.034  15.045   3.690
  150   1HB   LYS  18          2HB       LYS  18   1.817  13.650   4.738
  151   2HB   LYS  18          1HB       LYS  18   2.025  12.808   3.213
  152   1HG   LYS  18          2HG       LYS  18   2.348  15.778   3.328
  153   2HG   LYS  18          1HG       LYS  18   3.648  14.722   3.880
  154   1HD   LYS  18          2HD       LYS  18   3.598  13.589   1.674
  155   2HD   LYS  18          1HD       LYS  18   2.381  14.750   1.141
  156   1HE   LYS  18          2HE       LYS  18   3.948  16.575   1.487
  157   2HE   LYS  18          1HE       LYS  18   5.159  15.438   2.079
  158   1HZ   LYS  18          1HZ       LYS  18   4.069  15.647  -0.670
  159   2HZ   LYS  18          2HZ       LYS  18   4.984  14.322  -0.143
  160   3HZ   LYS  18          3HZ       LYS  18   5.674  15.870  -0.170
  161    H    ASP  19           H        ASP  19   1.000  12.324   1.591
  162    HA   ASP  19           HA       ASP  19   0.096  13.938  -0.698
  163   1HB   ASP  19          2HB       ASP  19   2.589  12.974  -0.296
  164   2HB   ASP  19          1HB       ASP  19   1.882  11.624  -1.183
  165    H    PHE  20           H        PHE  20  -0.922  11.569   1.192
  166    HA   PHE  20           HA       PHE  20  -3.038  10.924  -0.578
  167   1HB   PHE  20          2HB       PHE  20  -2.801   8.505  -0.641
  168   2HB   PHE  20          1HB       PHE  20  -1.374   9.241  -1.356
  169    HD1  PHE  20           HD1      PHE  20  -2.655   7.086   1.217
  170    HD2  PHE  20           HD2      PHE  20   0.746   9.318  -0.033
  171    HE1  PHE  20           HE1      PHE  20  -1.239   5.766   2.730
  172    HE2  PHE  20           HE2      PHE  20   2.167   8.002   1.480
  173    HZ   PHE  20           HZ       PHE  20   1.175   6.222   2.865
  174    H    GLU  21           H        GLU  21  -4.824  10.689   0.647
  175    HA   GLU  21           HA       GLU  21  -4.333  10.504   3.546
  176   1HB   GLU  21          2HB       GLU  21  -5.063  12.731   2.742
  177   2HB   GLU  21          1HB       GLU  21  -6.546  12.002   2.145
  178   1HG   GLU  21          2HG       GLU  21  -7.275  11.486   4.341
  179   2HG   GLU  21          1HG       GLU  21  -5.704  11.903   5.028
  180    H    LEU  22           H        LEU  22  -5.349   9.035   4.686
  181    HA   LEU  22           HA       LEU  22  -7.330   7.342   3.327
  182   1HB   LEU  22          2HB       LEU  22  -5.684   6.617   5.747
  183   2HB   LEU  22          1HB       LEU  22  -6.620   5.543   4.728
  184    HG   LEU  22           HG       LEU  22  -4.104   6.983   3.883
  185   1HD1  LEU  22          1HD1      LEU  22  -4.575   4.079   4.542
  186   2HD1  LEU  22          2HD1      LEU  22  -3.681   5.232   5.534
  187   3HD1  LEU  22          3HD1      LEU  22  -3.072   4.779   3.941
  188   1HD2  LEU  22          1HD2      LEU  22  -4.217   5.572   1.903
  189   2HD2  LEU  22          2HD2      LEU  22  -5.648   6.595   2.030
  190   3HD2  LEU  22          3HD2      LEU  22  -5.739   4.887   2.464
  191    H    ARG  23           H        ARG  23  -9.142   6.618   4.566
  192    HA   ARG  23           HA       ARG  23  -9.570   8.021   7.108
  193   1HB   ARG  23          2HB       ARG  23 -11.423   8.016   4.753
  194   2HB   ARG  23          1HB       ARG  23 -12.058   8.154   6.387
  195   1HG   ARG  23          2HG       ARG  23 -11.863  10.345   5.861
  196   2HG   ARG  23          1HG       ARG  23 -10.262  10.077   6.546
  197   1HD   ARG  23          2HD       ARG  23  -9.360   9.716   4.306
  198   2HD   ARG  23          1HD       ARG  23 -10.957   9.987   3.615
  199    HE   ARG  23           HE       ARG  23  -9.142  11.989   4.688
  200   1HH1  ARG  23          1HH1      ARG  23 -12.375  11.268   3.588
  201   2HH1  ARG  23          2HH1      ARG  23 -12.711  12.894   3.077
  202   1HH2  ARG  23          1HH2      ARG  23  -9.557  14.133   4.018
  203   2HH2  ARG  23          2HH2      ARG  23 -11.124  14.530   3.357
  204    H    ASN  24           H        ASN  24 -11.666   7.181   8.125
  205    HA   ASN  24           HA       ASN  24 -11.349   4.258   8.222
  206   1HB   ASN  24          2HB       ASN  24 -10.999   5.524  10.327
  207   2HB   ASN  24          1HB       ASN  24 -12.653   6.115  10.225
  208   1HD2  ASN  24          1HD2      ASN  24 -14.334   4.779  10.765
  209   2HD2  ASN  24          2HD2      ASN  24 -14.107   3.223  11.505
  210    H    ASP  25           H        ASP  25 -12.854   2.997   7.395
  211    HA   ASP  25           HA       ASP  25 -15.426   4.177   6.628
  212   1HB   ASP  25          2HB       ASP  25 -14.383   3.105   4.794
  213   2HB   ASP  25          1HB       ASP  25 -13.937   1.704   5.761
  214    H    GLY  26           H        GLY  26 -14.032   1.683   8.643
  215   1HA   GLY  26          2HA       GLY  26 -15.407   1.000  10.590
  216   2HA   GLY  26          1HA       GLY  26 -16.756   0.872   9.465
  217    H    ASN  27           H        ASN  27 -15.104  -0.230   7.353
  218    HA   ASN  27           HA       ASN  27 -14.786  -2.960   8.365
  219   1HB   ASN  27          2HB       ASN  27 -16.248  -2.512   6.361
  220   2HB   ASN  27          1HB       ASN  27 -14.805  -2.013   5.489
  221   1HD2  ASN  27          1HD2      ASN  27 -16.554  -4.663   6.865
  222   2HD2  ASN  27          2HD2      ASN  27 -15.650  -5.924   6.094
  223    H    GLY  28           H        GLY  28 -13.018  -0.252   7.753
  224   1HA   GLY  28          2HA       GLY  28 -10.534  -1.081   8.327
  225   2HA   GLY  28          1HA       GLY  28 -10.672  -1.512   6.628
  226    H    SER  29           H        SER  29  -8.734   0.172   7.071
  227    HA   SER  29           HA       SER  29  -9.714   2.899   6.694
  228   1HB   SER  29          2HB       SER  29  -6.850   1.938   6.929
  229   2HB   SER  29          1HB       SER  29  -7.430   3.598   7.070
  230    HG   SER  29           HG       SER  29  -7.558   3.162   9.125
  231    H    TYR  30           H        TYR  30 -10.047   3.597   4.695
  232    HA   TYR  30           HA       TYR  30  -8.832   2.098   2.473
  233   1HB   TYR  30          2HB       TYR  30 -10.737   2.819   1.136
  234   2HB   TYR  30          1HB       TYR  30 -11.295   2.038   2.607
  235    HD1  TYR  30           HD1      TYR  30 -12.405   3.343   4.368
  236    HD2  TYR  30           HD2      TYR  30 -11.080   5.188   0.770
  237    HE1  TYR  30           HE1      TYR  30 -13.754   5.334   4.893
  238    HE2  TYR  30           HE2      TYR  30 -12.427   7.173   1.283
  239    HH   TYR  30           HH       TYR  30 -14.019   8.026   2.605
  240    H    ILE  31           H        ILE  31  -8.654   3.401   0.408
  241    HA   ILE  31           HA       ILE  31  -7.178   5.858   0.940
  242    HB   ILE  31           HB       ILE  31  -7.704   4.498  -1.707
  243   1HG1  ILE  31          2HG1      ILE  31  -5.262   4.317   0.075
  244   2HG1  ILE  31          1HG1      ILE  31  -6.452   3.040  -0.143
  245   1HG2  ILE  31          1HG2      ILE  31  -7.126   6.841  -1.953
  246   2HG2  ILE  31          2HG2      ILE  31  -5.797   5.822  -2.506
  247   3HG2  ILE  31          3HG2      ILE  31  -5.700   6.621  -0.936
  248   1HD1  ILE  31          1HD1      ILE  31  -4.714   4.174  -2.324
  249   2HD1  ILE  31          2HD1      ILE  31  -5.851   2.831  -2.476
  250   3HD1  ILE  31          3HD1      ILE  31  -4.423   2.668  -1.454
  251    H    GLU  32           H        GLU  32  -8.162   7.760   0.947
  252    HA   GLU  32           HA       GLU  32 -10.716   8.004  -0.473
  253   1HB   GLU  32          2HB       GLU  32 -10.648   8.546   1.955
  254   2HB   GLU  32          1HB       GLU  32  -9.519   9.845   1.596
  255   1HG   GLU  32          2HG       GLU  32 -11.749  10.720   1.871
  256   2HG   GLU  32          1HG       GLU  32 -11.214  10.929   0.204
  257    H    LYS  33           H        LYS  33  -7.783   9.926   0.157
  258    HA   LYS  33           HA       LYS  33  -8.204  11.228  -2.440
  259   1HB   LYS  33          2HB       LYS  33  -8.715  12.803  -0.730
  260   2HB   LYS  33          1HB       LYS  33  -7.291  12.359   0.198
  261   1HG   LYS  33          2HG       LYS  33  -5.861  13.518  -1.221
  262   2HG   LYS  33          1HG       LYS  33  -7.039  13.557  -2.528
  263   1HD   LYS  33          2HD       LYS  33  -6.569  15.677  -1.115
  264   2HD   LYS  33          1HD       LYS  33  -8.209  15.289  -1.605
  265   1HE   LYS  33          2HE       LYS  33  -8.300  15.925   0.671
  266   2HE   LYS  33          1HE       LYS  33  -8.493  14.177   0.627
  267   1HZ   LYS  33          1HZ       LYS  33  -6.112  15.734   1.455
  268   2HZ   LYS  33          2HZ       LYS  33  -6.022  14.084   1.085
  269   3HZ   LYS  33          3HZ       LYS  33  -7.010  14.611   2.362
  270    H    TRP  34           H        TRP  34  -6.728  10.644  -3.815
  271    HA   TRP  34           HA       TRP  34  -4.097   9.714  -2.865
  272   1HB   TRP  34          2HB       TRP  34  -5.535   8.075  -4.026
  273   2HB   TRP  34          1HB       TRP  34  -5.629   9.140  -5.417
  274    HD1  TRP  34           HD1      TRP  34  -3.535   9.210  -7.056
  275    HE1  TRP  34           HE1      TRP  34  -1.583   7.571  -7.416
  276    HE3  TRP  34           HE3      TRP  34  -3.945   6.505  -2.737
  277    HZ2  TRP  34           HZ2      TRP  34  -0.376   5.420  -6.045
  278    HZ3  TRP  34           HZ3      TRP  34  -2.354   4.669  -2.340
  279    HH2  TRP  34           HH2      TRP  34  -0.609   4.141  -3.960
  280    H    ASN  35           H        ASN  35  -2.525  11.213  -3.121
  281    HA   ASN  35           HA       ASN  35  -2.751  13.088  -5.382
  282   1HB   ASN  35          2HB       ASN  35  -1.541  13.419  -2.642
  283   2HB   ASN  35          1HB       ASN  35  -1.117  14.494  -3.969
  284   1HD2  ASN  35          1HD2      ASN  35  -1.955  16.230  -2.830
  285   2HD2  ASN  35          2HD2      ASN  35  -3.658  16.514  -2.731
  286    H    LEU  36           H        LEU  36  -1.220  10.362  -4.614
  287    HA   LEU  36           HA       LEU  36   1.496  10.974  -5.191
  288   1HB   LEU  36          2HB       LEU  36   0.026   8.342  -5.378
  289   2HB   LEU  36          1HB       LEU  36   1.763   8.531  -5.472
  290    HG   LEU  36           HG       LEU  36   0.055   9.152  -3.073
  291   1HD1  LEU  36          1HD1      LEU  36   2.037   6.938  -3.567
  292   2HD1  LEU  36          2HD1      LEU  36   0.284   6.761  -3.500
  293   3HD1  LEU  36          3HD1      LEU  36   1.176   7.244  -2.057
  294   1HD2  LEU  36          1HD2      LEU  36   1.981  10.644  -3.241
  295   2HD2  LEU  36          2HD2      LEU  36   3.047   9.248  -3.405
  296   3HD2  LEU  36          3HD2      LEU  36   2.159   9.508  -1.904
  297    H    ARG  37           H        ARG  37   2.638  10.816  -7.094
  298    HA   ARG  37           HA       ARG  37   1.048  11.177  -9.485
  299   1HB   ARG  37          2HB       ARG  37   4.035  11.286  -9.056
  300   2HB   ARG  37          1HB       ARG  37   3.239  11.631 -10.587
  301   1HG   ARG  37          2HG       ARG  37   1.928  13.398  -9.272
  302   2HG   ARG  37          1HG       ARG  37   3.172  13.194  -8.036
  303   1HD   ARG  37          2HD       ARG  37   3.777  15.028  -9.472
  304   2HD   ARG  37          1HD       ARG  37   4.888  13.689  -9.752
  305    HE   ARG  37           HE       ARG  37   2.814  13.441 -11.596
  306   1HH1  ARG  37          1HH1      ARG  37   5.441  15.644 -10.880
  307   2HH1  ARG  37          2HH1      ARG  37   5.563  16.221 -12.512
  308   1HH2  ARG  37          1HH2      ARG  37   2.972  14.226 -13.751
  309   2HH2  ARG  37          2HH2      ARG  37   4.168  15.435 -14.131
  310    H    ALA  38           H        ALA  38   0.771   8.670  -8.466
  311    HA   ALA  38           HA       ALA  38   1.837   7.059 -10.669
  312   1HB   ALA  38          1HB       ALA  38   2.150   5.155  -9.156
  313   2HB   ALA  38          2HB       ALA  38   1.708   6.169  -7.782
  314   3HB   ALA  38          3HB       ALA  38   3.177   6.512  -8.697
  315    HA   PRO  39           HA       PRO  39  -2.452   6.121 -11.199
  316   1HB   PRO  39          2HB       PRO  39  -2.210   3.604 -12.282
  317   2HB   PRO  39          1HB       PRO  39  -2.002   5.103 -13.194
  318   1HG   PRO  39          2HG       PRO  39   0.068   3.308 -11.995
  319   2HG   PRO  39          1HG       PRO  39   0.072   4.130 -13.566
  320   1HD   PRO  39          2HD       PRO  39   1.483   5.063 -11.482
  321   2HD   PRO  39          1HD       PRO  39   0.702   6.160 -12.642
  322    H    LEU  40           H        LEU  40  -4.110   4.798 -10.355
  323    HA   LEU  40           HA       LEU  40  -3.626   3.793  -7.760
  324   1HB   LEU  40          2HB       LEU  40  -5.965   3.853  -9.617
  325   2HB   LEU  40          1HB       LEU  40  -6.038   2.822  -8.208
  326    HG   LEU  40           HG       LEU  40  -7.133   4.927  -7.753
  327   1HD1  LEU  40          1HD1      LEU  40  -5.979   3.856  -5.906
  328   2HD1  LEU  40          2HD1      LEU  40  -5.905   5.613  -5.756
  329   3HD1  LEU  40          3HD1      LEU  40  -4.494   4.716  -6.318
  330   1HD2  LEU  40          1HD2      LEU  40  -5.908   7.042  -7.753
  331   2HD2  LEU  40          2HD2      LEU  40  -5.955   6.327  -9.365
  332   3HD2  LEU  40          3HD2      LEU  40  -4.486   6.221  -8.395
  333    HA   PRO  41           HA       PRO  41  -2.139  -0.252  -8.948
  334   1HB   PRO  41          2HB       PRO  41  -2.201  -1.272  -6.398
  335   2HB   PRO  41          1HB       PRO  41  -0.875  -0.302  -7.047
  336   1HG   PRO  41          2HG       PRO  41  -3.160   0.529  -5.309
  337   2HG   PRO  41          1HG       PRO  41  -1.455   1.008  -5.222
  338   1HD   PRO  41          2HD       PRO  41  -3.325   2.615  -6.290
  339   2HD   PRO  41          1HD       PRO  41  -1.674   2.548  -6.939
  340    H    THR  42           H        THR  42  -2.867  -2.535  -8.544
  341    HA   THR  42           HA       THR  42  -5.785  -2.539  -8.780
  342    HB   THR  42           HB       THR  42  -5.405  -4.921  -9.593
  343    HG1  THR  42           HG1      THR  42  -2.692  -4.016  -9.728
  344   1HG2  THR  42          1HG2      THR  42  -5.810  -3.070 -11.139
  345   2HG2  THR  42          2HG2      THR  42  -4.634  -4.202 -11.809
  346   3HG2  THR  42          3HG2      THR  42  -4.091  -2.671 -11.122
  347    H    GLN  43           H        GLN  43  -6.921  -4.521  -7.874
  348    HA   GLN  43           HA       GLN  43  -6.625  -4.578  -5.111
  349   1HB   GLN  43          2HB       GLN  43  -8.160  -6.132  -7.107
  350   2HB   GLN  43          1HB       GLN  43  -8.165  -6.619  -5.440
  351   1HG   GLN  43          2HG       GLN  43  -9.126  -4.021  -6.585
  352   2HG   GLN  43          1HG       GLN  43 -10.094  -5.278  -5.818
  353   1HE2  GLN  43          1HE2      GLN  43  -9.837  -5.618  -3.543
  354   2HE2  GLN  43          2HE2      GLN  43  -9.320  -4.318  -2.523
  355    H    ALA  44           H        ALA  44  -5.738  -6.912  -7.625
  356    HA   ALA  44           HA       ALA  44  -4.692  -8.913  -5.984
  357   1HB   ALA  44          1HB       ALA  44  -3.794  -8.098  -8.746
  358   2HB   ALA  44          2HB       ALA  44  -5.067  -9.255  -8.359
  359   3HB   ALA  44          3HB       ALA  44  -3.391  -9.618  -7.951
  360    H    GLU  45           H        GLU  45  -3.122  -6.074  -7.403
  361    HA   GLU  45           HA       GLU  45  -0.546  -6.482  -6.417
  362   1HB   GLU  45          2HB       GLU  45  -2.118  -4.084  -7.251
  363   2HB   GLU  45          1HB       GLU  45  -0.572  -3.833  -6.462
  364   1HG   GLU  45          2HG       GLU  45   0.532  -5.146  -8.187
  365   2HG   GLU  45          1HG       GLU  45  -1.026  -5.458  -8.954
  366    H    LEU  46           H        LEU  46  -3.187  -4.560  -4.999
  367    HA   LEU  46           HA       LEU  46  -1.900  -3.748  -2.686
  368   1HB   LEU  46          2HB       LEU  46  -4.805  -4.335  -3.223
  369   2HB   LEU  46          1HB       LEU  46  -4.234  -3.592  -1.746
  370    HG   LEU  46           HG       LEU  46  -3.844  -2.421  -4.499
  371   1HD1  LEU  46          1HD1      LEU  46  -5.828  -1.696  -2.347
  372   2HD1  LEU  46          2HD1      LEU  46  -6.205  -2.470  -3.886
  373   3HD1  LEU  46          3HD1      LEU  46  -5.574  -0.823  -3.859
  374   1HD2  LEU  46          1HD2      LEU  46  -3.188  -0.413  -3.292
  375   2HD2  LEU  46          2HD2      LEU  46  -2.143  -1.764  -2.857
  376   3HD2  LEU  46          3HD2      LEU  46  -3.416  -1.244  -1.753
  377    H    GLU  47           H        GLU  47  -3.824  -6.691  -3.230
  378    HA   GLU  47           HA       GLU  47  -3.543  -7.533  -0.524
  379   1HB   GLU  47          2HB       GLU  47  -4.535  -8.980  -2.970
  380   2HB   GLU  47          1HB       GLU  47  -4.558  -9.668  -1.347
  381   1HG   GLU  47          2HG       GLU  47  -5.958  -7.776  -0.602
  382   2HG   GLU  47          1HG       GLU  47  -5.980  -7.172  -2.256
  383    H    THR  48           H        THR  48  -1.587  -7.911  -3.353
  384    HA   THR  48           HA       THR  48  -0.116 -10.186  -2.430
  385    HB   THR  48           HB       THR  48   0.743  -7.999  -4.352
  386    HG1  THR  48           HG1      THR  48  -1.089  -9.183  -5.072
  387   1HG2  THR  48          1HG2      THR  48   1.880 -10.767  -3.929
  388   2HG2  THR  48          2HG2      THR  48   2.648  -9.256  -3.438
  389   3HG2  THR  48          3HG2      THR  48   2.400  -9.603  -5.148
  390    H    TRP  49           H        TRP  49   0.404  -6.662  -2.219
  391    HA   TRP  49           HA       TRP  49   2.784  -6.813  -0.709
  392   1HB   TRP  49          2HB       TRP  49   0.684  -4.632  -0.724
  393   2HB   TRP  49          1HB       TRP  49   2.320  -4.473  -0.091
  394    HD1  TRP  49           HD1      TRP  49   4.033  -5.679  -2.385
  395    HE1  TRP  49           HE1      TRP  49   4.162  -4.545  -4.698
  396    HE3  TRP  49           HE3      TRP  49  -0.257  -2.903  -2.162
  397    HZ2  TRP  49           HZ2      TRP  49   2.639  -2.722  -6.213
  398    HZ3  TRP  49           HZ3      TRP  49  -0.840  -1.487  -4.085
  399    HH2  TRP  49           HH2      TRP  49   0.580  -1.398  -6.066
  400    H    TRP  50           H        TRP  50  -0.613  -6.754   0.162
  401    HA   TRP  50           HA       TRP  50  -0.364  -6.713   2.950
  402   1HB   TRP  50          2HB       TRP  50  -2.505  -6.405   1.793
  403   2HB   TRP  50          1HB       TRP  50  -2.451  -8.069   1.225
  404    HD1  TRP  50           HD1      TRP  50  -3.163  -9.969   2.921
  405    HE1  TRP  50           HE1      TRP  50  -4.341  -9.925   5.214
  406    HE3  TRP  50           HE3      TRP  50  -2.692  -4.986   3.968
  407    HZ2  TRP  50           HZ2      TRP  50  -4.982  -8.011   7.198
  408    HZ3  TRP  50           HZ3      TRP  50  -3.613  -4.132   6.077
  409    HH2  TRP  50           HH2      TRP  50  -4.734  -5.613   7.658
  410    H    GLU  51           H        GLU  51  -0.329  -9.390   0.641
  411    HA   GLU  51           HA       GLU  51  -0.182 -11.433   2.593
  412   1HB   GLU  51          2HB       GLU  51   0.055 -11.232  -0.351
  413   2HB   GLU  51          1HB       GLU  51   0.751 -12.647   0.404
  414   1HG   GLU  51          2HG       GLU  51  -1.528 -12.860   1.590
  415   2HG   GLU  51          1HG       GLU  51  -2.100 -11.761   0.333
  416    H    GLU  52           H        GLU  52   2.308  -9.836   0.599
  417    HA   GLU  52           HA       GLU  52   4.471 -11.367   1.534
  418   1HB   GLU  52          2HB       GLU  52   4.301  -8.561   0.444
  419   2HB   GLU  52          1HB       GLU  52   5.831  -9.295   0.905
  420   1HG   GLU  52          2HG       GLU  52   5.451 -11.091  -0.708
  421   2HG   GLU  52          1HG       GLU  52   3.923 -10.350  -1.172
  422    H    LEU  53           H        LEU  53   3.002  -8.394   2.779
  423    HA   LEU  53           HA       LEU  53   4.806  -8.061   4.937
  424   1HB   LEU  53          2HB       LEU  53   3.373  -6.256   4.109
  425   2HB   LEU  53          1HB       LEU  53   1.947  -7.137   4.623
  426    HG   LEU  53           HG       LEU  53   2.734  -6.951   6.973
  427   1HD1  LEU  53          1HD1      LEU  53   4.807  -5.112   5.788
  428   2HD1  LEU  53          2HD1      LEU  53   5.120  -6.680   6.531
  429   3HD1  LEU  53          3HD1      LEU  53   4.495  -5.351   7.508
  430   1HD2  LEU  53          1HD2      LEU  53   1.099  -5.390   6.058
  431   2HD2  LEU  53          2HD2      LEU  53   2.406  -4.340   5.510
  432   3HD2  LEU  53          3HD2      LEU  53   2.151  -4.603   7.235
  433    H    GLN  54           H        GLN  54   1.848  -9.895   4.505
  434    HA   GLN  54           HA       GLN  54   1.474 -10.523   7.265
  435   1HB   GLN  54          2HB       GLN  54  -0.002 -10.830   4.915
  436   2HB   GLN  54          1HB       GLN  54   0.334 -12.474   5.445
  437   1HG   GLN  54          2HG       GLN  54  -1.771 -11.716   6.346
  438   2HG   GLN  54          1HG       GLN  54  -0.600 -11.953   7.643
  439   1HE2  GLN  54          1HE2      GLN  54  -0.590  -9.193   5.480
  440   2HE2  GLN  54          2HE2      GLN  54  -1.036  -8.023   6.674
  441    H    LYS  55           H        LYS  55   3.324 -11.857   4.669
  442    HA   LYS  55           HA       LYS  55   3.957 -14.335   5.977
  443   1HB   LYS  55          2HB       LYS  55   4.009 -14.010   3.509
  444   2HB   LYS  55          1HB       LYS  55   5.383 -12.934   3.713
  445   1HG   LYS  55          2HG       LYS  55   6.522 -14.921   4.859
  446   2HG   LYS  55          1HG       LYS  55   5.237 -15.892   4.138
  447   1HD   LYS  55          2HD       LYS  55   5.861 -15.129   1.925
  448   2HD   LYS  55          1HD       LYS  55   7.091 -14.071   2.617
  449   1HE   LYS  55          2HE       LYS  55   8.209 -16.090   3.555
  450   2HE   LYS  55          1HE       LYS  55   7.039 -17.086   2.690
  451   1HZ   LYS  55          1HZ       LYS  55   7.829 -16.086   0.609
  452   2HZ   LYS  55          2HZ       LYS  55   9.062 -16.910   1.428
  453   3HZ   LYS  55          3HZ       LYS  55   9.003 -15.214   1.472
  454    H    ASN  56           H        ASN  56   4.757 -11.224   6.587
  455    HA   ASN  56           HA       ASN  56   6.285 -10.134   7.850
  456   1HB   ASN  56          2HB       ASN  56   6.233 -12.123   9.355
  457   2HB   ASN  56          1HB       ASN  56   7.545 -12.829   8.415
  458   1HD2  ASN  56          1HD2      ASN  56   8.985 -12.858  10.121
  459   2HD2  ASN  56          2HD2      ASN  56   9.687 -11.417  10.772
  460    HA   PRO  57           HA       PRO  57   8.969  -9.617   4.317
  461   1HB   PRO  57          2HB       PRO  57   9.815  -7.250   5.885
  462   2HB   PRO  57          1HB       PRO  57   9.209  -7.345   4.229
  463   1HG   PRO  57          2HG       PRO  57   7.685  -6.380   6.193
  464   2HG   PRO  57          1HG       PRO  57   6.994  -7.375   4.898
  465   1HD   PRO  57          2HD       PRO  57   7.678  -8.130   7.713
  466   2HD   PRO  57          1HD       PRO  57   6.279  -8.603   6.727
  467    HA   PRO  58           HA       PRO  58  12.831 -11.193   5.884
  468   1HB   PRO  58          2HB       PRO  58  14.348 -10.722   3.687
  469   2HB   PRO  58          1HB       PRO  58  13.173 -12.038   3.777
  470   1HG   PRO  58          2HG       PRO  58  12.894  -9.339   2.510
  471   2HG   PRO  58          1HG       PRO  58  12.391 -10.924   1.892
  472   1HD   PRO  58          2HD       PRO  58  10.652  -9.203   3.036
  473   2HD   PRO  58          1HD       PRO  58  10.484 -10.964   3.183
  474    H    TYR  59           H        TYR  59  15.226 -10.443   5.735
  475    HA   TYR  59           HA       TYR  59  15.469  -8.045   7.167
  476   1HB   TYR  59          2HB       TYR  59  17.123  -9.860   7.291
  477   2HB   TYR  59          1HB       TYR  59  17.609  -9.534   5.629
  478    HD1  TYR  59           HD1      TYR  59  19.209  -7.869   5.144
  479    HD2  TYR  59           HD2      TYR  59  17.505  -8.066   9.036
  480    HE1  TYR  59           HE1      TYR  59  20.841  -6.212   5.935
  481    HE2  TYR  59           HE2      TYR  59  19.136  -6.410   9.841
  482    HH   TYR  59           HH       TYR  59  20.919  -4.482   7.815
  483    H    GLU  60           H        GLU  60  15.327  -6.029   6.510
  484    HA   GLU  60           HA       GLU  60  15.093  -5.243   3.820
  485   1HB   GLU  60          2HB       GLU  60  14.073  -3.999   5.661
  486   2HB   GLU  60          1HB       GLU  60  15.663  -3.595   6.288
  487   1HG   GLU  60          2HG       GLU  60  16.127  -2.325   4.237
  488   2HG   GLU  60          1HG       GLU  60  14.498  -2.689   3.666
  Start of MODEL   10
    1   1H    MET   1          1H        MET   1  -8.399  -4.703   7.801
    2   2H    MET   1          2H        MET   1  -8.799  -6.113   6.953
    3   3H    MET   1          3H        MET   1  -9.456  -4.626   6.478
    4    HA   MET   1           HA       MET   1  -6.594  -5.377   6.361
    5   1HB   MET   1          2HB       MET   1  -8.118  -6.464   4.677
    6   2HB   MET   1          1HB       MET   1  -8.552  -4.860   4.109
    7   1HG   MET   1          2HG       MET   1  -5.711  -5.819   4.129
    8   2HG   MET   1          1HG       MET   1  -6.804  -6.162   2.792
    9   1HE   MET   1          1HE       MET   1  -5.225  -5.030   1.048
   10   2HE   MET   1          2HE       MET   1  -4.047  -4.705   2.321
   11   3HE   MET   1          3HE       MET   1  -4.549  -3.413   1.228
   12    H    ILE   2           H        ILE   2  -5.288  -3.675   6.506
   13    HA   ILE   2           HA       ILE   2  -6.473  -1.010   6.151
   14    HB   ILE   2           HB       ILE   2  -3.937  -1.689   7.656
   15   1HG1  ILE   2          2HG1      ILE   2  -5.510  -0.934   9.634
   16   2HG1  ILE   2          1HG1      ILE   2  -6.787  -1.479   8.554
   17   1HG2  ILE   2          1HG2      ILE   2  -4.179   0.583   8.563
   18   2HG2  ILE   2          2HG2      ILE   2  -5.569   0.839   7.509
   19   3HG2  ILE   2          3HG2      ILE   2  -3.971   0.576   6.812
   20   1HD1  ILE   2          1HD1      ILE   2  -6.132  -3.211  10.135
   21   2HD1  ILE   2          2HD1      ILE   2  -4.481  -3.152   9.517
   22   3HD1  ILE   2          3HD1      ILE   2  -5.795  -3.694   8.473
   23    H    LEU   3           H        LEU   3  -5.864   0.153   4.462
   24    HA   LEU   3           HA       LEU   3  -3.999  -0.758   2.543
   25   1HB   LEU   3          2HB       LEU   3  -5.950   1.272   2.796
   26   2HB   LEU   3          1HB       LEU   3  -4.455   2.067   2.358
   27    HG   LEU   3           HG       LEU   3  -5.734   1.575   0.375
   28   1HD1  LEU   3          1HD1      LEU   3  -3.288   1.422   0.234
   29   2HD1  LEU   3          2HD1      LEU   3  -4.089   0.339  -0.902
   30   3HD1  LEU   3          3HD1      LEU   3  -3.385  -0.305   0.581
   31   1HD2  LEU   3          1HD2      LEU   3  -5.626  -1.303   1.267
   32   2HD2  LEU   3          2HD2      LEU   3  -6.247  -0.729  -0.280
   33   3HD2  LEU   3          3HD2      LEU   3  -7.060  -0.278   1.219
   34    H    TYR   4           H        TYR   4  -3.811   1.426   5.234
   35    HA   TYR   4           HA       TYR   4  -1.532   2.887   4.716
   36   1HB   TYR   4          2HB       TYR   4  -2.974   3.315   6.624
   37   2HB   TYR   4          1HB       TYR   4  -2.525   1.777   7.346
   38    HD1  TYR   4           HD1      TYR   4  -0.983   4.980   6.197
   39    HD2  TYR   4           HD2      TYR   4  -0.862   1.736   8.947
   40    HE1  TYR   4           HE1      TYR   4   0.813   6.109   7.441
   41    HE2  TYR   4           HE2      TYR   4   0.940   2.852  10.190
   42    HH   TYR   4           HH       TYR   4   1.812   6.129   9.621
   43    H    ASP   5           H        ASP   5  -1.756  -0.301   6.283
   44    HA   ASP   5           HA       ASP   5   0.972  -0.683   6.746
   45   1HB   ASP   5          2HB       ASP   5  -1.334  -2.563   6.362
   46   2HB   ASP   5          1HB       ASP   5   0.294  -3.177   6.592
   47    H    ALA   6           H        ALA   6  -1.027  -1.669   3.991
   48    HA   ALA   6           HA       ALA   6   0.982  -2.999   2.552
   49   1HB   ALA   6          1HB       ALA   6  -0.506  -2.797   0.624
   50   2HB   ALA   6          2HB       ALA   6  -1.481  -1.613   1.497
   51   3HB   ALA   6          3HB       ALA   6  -1.391  -3.277   2.073
   52    H    ILE   7           H        ILE   7  -0.122   0.367   2.462
   53    HA   ILE   7           HA       ILE   7   1.502   1.209   0.318
   54    HB   ILE   7           HB       ILE   7   0.468   2.857   2.632
   55   1HG1  ILE   7          2HG1      ILE   7  -0.656   2.482  -0.143
   56   2HG1  ILE   7          1HG1      ILE   7  -1.253   1.652   1.290
   57   1HG2  ILE   7          1HG2      ILE   7   1.491   3.707  -0.078
   58   2HG2  ILE   7          2HG2      ILE   7   2.286   3.995   1.471
   59   3HG2  ILE   7          3HG2      ILE   7   0.741   4.769   1.112
   60   1HD1  ILE   7          1HD1      ILE   7  -1.287   4.621   0.795
   61   2HD1  ILE   7          2HD1      ILE   7  -1.834   3.828   2.273
   62   3HD1  ILE   7          3HD1      ILE   7  -2.668   3.526   0.748
   63    H    MET   8           H        MET   8   2.071   1.186   3.813
   64    HA   MET   8           HA       MET   8   4.564   2.528   3.680
   65   1HB   MET   8          2HB       MET   8   3.375   0.741   5.797
   66   2HB   MET   8          1HB       MET   8   4.905   1.581   5.988
   67   1HG   MET   8          2HG       MET   8   2.261   2.933   5.497
   68   2HG   MET   8          1HG       MET   8   2.995   2.703   7.079
   69   1HE   MET   8          1HE       MET   8   2.572   4.964   4.105
   70   2HE   MET   8          2HE       MET   8   4.001   4.166   3.448
   71   3HE   MET   8          3HE       MET   8   4.084   5.854   3.948
   72    H    TYR   9           H        TYR   9   3.633  -0.754   3.145
   73    HA   TYR   9           HA       TYR   9   6.315  -1.787   3.393
   74   1HB   TYR   9          2HB       TYR   9   4.401  -3.249   3.852
   75   2HB   TYR   9          1HB       TYR   9   3.822  -3.035   2.204
   76    HD1  TYR   9           HD1      TYR   9   6.622  -4.422   4.209
   77    HD2  TYR   9           HD2      TYR   9   4.607  -4.404   0.463
   78    HE1  TYR   9           HE1      TYR   9   7.950  -6.365   3.491
   79    HE2  TYR   9           HE2      TYR   9   5.932  -6.341  -0.265
   80    HH   TYR   9           HH       TYR   9   7.998  -7.456   0.225
   81    H    LYS  10           H        LYS  10   4.184  -0.692   0.820
   82    HA   LYS  10           HA       LYS  10   5.969  -1.596  -1.258
   83   1HB   LYS  10          2HB       LYS  10   3.463  -1.554  -1.469
   84   2HB   LYS  10          1HB       LYS  10   3.561   0.201  -1.532
   85   1HG   LYS  10          2HG       LYS  10   3.373  -0.742  -3.757
   86   2HG   LYS  10          1HG       LYS  10   4.930   0.063  -3.540
   87   1HD   LYS  10          2HD       LYS  10   5.989  -2.101  -3.124
   88   2HD   LYS  10          1HD       LYS  10   4.433  -2.903  -3.337
   89   1HE   LYS  10          2HE       LYS  10   4.330  -2.077  -5.644
   90   2HE   LYS  10          1HE       LYS  10   5.900  -1.301  -5.429
   91   1HZ   LYS  10          1HZ       LYS  10   5.401  -4.222  -5.185
   92   2HZ   LYS  10          2HZ       LYS  10   6.903  -3.447  -5.081
   93   3HZ   LYS  10          3HZ       LYS  10   6.057  -3.458  -6.553
   94    H    TYR  11           H        TYR  11   4.863   1.559  -0.060
   95    HA   TYR  11           HA       TYR  11   7.330   2.738  -1.128
   96   1HB   TYR  11          2HB       TYR  11   4.512   3.683  -1.552
   97   2HB   TYR  11          1HB       TYR  11   5.843   4.833  -1.554
   98    HD1  TYR  11           HD1      TYR  11   4.104   2.255  -3.428
   99    HD2  TYR  11           HD2      TYR  11   7.627   4.640  -3.273
  100    HE1  TYR  11           HE1      TYR  11   4.542   1.754  -5.799
  101    HE2  TYR  11           HE2      TYR  11   8.077   4.144  -5.638
  102    HH   TYR  11           HH       TYR  11   5.777   2.733  -7.703
  103    HA   PRO  12           HA       PRO  12   7.040   4.031   3.288
  104   1HB   PRO  12          2HB       PRO  12   9.966   3.950   2.980
  105   2HB   PRO  12          1HB       PRO  12   8.944   3.181   4.189
  106   1HG   PRO  12          2HG       PRO  12  10.179   1.750   2.287
  107   2HG   PRO  12          1HG       PRO  12   8.568   1.309   2.887
  108   1HD   PRO  12          2HD       PRO  12   9.325   2.747   0.366
  109   2HD   PRO  12          1HD       PRO  12   8.112   1.470   0.614
  110    H    ASN  13           H        ASN  13   8.375   5.108   0.395
  111    HA   ASN  13           HA       ASN  13   9.518   7.580   1.247
  112   1HB   ASN  13          2HB       ASN  13  10.245   6.359  -0.780
  113   2HB   ASN  13          1HB       ASN  13   8.681   6.685  -1.500
  114   1HD2  ASN  13          1HD2      ASN  13  11.696   8.054  -0.473
  115   2HD2  ASN  13          2HD2      ASN  13  11.560   9.530  -1.365
  116    H    ALA  14           H        ALA  14   6.356   6.501   0.759
  117    HA   ALA  14           HA       ALA  14   5.281   9.102   0.040
  118   1HB   ALA  14          1HB       ALA  14   3.106   7.965   0.040
  119   2HB   ALA  14          2HB       ALA  14   3.876   6.497   0.643
  120   3HB   ALA  14          3HB       ALA  14   4.283   7.110  -0.959
  121    H    VAL  15           H        VAL  15   4.217  10.470   1.394
  122    HA   VAL  15           HA       VAL  15   4.467   9.852   4.254
  123    HB   VAL  15           HB       VAL  15   3.929  12.521   2.936
  124   1HG1  VAL  15          1HG1      VAL  15   4.685  11.863   5.781
  125   2HG1  VAL  15          2HG1      VAL  15   3.086  12.370   5.234
  126   3HG1  VAL  15          3HG1      VAL  15   4.454  13.478   5.111
  127   1HG2  VAL  15          1HG2      VAL  15   6.142  11.685   2.354
  128   2HG2  VAL  15          2HG2      VAL  15   6.491  11.389   4.057
  129   3HG2  VAL  15          3HG2      VAL  15   6.271  13.040   3.476
  130    H    SER  16           H        SER  16   2.768   9.516   5.495
  131    HA   SER  16           HA       SER  16   0.188   9.133   4.453
  132   1HB   SER  16          2HB       SER  16   0.941   9.537   7.353
  133   2HB   SER  16          1HB       SER  16  -0.470   8.685   6.731
  134    HG   SER  16           HG       SER  16   2.254   7.930   6.367
  135    H    ARG  17           H        ARG  17  -1.561  10.375   4.306
  136    HA   ARG  17           HA       ARG  17  -2.967  12.134   4.366
  137   1HB   ARG  17          2HB       ARG  17  -1.254  12.934   6.704
  138   2HB   ARG  17          1HB       ARG  17  -2.618  13.903   6.160
  139   1HG   ARG  17          2HG       ARG  17  -4.130  12.052   6.572
  140   2HG   ARG  17          1HG       ARG  17  -2.774  11.023   7.030
  141   1HD   ARG  17          2HD       ARG  17  -3.545  13.567   8.455
  142   2HD   ARG  17          1HD       ARG  17  -4.040  11.950   8.957
  143    HE   ARG  17           HE       ARG  17  -1.220  12.107   8.684
  144   1HH1  ARG  17          1HH1      ARG  17  -3.850  13.046  10.783
  145   2HH1  ARG  17          2HH1      ARG  17  -2.878  13.034  12.223
  146   1HH2  ARG  17          1HH2      ARG  17   0.081  12.106  10.551
  147   2HH2  ARG  17          2HH2      ARG  17  -0.624  12.543  12.082
  148    H    LYS  18           H        LYS  18   0.085  12.224   3.382
  149    HA   LYS  18           HA       LYS  18  -0.167  14.950   2.310
  150   1HB   LYS  18          2HB       LYS  18   1.925  14.701   3.455
  151   2HB   LYS  18          1HB       LYS  18   2.251  13.170   2.655
  152   1HG   LYS  18          2HG       LYS  18   2.404  14.381   0.497
  153   2HG   LYS  18          1HG       LYS  18   2.199  15.897   1.375
  154   1HD   LYS  18          2HD       LYS  18   4.240  15.545   2.581
  155   2HD   LYS  18          1HD       LYS  18   4.409  13.921   1.915
  156   1HE   LYS  18          2HE       LYS  18   4.428  16.464   0.297
  157   2HE   LYS  18          1HE       LYS  18   5.869  15.591   0.814
  158   1HZ   LYS  18          1HZ       LYS  18   5.105  13.671  -0.463
  159   2HZ   LYS  18          2HZ       LYS  18   5.284  15.030  -1.453
  160   3HZ   LYS  18          3HZ       LYS  18   3.742  14.529  -0.974
  161    H    ASP  19           H        ASP  19   1.178  11.813   1.330
  162    HA   ASP  19           HA       ASP  19   0.572  12.412  -1.452
  163   1HB   ASP  19          2HB       ASP  19   2.005  10.057  -0.204
  164   2HB   ASP  19          1HB       ASP  19   1.870  10.364  -1.933
  165    H    PHE  20           H        PHE  20  -0.721  10.699   1.168
  166    HA   PHE  20           HA       PHE  20  -2.961   9.860  -0.440
  167   1HB   PHE  20          2HB       PHE  20  -2.918   7.519   0.380
  168   2HB   PHE  20          1HB       PHE  20  -1.542   7.891  -0.648
  169    HD1  PHE  20           HD1      PHE  20  -2.638   6.884   2.648
  170    HD2  PHE  20           HD2      PHE  20   0.697   8.186   0.353
  171    HE1  PHE  20           HE1      PHE  20  -1.121   6.071   4.403
  172    HE2  PHE  20           HE2      PHE  20   2.222   7.371   2.103
  173    HZ   PHE  20           HZ       PHE  20   1.312   6.314   4.131
  174    H    GLU  21           H        GLU  21  -4.786  10.158   0.666
  175    HA   GLU  21           HA       GLU  21  -4.560  10.506   3.586
  176   1HB   GLU  21          2HB       GLU  21  -5.277  12.505   2.297
  177   2HB   GLU  21          1HB       GLU  21  -6.671  11.608   1.722
  178   1HG   GLU  21          2HG       GLU  21  -7.550  11.456   3.961
  179   2HG   GLU  21          1HG       GLU  21  -6.099  12.221   4.613
  180    H    LEU  22           H        LEU  22  -5.637   9.142   4.868
  181    HA   LEU  22           HA       LEU  22  -6.943   6.917   3.521
  182   1HB   LEU  22          2HB       LEU  22  -6.220   7.167   6.432
  183   2HB   LEU  22          1HB       LEU  22  -6.668   5.705   5.582
  184    HG   LEU  22           HG       LEU  22  -4.153   7.294   5.062
  185   1HD1  LEU  22          1HD1      LEU  22  -4.103   6.260   7.255
  186   2HD1  LEU  22          2HD1      LEU  22  -3.012   5.420   6.152
  187   3HD1  LEU  22          3HD1      LEU  22  -4.576   4.711   6.557
  188   1HD2  LEU  22          1HD2      LEU  22  -5.067   4.609   4.032
  189   2HD2  LEU  22          2HD2      LEU  22  -3.481   5.331   3.758
  190   3HD2  LEU  22          3HD2      LEU  22  -4.924   6.094   3.093
  191    H    ARG  23           H        ARG  23  -8.903   6.075   4.115
  192    HA   ARG  23           HA       ARG  23 -10.611   7.620   5.923
  193   1HB   ARG  23          2HB       ARG  23 -10.977   8.298   3.480
  194   2HB   ARG  23          1HB       ARG  23 -11.590   6.670   3.226
  195   1HG   ARG  23          2HG       ARG  23 -13.466   8.072   3.564
  196   2HG   ARG  23          1HG       ARG  23 -13.266   7.122   5.037
  197   1HD   ARG  23          2HD       ARG  23 -13.717   9.360   5.701
  198   2HD   ARG  23          1HD       ARG  23 -12.006   9.058   6.005
  199    HE   ARG  23           HE       ARG  23 -12.644  10.294   3.450
  200   1HH1  ARG  23          1HH1      ARG  23 -11.573  10.740   6.769
  201   2HH1  ARG  23          2HH1      ARG  23 -10.997  12.354   6.493
  202   1HH2  ARG  23          1HH2      ARG  23 -11.862  12.402   3.091
  203   2HH2  ARG  23          2HH2      ARG  23 -11.146  13.299   4.406
  204    H    ASN  24           H        ASN  24 -12.415   6.303   6.746
  205    HA   ASN  24           HA       ASN  24 -11.635   3.511   6.872
  206   1HB   ASN  24          2HB       ASN  24 -12.246   4.668   8.945
  207   2HB   ASN  24          1HB       ASN  24 -13.855   4.982   8.300
  208   1HD2  ASN  24          1HD2      ASN  24 -14.820   3.884   9.987
  209   2HD2  ASN  24          2HD2      ASN  24 -14.800   2.160  10.095
  210    H    ASP  25           H        ASP  25 -12.444   1.990   5.658
  211    HA   ASP  25           HA       ASP  25 -14.778   2.490   3.985
  212   1HB   ASP  25          2HB       ASP  25 -13.028   1.441   2.800
  213   2HB   ASP  25          1HB       ASP  25 -12.681   0.334   4.125
  214    H    GLY  26           H        GLY  26 -13.835   0.710   6.796
  215   1HA   GLY  26          2HA       GLY  26 -15.643  -0.160   8.239
  216   2HA   GLY  26          1HA       GLY  26 -16.403  -0.750   6.762
  217    H    ASN  27           H        ASN  27 -14.286  -1.799   5.395
  218    HA   ASN  27           HA       ASN  27 -13.634  -4.167   6.898
  219   1HB   ASN  27          2HB       ASN  27 -14.095  -4.248   4.455
  220   2HB   ASN  27          1HB       ASN  27 -12.652  -3.279   4.174
  221   1HD2  ASN  27          1HD2      ASN  27 -13.904  -6.393   4.984
  222   2HD2  ASN  27          2HD2      ASN  27 -12.413  -7.257   4.835
  223    H    GLY  28           H        GLY  28 -12.288  -1.138   6.326
  224   1HA   GLY  28          2HA       GLY  28 -10.319  -1.155   8.199
  225   2HA   GLY  28          1HA       GLY  28  -9.532  -1.801   6.762
  226    H    SER  29           H        SER  29  -8.273   0.288   7.284
  227    HA   SER  29           HA       SER  29  -9.554   2.708   6.314
  228   1HB   SER  29          2HB       SER  29  -6.621   2.423   6.940
  229   2HB   SER  29          1HB       SER  29  -7.658   3.841   7.111
  230    HG   SER  29           HG       SER  29  -8.529   3.013   8.939
  231    H    TYR  30           H        TYR  30  -9.560   3.240   4.194
  232    HA   TYR  30           HA       TYR  30  -7.456   2.066   2.490
  233   1HB   TYR  30          2HB       TYR  30  -8.986   1.861   0.686
  234   2HB   TYR  30          1HB       TYR  30  -9.800   1.195   2.091
  235    HD1  TYR  30           HD1      TYR  30 -11.346   2.946   3.380
  236    HD2  TYR  30           HD2      TYR  30 -10.143   3.289  -0.682
  237    HE1  TYR  30           HE1      TYR  30 -13.276   4.404   2.938
  238    HE2  TYR  30           HE2      TYR  30 -12.063   4.754  -1.136
  239    HH   TYR  30           HH       TYR  30 -14.274   5.216  -0.224
  240    H    ILE  31           H        ILE  31  -7.616   3.449   0.230
  241    HA   ILE  31           HA       ILE  31  -6.708   6.088   1.086
  242    HB   ILE  31           HB       ILE  31  -6.582   4.924  -1.699
  243   1HG1  ILE  31          2HG1      ILE  31  -4.457   4.823   0.452
  244   2HG1  ILE  31          1HG1      ILE  31  -5.435   3.449  -0.057
  245   1HG2  ILE  31          1HG2      ILE  31  -6.280   7.336  -1.558
  246   2HG2  ILE  31          2HG2      ILE  31  -4.762   6.545  -1.982
  247   3HG2  ILE  31          3HG2      ILE  31  -5.023   7.122  -0.336
  248   1HD1  ILE  31          1HD1      ILE  31  -3.525   4.986  -1.808
  249   2HD1  ILE  31          2HD1      ILE  31  -4.474   3.577  -2.286
  250   3HD1  ILE  31          3HD1      ILE  31  -3.213   3.419  -1.064
  251    H    GLU  32           H        GLU  32  -8.050   7.789   0.980
  252    HA   GLU  32           HA       GLU  32 -10.240   7.742  -0.976
  253   1HB   GLU  32          2HB       GLU  32 -10.795   8.330   1.375
  254   2HB   GLU  32          1HB       GLU  32  -9.716   9.715   1.264
  255   1HG   GLU  32          2HG       GLU  32 -11.105  10.643  -0.530
  256   2HG   GLU  32          1HG       GLU  32 -12.191   9.264  -0.388
  257    H    LYS  33           H        LYS  33  -7.697   9.936   0.196
  258    HA   LYS  33           HA       LYS  33  -7.789  11.389  -2.329
  259   1HB   LYS  33          2HB       LYS  33  -7.628  12.549  -0.065
  260   2HB   LYS  33          1HB       LYS  33  -5.985  11.929   0.030
  261   1HG   LYS  33          2HG       LYS  33  -5.724  14.077  -0.772
  262   2HG   LYS  33          1HG       LYS  33  -5.631  13.082  -2.218
  263   1HD   LYS  33          2HD       LYS  33  -7.011  15.069  -2.550
  264   2HD   LYS  33          1HD       LYS  33  -7.927  13.579  -2.741
  265   1HE   LYS  33          2HE       LYS  33  -9.107  15.332  -1.447
  266   2HE   LYS  33          1HE       LYS  33  -8.905  13.817  -0.575
  267   1HZ   LYS  33          1HZ       LYS  33  -6.909  14.856   0.478
  268   2HZ   LYS  33          2HZ       LYS  33  -8.383  15.561   0.910
  269   3HZ   LYS  33          3HZ       LYS  33  -7.371  16.334  -0.210
  270    H    TRP  34           H        TRP  34  -6.750  10.166  -3.863
  271    HA   TRP  34           HA       TRP  34  -4.044   9.253  -3.318
  272   1HB   TRP  34          2HB       TRP  34  -5.584   8.003  -4.866
  273   2HB   TRP  34          1HB       TRP  34  -5.537   9.384  -5.955
  274    HD1  TRP  34           HD1      TRP  34  -3.897   9.070  -7.873
  275    HE1  TRP  34           HE1      TRP  34  -1.722   7.751  -8.272
  276    HE3  TRP  34           HE3      TRP  34  -3.316   7.062  -3.208
  277    HZ2  TRP  34           HZ2      TRP  34   0.016   6.090  -6.791
  278    HZ3  TRP  34           HZ3      TRP  34  -1.367   5.623  -2.779
  279    HH2  TRP  34           HH2      TRP  34   0.266   5.147  -4.534
  280    H    ASN  35           H        ASN  35  -2.511  10.769  -3.204
  281    HA   ASN  35           HA       ASN  35  -3.027  13.301  -4.600
  282   1HB   ASN  35          2HB       ASN  35  -2.734  12.973  -1.963
  283   2HB   ASN  35          1HB       ASN  35  -1.040  13.141  -2.392
  284   1HD2  ASN  35          1HD2      ASN  35  -0.269  15.075  -2.892
  285   2HD2  ASN  35          2HD2      ASN  35  -1.184  16.538  -2.867
  286    H    LEU  36           H        LEU  36  -1.227  10.597  -4.806
  287    HA   LEU  36           HA       LEU  36   1.173  11.830  -5.869
  288   1HB   LEU  36          2HB       LEU  36   0.254   8.970  -5.618
  289   2HB   LEU  36          1HB       LEU  36   1.714   9.416  -6.474
  290    HG   LEU  36           HG       LEU  36   1.202   9.997  -3.565
  291   1HD1  LEU  36          1HD1      LEU  36   2.819   8.221  -3.122
  292   2HD1  LEU  36          2HD1      LEU  36   2.909   7.872  -4.848
  293   3HD1  LEU  36          3HD1      LEU  36   1.403   7.597  -3.972
  294   1HD2  LEU  36          1HD2      LEU  36   3.594  10.530  -3.522
  295   2HD2  LEU  36          2HD2      LEU  36   2.710  11.592  -4.620
  296   3HD2  LEU  36          3HD2      LEU  36   3.677  10.264  -5.265
  297    H    ARG  37           H        ARG  37   1.777  11.751  -8.034
  298    HA   ARG  37           HA       ARG  37  -0.472  11.647  -9.887
  299   1HB   ARG  37          2HB       ARG  37   2.369  12.633 -10.231
  300   2HB   ARG  37          1HB       ARG  37   1.104  12.753 -11.450
  301   1HG   ARG  37          2HG       ARG  37  -0.148  14.275 -10.144
  302   2HG   ARG  37          1HG       ARG  37   0.836  13.960  -8.714
  303   1HD   ARG  37          2HD       ARG  37   1.416  16.097  -9.700
  304   2HD   ARG  37          1HD       ARG  37   2.765  14.970  -9.815
  305    HE   ARG  37           HE       ARG  37   1.138  14.958 -12.166
  306   1HH1  ARG  37          1HH1      ARG  37   3.682  16.676 -10.477
  307   2HH1  ARG  37          2HH1      ARG  37   4.333  17.398 -11.921
  308   1HH2  ARG  37          1HH2      ARG  37   2.012  15.853 -14.075
  309   2HH2  ARG  37          2HH2      ARG  37   3.390  16.916 -13.980
  310    H    ALA  38           H        ALA  38   0.392   9.262  -8.828
  311    HA   ALA  38           HA       ALA  38   1.798   7.930 -11.043
  312   1HB   ALA  38          1HB       ALA  38   2.995   7.786  -8.914
  313   2HB   ALA  38          2HB       ALA  38   2.412   6.196  -9.407
  314   3HB   ALA  38          3HB       ALA  38   1.567   7.095  -8.147
  315    HA   PRO  39           HA       PRO  39  -1.793   5.484 -11.936
  316   1HB   PRO  39          2HB       PRO  39  -0.767   2.953 -12.156
  317   2HB   PRO  39          1HB       PRO  39  -0.620   4.190 -13.408
  318   1HG   PRO  39          2HG       PRO  39   1.362   3.351 -11.329
  319   2HG   PRO  39          1HG       PRO  39   1.627   3.724 -13.043
  320   1HD   PRO  39          2HD       PRO  39   2.212   5.494 -11.108
  321   2HD   PRO  39          1HD       PRO  39   1.576   6.007 -12.684
  322    H    LEU  40           H        LEU  40  -3.349   4.186 -10.985
  323    HA   LEU  40           HA       LEU  40  -3.029   3.711  -8.164
  324   1HB   LEU  40          2HB       LEU  40  -5.277   3.632 -10.118
  325   2HB   LEU  40          1HB       LEU  40  -5.446   2.726  -8.634
  326    HG   LEU  40           HG       LEU  40  -6.515   4.877  -8.411
  327   1HD1  LEU  40          1HD1      LEU  40  -5.512   3.985  -6.414
  328   2HD1  LEU  40          2HD1      LEU  40  -5.318   5.738  -6.432
  329   3HD1  LEU  40          3HD1      LEU  40  -3.954   4.696  -6.837
  330   1HD2  LEU  40          1HD2      LEU  40  -3.825   6.060  -9.065
  331   2HD2  LEU  40          2HD2      LEU  40  -5.237   6.964  -8.517
  332   3HD2  LEU  40          3HD2      LEU  40  -5.272   6.127 -10.070
  333    HA   PRO  41           HA       PRO  41  -2.053  -0.652  -8.595
  334   1HB   PRO  41          2HB       PRO  41  -2.508  -1.309  -5.996
  335   2HB   PRO  41          1HB       PRO  41  -1.023  -0.521  -6.544
  336   1HG   PRO  41          2HG       PRO  41  -3.449   0.688  -5.266
  337   2HG   PRO  41          1HG       PRO  41  -1.736   1.014  -4.943
  338   1HD   PRO  41          2HD       PRO  41  -3.238   2.650  -6.470
  339   2HD   PRO  41          1HD       PRO  41  -1.515   2.371  -6.793
  340    H    THR  42           H        THR  42  -3.212  -2.696  -8.205
  341    HA   THR  42           HA       THR  42  -6.095  -2.277  -8.533
  342    HB   THR  42           HB       THR  42  -6.168  -4.570  -9.373
  343    HG1  THR  42           HG1      THR  42  -3.734  -5.340  -9.680
  344   1HG2  THR  42          1HG2      THR  42  -3.901  -2.979 -10.583
  345   2HG2  THR  42          2HG2      THR  42  -5.614  -2.808 -10.969
  346   3HG2  THR  42          3HG2      THR  42  -4.764  -4.299 -11.373
  347    H    GLN  43           H        GLN  43  -7.550  -3.943  -7.537
  348    HA   GLN  43           HA       GLN  43  -7.335  -4.163  -4.764
  349   1HB   GLN  43          2HB       GLN  43  -9.422  -4.498  -6.049
  350   2HB   GLN  43          1HB       GLN  43  -8.781  -5.997  -6.686
  351   1HG   GLN  43          2HG       GLN  43 -10.363  -6.403  -4.885
  352   2HG   GLN  43          1HG       GLN  43  -8.748  -6.971  -4.475
  353   1HE2  GLN  43          1HE2      GLN  43  -7.593  -5.946  -2.870
  354   2HE2  GLN  43          2HE2      GLN  43  -8.330  -4.852  -1.747
  355    H    ALA  44           H        ALA  44  -6.612  -6.473  -7.312
  356    HA   ALA  44           HA       ALA  44  -5.653  -8.597  -5.808
  357   1HB   ALA  44          1HB       ALA  44  -4.391  -9.244  -7.811
  358   2HB   ALA  44          2HB       ALA  44  -4.685  -7.645  -8.497
  359   3HB   ALA  44          3HB       ALA  44  -6.035  -8.737  -8.201
  360    H    GLU  45           H        GLU  45  -3.811  -5.848  -7.151
  361    HA   GLU  45           HA       GLU  45  -1.314  -6.550  -6.113
  362   1HB   GLU  45          2HB       GLU  45  -2.525  -3.927  -6.909
  363   2HB   GLU  45          1HB       GLU  45  -0.906  -3.999  -6.235
  364   1HG   GLU  45          2HG       GLU  45  -0.336  -5.645  -8.027
  365   2HG   GLU  45          1HG       GLU  45  -1.904  -5.292  -8.747
  366    H    LEU  46           H        LEU  46  -3.844  -4.487  -4.696
  367    HA   LEU  46           HA       LEU  46  -2.489  -3.703  -2.399
  368   1HB   LEU  46          2HB       LEU  46  -5.433  -4.269  -2.758
  369   2HB   LEU  46          1HB       LEU  46  -4.733  -3.369  -1.433
  370    HG   LEU  46           HG       LEU  46  -4.704  -2.553  -4.334
  371   1HD1  LEU  46          1HD1      LEU  46  -6.179  -0.746  -3.587
  372   2HD1  LEU  46          2HD1      LEU  46  -6.194  -1.435  -1.963
  373   3HD1  LEU  46          3HD1      LEU  46  -6.897  -2.333  -3.307
  374   1HD2  LEU  46          1HD2      LEU  46  -2.681  -1.807  -3.233
  375   2HD2  LEU  46          2HD2      LEU  46  -3.619  -1.157  -1.891
  376   3HD2  LEU  46          3HD2      LEU  46  -3.760  -0.436  -3.494
  377    H    GLU  47           H        GLU  47  -4.487  -6.578  -2.982
  378    HA   GLU  47           HA       GLU  47  -4.172  -7.557  -0.320
  379   1HB   GLU  47          2HB       GLU  47  -5.160  -8.935  -2.813
  380   2HB   GLU  47          1HB       GLU  47  -5.250  -9.607  -1.187
  381   1HG   GLU  47          2HG       GLU  47  -6.628  -7.706  -0.491
  382   2HG   GLU  47          1HG       GLU  47  -6.563  -7.071  -2.131
  383    H    THR  48           H        THR  48  -2.394  -7.848  -3.269
  384    HA   THR  48           HA       THR  48  -0.836 -10.115  -2.503
  385    HB   THR  48           HB       THR  48  -0.243  -7.957  -4.545
  386    HG1  THR  48           HG1      THR  48  -2.078  -9.150  -5.095
  387   1HG2  THR  48          1HG2      THR  48   1.360  -9.541  -5.498
  388   2HG2  THR  48          2HG2      THR  48   1.034 -10.674  -4.186
  389   3HG2  THR  48          3HG2      THR  48   1.802  -9.124  -3.842
  390    H    TRP  49           H        TRP  49  -0.379  -6.603  -2.322
  391    HA   TRP  49           HA       TRP  49   2.184  -6.698  -1.136
  392   1HB   TRP  49          2HB       TRP  49   0.062  -4.548  -0.923
  393   2HB   TRP  49          1HB       TRP  49   1.753  -4.358  -0.473
  394    HD1  TRP  49           HD1      TRP  49   2.400  -6.201  -3.330
  395    HE1  TRP  49           HE1      TRP  49   2.579  -4.799  -5.479
  396    HE3  TRP  49           HE3      TRP  49   0.086  -1.941  -1.715
  397    HZ2  TRP  49           HZ2      TRP  49   1.834  -2.225  -6.374
  398    HZ3  TRP  49           HZ3      TRP  49  -0.133  -0.057  -3.278
  399    HH2  TRP  49           HH2      TRP  49   0.725  -0.197  -5.556
  400    H    TRP  50           H        TRP  50  -1.065  -6.865   0.125
  401    HA   TRP  50           HA       TRP  50  -0.471  -6.727   2.874
  402   1HB   TRP  50          2HB       TRP  50  -2.747  -6.556   1.828
  403   2HB   TRP  50          1HB       TRP  50  -2.691  -8.285   1.527
  404    HD1  TRP  50           HD1      TRP  50  -3.593  -9.807   3.394
  405    HE1  TRP  50           HE1      TRP  50  -4.370  -9.450   5.823
  406    HE3  TRP  50           HE3      TRP  50  -2.140  -4.943   4.002
  407    HZ2  TRP  50           HZ2      TRP  50  -4.368  -7.380   7.740
  408    HZ3  TRP  50           HZ3      TRP  50  -2.566  -3.847   6.165
  409    HH2  TRP  50           HH2      TRP  50  -3.657  -5.041   7.994
  410    H    GLU  51           H        GLU  51  -0.473  -9.358   0.551
  411    HA   GLU  51           HA       GLU  51   0.126 -11.465   2.347
  412   1HB   GLU  51          2HB       GLU  51  -0.185 -11.082  -0.486
  413   2HB   GLU  51          1HB       GLU  51   1.203 -12.094  -0.140
  414   1HG   GLU  51          2HG       GLU  51  -1.386 -12.621   1.171
  415   2HG   GLU  51          1HG       GLU  51  -1.079 -13.179  -0.457
  416    H    GLU  52           H        GLU  52   2.183  -9.543   0.163
  417    HA   GLU  52           HA       GLU  52   4.611 -10.703   0.954
  418   1HB   GLU  52          2HB       GLU  52   4.007  -7.987  -0.199
  419   2HB   GLU  52          1HB       GLU  52   5.641  -8.590   0.056
  420   1HG   GLU  52          2HG       GLU  52   5.139 -10.489  -1.421
  421   2HG   GLU  52          1HG       GLU  52   3.545  -9.805  -1.718
  422    H    LEU  53           H        LEU  53   2.730  -8.072   2.281
  423    HA   LEU  53           HA       LEU  53   4.559  -7.058   4.135
  424   1HB   LEU  53          2HB       LEU  53   2.534  -5.877   3.699
  425   2HB   LEU  53          1HB       LEU  53   1.557  -7.249   4.179
  426    HG   LEU  53           HG       LEU  53   2.384  -6.956   6.519
  427   1HD1  LEU  53          1HD1      LEU  53   4.463  -5.776   6.014
  428   2HD1  LEU  53          2HD1      LEU  53   3.451  -4.840   7.115
  429   3HD1  LEU  53          3HD1      LEU  53   3.545  -4.397   5.410
  430   1HD2  LEU  53          1HD2      LEU  53   0.974  -5.026   6.984
  431   2HD2  LEU  53          2HD2      LEU  53   0.230  -6.079   5.780
  432   3HD2  LEU  53          3HD2      LEU  53   1.007  -4.578   5.278
  433    H    GLN  54           H        GLN  54   2.256  -9.753   4.407
  434    HA   GLN  54           HA       GLN  54   2.965 -10.235   7.141
  435   1HB   GLN  54          2HB       GLN  54   0.792 -10.889   5.727
  436   2HB   GLN  54          1HB       GLN  54   1.699 -12.388   5.555
  437   1HG   GLN  54          2HG       GLN  54   0.257 -12.580   7.450
  438   2HG   GLN  54          1HG       GLN  54   1.925 -12.487   8.016
  439   1HE2  GLN  54          1HE2      GLN  54   1.580 -11.635   9.997
  440   2HE2  GLN  54          2HE2      GLN  54   0.888 -10.076  10.287
  441    H    LYS  55           H        LYS  55   3.941 -11.477   4.019
  442    HA   LYS  55           HA       LYS  55   5.593 -13.548   5.068
  443   1HB   LYS  55          2HB       LYS  55   5.296 -12.259   2.400
  444   2HB   LYS  55          1HB       LYS  55   6.676 -13.303   2.704
  445   1HG   LYS  55          2HG       LYS  55   5.197 -15.148   3.240
  446   2HG   LYS  55          1HG       LYS  55   3.791 -14.102   3.033
  447   1HD   LYS  55          2HD       LYS  55   4.190 -13.875   0.712
  448   2HD   LYS  55          1HD       LYS  55   5.790 -14.603   0.840
  449   1HE   LYS  55          2HE       LYS  55   4.160 -16.155  -0.127
  450   2HE   LYS  55          1HE       LYS  55   4.793 -16.744   1.408
  451   1HZ   LYS  55          1HZ       LYS  55   2.399 -17.055   1.233
  452   2HZ   LYS  55          2HZ       LYS  55   2.171 -15.388   1.032
  453   3HZ   LYS  55          3HZ       LYS  55   2.776 -15.992   2.501
  454    H    ASN  56           H        ASN  56   5.944 -10.224   4.923
  455    HA   ASN  56           HA       ASN  56   8.673 -10.409   5.913
  456   1HB   ASN  56          2HB       ASN  56   8.928 -10.091   3.472
  457   2HB   ASN  56          1HB       ASN  56   7.953  -8.631   3.568
  458   1HD2  ASN  56          1HD2      ASN  56   9.543  -7.291   2.823
  459   2HD2  ASN  56          2HD2      ASN  56  10.954  -6.891   3.749
  460    HA   PRO  57           HA       PRO  57   5.905  -7.491   8.162
  461   1HB   PRO  57          2HB       PRO  57   6.716  -8.182  10.648
  462   2HB   PRO  57          1HB       PRO  57   5.518  -9.119   9.745
  463   1HG   PRO  57          2HG       PRO  57   8.448  -9.622  10.099
  464   2HG   PRO  57          1HG       PRO  57   7.098 -10.770  10.183
  465   1HD   PRO  57          2HD       PRO  57   8.673 -10.504   7.987
  466   2HD   PRO  57          1HD       PRO  57   6.962 -10.966   7.889
  467    HA   PRO  58           HA       PRO  58   8.647  -4.076   8.972
  468   1HB   PRO  58          2HB       PRO  58   7.269  -3.816  11.599
  469   2HB   PRO  58          1HB       PRO  58   7.525  -2.607  10.338
  470   1HG   PRO  58          2HG       PRO  58   5.131  -3.725  10.691
  471   2HG   PRO  58          1HG       PRO  58   5.740  -3.355   9.068
  472   1HD   PRO  58          2HD       PRO  58   5.546  -5.983  10.469
  473   2HD   PRO  58          1HD       PRO  58   5.327  -5.599   8.749
  474    H    TYR  59           H        TYR  59  10.494  -3.557  10.168
  475    HA   TYR  59           HA       TYR  59  11.808  -5.830  11.202
  476   1HB   TYR  59          2HB       TYR  59  12.817  -3.773  10.017
  477   2HB   TYR  59          1HB       TYR  59  12.803  -3.023  11.612
  478    HD1  TYR  59           HD1      TYR  59  14.261  -3.855  13.389
  479    HD2  TYR  59           HD2      TYR  59  14.316  -5.593   9.511
  480    HE1  TYR  59           HE1      TYR  59  16.367  -4.995  13.938
  481    HE2  TYR  59           HE2      TYR  59  16.422  -6.740  10.048
  482    HH   TYR  59           HH       TYR  59  17.566  -7.131  13.128
  483    H    GLU  60           H        GLU  60  11.868  -6.642  13.140
  484    HA   GLU  60           HA       GLU  60  10.629  -5.280  15.369
  485   1HB   GLU  60          2HB       GLU  60  11.149  -7.500  16.518
  486   2HB   GLU  60          1HB       GLU  60  10.018  -7.552  15.172
  487   1HG   GLU  60          2HG       GLU  60  11.638  -8.478  13.723
  488   2HG   GLU  60          1HG       GLU  60  12.945  -8.138  14.855
  Start of MODEL   11
    1   1H    MET   1          1H        MET   1  -9.556  -4.723   6.846
    2   2H    MET   1          2H        MET   1  -8.206  -4.769   7.865
    3   3H    MET   1          3H        MET   1  -8.751  -6.191   7.124
    4    HA   MET   1           HA       MET   1  -6.789  -5.391   6.018
    5   1HB   MET   1          2HB       MET   1  -8.794  -6.434   4.783
    6   2HB   MET   1          1HB       MET   1  -9.164  -4.806   4.241
    7   1HG   MET   1          2HG       MET   1  -6.532  -6.170   3.733
    8   2HG   MET   1          1HG       MET   1  -7.896  -6.224   2.620
    9   1HE   MET   1          1HE       MET   1  -6.611  -5.243   0.594
   10   2HE   MET   1          2HE       MET   1  -5.134  -5.288   1.559
   11   3HE   MET   1          3HE       MET   1  -5.570  -3.822   0.681
   12    H    ILE   2           H        ILE   2  -5.549  -3.628   6.128
   13    HA   ILE   2           HA       ILE   2  -6.837  -0.995   5.841
   14    HB   ILE   2           HB       ILE   2  -4.165  -1.552   7.154
   15   1HG1  ILE   2          2HG1      ILE   2  -5.607  -0.848   9.256
   16   2HG1  ILE   2          1HG1      ILE   2  -6.940  -1.475   8.291
   17   1HG2  ILE   2          1HG2      ILE   2  -4.489   0.724   8.082
   18   2HG2  ILE   2          2HG2      ILE   2  -5.921   0.892   7.064
   19   3HG2  ILE   2          3HG2      ILE   2  -4.334   0.690   6.326
   20   1HD1  ILE   2          1HD1      ILE   2  -6.102  -3.163   9.803
   21   2HD1  ILE   2          2HD1      ILE   2  -4.480  -2.996   9.131
   22   3HD1  ILE   2          3HD1      ILE   2  -5.789  -3.632   8.133
   23    H    LEU   3           H        LEU   3  -6.305   0.244   4.145
   24    HA   LEU   3           HA       LEU   3  -4.645  -0.697   2.081
   25   1HB   LEU   3          2HB       LEU   3  -6.413   1.501   2.598
   26   2HB   LEU   3          1HB       LEU   3  -4.962   2.080   1.817
   27    HG   LEU   3           HG       LEU   3  -6.676   1.602   0.176
   28   1HD1  LEU   3          1HD1      LEU   3  -5.422   0.058  -1.268
   29   2HD1  LEU   3          2HD1      LEU   3  -4.423  -0.396   0.114
   30   3HD1  LEU   3          3HD1      LEU   3  -4.379   1.257  -0.501
   31   1HD2  LEU   3          1HD2      LEU   3  -7.907  -0.086   1.450
   32   2HD2  LEU   3          2HD2      LEU   3  -6.583  -1.227   1.213
   33   3HD2  LEU   3          3HD2      LEU   3  -7.515  -0.655  -0.170
   34    H    TYR   4           H        TYR   4  -4.112   1.456   4.760
   35    HA   TYR   4           HA       TYR   4  -1.833   2.823   4.033
   36   1HB   TYR   4          2HB       TYR   4  -3.008   3.311   6.098
   37   2HB   TYR   4          1HB       TYR   4  -2.595   1.729   6.748
   38    HD1  TYR   4           HD1      TYR   4  -0.708   1.494   8.087
   39    HD2  TYR   4           HD2      TYR   4  -1.001   4.872   5.514
   40    HE1  TYR   4           HE1      TYR   4   1.325   2.436   9.102
   41    HE2  TYR   4           HE2      TYR   4   1.031   5.819   6.522
   42    HH   TYR   4           HH       TYR   4   3.107   4.035   8.550
   43    H    ASP   5           H        ASP   5  -2.046  -0.409   5.483
   44    HA   ASP   5           HA       ASP   5   0.693  -0.820   5.844
   45   1HB   ASP   5          2HB       ASP   5  -1.583  -2.747   5.425
   46   2HB   ASP   5          1HB       ASP   5   0.056  -3.270   5.778
   47    H    ALA   6           H        ALA   6  -1.414  -1.801   3.178
   48    HA   ALA   6           HA       ALA   6   0.552  -3.000   1.575
   49   1HB   ALA   6          1HB       ALA   6  -1.992  -1.637   0.693
   50   2HB   ALA   6          2HB       ALA   6  -1.854  -3.316   1.218
   51   3HB   ALA   6          3HB       ALA   6  -1.042  -2.780  -0.254
   52    H    ILE   7           H        ILE   7  -0.679   0.336   1.625
   53    HA   ILE   7           HA       ILE   7   0.844   1.275  -0.562
   54    HB   ILE   7           HB       ILE   7  -0.236   2.831   1.795
   55   1HG1  ILE   7          2HG1      ILE   7  -1.361   2.456  -0.991
   56   2HG1  ILE   7          1HG1      ILE   7  -1.939   1.620   0.452
   57   1HG2  ILE   7          1HG2      ILE   7  -0.037   4.801   0.340
   58   2HG2  ILE   7          2HG2      ILE   7   0.757   3.810  -0.884
   59   3HG2  ILE   7          3HG2      ILE   7   1.533   4.071   0.678
   60   1HD1  ILE   7          1HD1      ILE   7  -3.376   3.487  -0.120
   61   2HD1  ILE   7          2HD1      ILE   7  -2.008   4.597  -0.022
   62   3HD1  ILE   7          3HD1      ILE   7  -2.580   3.768   1.426
   63    H    MET   8           H        MET   8   1.430   1.342   2.930
   64    HA   MET   8           HA       MET   8   3.839   2.814   2.818
   65   1HB   MET   8          2HB       MET   8   2.400   2.481   4.849
   66   2HB   MET   8          1HB       MET   8   2.999   0.830   4.939
   67   1HG   MET   8          2HG       MET   8   4.212   2.185   6.489
   68   2HG   MET   8          1HG       MET   8   5.292   1.716   5.178
   69   1HE   MET   8          1HE       MET   8   6.624   5.274   6.097
   70   2HE   MET   8          2HE       MET   8   7.054   3.585   5.829
   71   3HE   MET   8          3HE       MET   8   6.028   4.028   7.193
   72    H    TYR   9           H        TYR   9   3.103  -0.575   2.468
   73    HA   TYR   9           HA       TYR   9   5.738  -1.557   2.808
   74   1HB   TYR   9          2HB       TYR   9   3.822  -3.044   2.989
   75   2HB   TYR   9          1HB       TYR   9   3.385  -2.732   1.313
   76    HD1  TYR   9           HD1      TYR   9   3.908  -4.399  -0.181
   77    HD2  TYR   9           HD2      TYR   9   6.416  -3.851   3.210
   78    HE1  TYR   9           HE1      TYR   9   5.297  -6.290  -0.911
   79    HE2  TYR   9           HE2      TYR   9   7.804  -5.747   2.493
   80    HH   TYR   9           HH       TYR   9   7.293  -7.345  -0.603
   81    H    LYS  10           H        LYS  10   3.882  -0.611  -0.075
   82    HA   LYS  10           HA       LYS  10   6.098  -1.264  -1.809
   83   1HB   LYS  10          2HB       LYS  10   3.684  -1.472  -2.489
   84   2HB   LYS  10          1HB       LYS  10   3.603   0.283  -2.514
   85   1HG   LYS  10          2HG       LYS  10   3.929  -0.598  -4.747
   86   2HG   LYS  10          1HG       LYS  10   5.333   0.343  -4.238
   87   1HD   LYS  10          2HD       LYS  10   6.464  -1.770  -3.606
   88   2HD   LYS  10          1HD       LYS  10   5.078  -2.663  -4.227
   89   1HE   LYS  10          2HE       LYS  10   6.806  -0.804  -5.857
   90   2HE   LYS  10          1HE       LYS  10   6.966  -2.559  -5.822
   91   1HZ   LYS  10          1HZ       LYS  10   4.624  -2.664  -6.611
   92   2HZ   LYS  10          2HZ       LYS  10   5.699  -1.985  -7.722
   93   3HZ   LYS  10          3HZ       LYS  10   4.658  -0.983  -6.831
   94    H    TYR  11           H        TYR  11   4.711   1.638  -0.386
   95    HA   TYR  11           HA       TYR  11   6.961   3.168  -1.513
   96   1HB   TYR  11          2HB       TYR  11   4.238   4.267  -0.799
   97   2HB   TYR  11          1HB       TYR  11   5.554   5.139  -1.569
   98    HD1  TYR  11           HD1      TYR  11   2.597   3.241  -2.081
   99    HD2  TYR  11           HD2      TYR  11   6.299   4.289  -3.901
  100    HE1  TYR  11           HE1      TYR  11   1.677   2.635  -4.279
  101    HE2  TYR  11           HE2      TYR  11   5.388   3.691  -6.105
  102    HH   TYR  11           HH       TYR  11   2.103   3.205  -6.671
  103    HA   PRO  12           HA       PRO  12   7.534   3.194   3.062
  104   1HB   PRO  12          2HB       PRO  12  10.321   3.696   2.241
  105   2HB   PRO  12          1HB       PRO  12   9.672   2.453   3.310
  106   1HG   PRO  12          2HG       PRO  12  10.587   1.855   0.865
  107   2HG   PRO  12          1HG       PRO  12   9.191   1.016   1.571
  108   1HD   PRO  12          2HD       PRO  12   9.249   3.219  -0.463
  109   2HD   PRO  12          1HD       PRO  12   8.240   1.758  -0.413
  110    H    ASN  13           H        ASN  13   8.403   5.377   0.527
  111    HA   ASN  13           HA       ASN  13   8.818   7.552   2.448
  112   1HB   ASN  13          2HB       ASN  13   9.761   7.020  -0.309
  113   2HB   ASN  13          1HB       ASN  13   9.419   8.702   0.092
  114   1HD2  ASN  13          1HD2      ASN  13  11.973   7.222  -0.413
  115   2HD2  ASN  13          2HD2      ASN  13  12.954   7.582   0.969
  116    H    ALA  14           H        ALA  14   6.205   6.328   1.569
  117    HA   ALA  14           HA       ALA  14   4.905   8.663   0.406
  118   1HB   ALA  14          1HB       ALA  14   3.726   6.035   1.310
  119   2HB   ALA  14          2HB       ALA  14   4.199   6.432  -0.341
  120   3HB   ALA  14          3HB       ALA  14   2.874   7.304   0.432
  121    H    VAL  15           H        VAL  15   4.608  10.295   1.804
  122    HA   VAL  15           HA       VAL  15   4.495   9.831   4.633
  123    HB   VAL  15           HB       VAL  15   3.965  12.434   3.209
  124   1HG1  VAL  15          1HG1      VAL  15   3.321  12.492   5.516
  125   2HG1  VAL  15          2HG1      VAL  15   4.839  13.375   5.342
  126   3HG1  VAL  15          3HG1      VAL  15   4.841  11.743   6.007
  127   1HG2  VAL  15          1HG2      VAL  15   6.097  11.572   2.440
  128   2HG2  VAL  15          2HG2      VAL  15   6.598  11.269   4.103
  129   3HG2  VAL  15          3HG2      VAL  15   6.353  12.923   3.544
  130    H    SER  16           H        SER  16   2.756   9.179   5.630
  131    HA   SER  16           HA       SER  16   0.159   9.230   4.535
  132   1HB   SER  16          2HB       SER  16  -0.437   8.550   6.970
  133   2HB   SER  16          1HB       SER  16   0.577   7.471   6.015
  134    HG   SER  16           HG       SER  16   1.698   7.649   7.846
  135    H    ARG  17           H        ARG  17  -1.536  10.529   4.830
  136    HA   ARG  17           HA       ARG  17  -2.855  12.238   5.462
  137   1HB   ARG  17          2HB       ARG  17  -1.068  12.129   7.863
  138   2HB   ARG  17          1HB       ARG  17  -2.234  13.436   7.686
  139   1HG   ARG  17          2HG       ARG  17  -4.040  11.786   7.509
  140   2HG   ARG  17          1HG       ARG  17  -2.864  10.489   7.723
  141   1HD   ARG  17          2HD       ARG  17  -2.380  11.165   9.934
  142   2HD   ARG  17          1HD       ARG  17  -3.215  12.702   9.725
  143    HE   ARG  17           HE       ARG  17  -5.043  10.590   9.328
  144   1HH1  ARG  17          1HH1      ARG  17  -3.151  12.023  11.899
  145   2HH1  ARG  17          2HH1      ARG  17  -4.345  11.730  13.129
  146   1HH2  ARG  17          1HH2      ARG  17  -6.621  10.198  10.941
  147   2HH2  ARG  17          2HH2      ARG  17  -6.326  10.701  12.580
  148    H    LYS  18           H        LYS  18   0.126  12.581   4.317
  149    HA   LYS  18           HA       LYS  18  -0.216  15.487   4.081
  150   1HB   LYS  18          2HB       LYS  18   2.264  13.796   4.148
  151   2HB   LYS  18          1HB       LYS  18   2.272  15.367   3.368
  152   1HG   LYS  18          2HG       LYS  18   1.391  16.295   5.572
  153   2HG   LYS  18          1HG       LYS  18   1.820  14.727   6.264
  154   1HD   LYS  18          2HD       LYS  18   4.126  15.025   5.579
  155   2HD   LYS  18          1HD       LYS  18   3.721  16.546   4.786
  156   1HE   LYS  18          2HE       LYS  18   4.686  17.139   6.851
  157   2HE   LYS  18          1HE       LYS  18   2.953  17.366   7.053
  158   1HZ   LYS  18          1HZ       LYS  18   4.085  16.244   8.937
  159   2HZ   LYS  18          2HZ       LYS  18   4.402  14.928   7.926
  160   3HZ   LYS  18          3HZ       LYS  18   2.800  15.356   8.290
  161    H    ASP  19           H        ASP  19   1.110  12.668   2.348
  162    HA   ASP  19           HA       ASP  19   0.475  13.932  -0.205
  163   1HB   ASP  19          2HB       ASP  19   2.659  12.769   0.098
  164   2HB   ASP  19          1HB       ASP  19   1.787  11.255   0.332
  165    H    PHE  20           H        PHE  20  -0.213  10.886   1.499
  166    HA   PHE  20           HA       PHE  20  -2.755  10.791   0.029
  167   1HB   PHE  20          2HB       PHE  20  -2.712   8.394   0.052
  168   2HB   PHE  20          1HB       PHE  20  -1.160   8.938  -0.570
  169    HD1  PHE  20           HD1      PHE  20  -2.861   7.028   1.939
  170    HD2  PHE  20           HD2      PHE  20   0.843   8.879   0.959
  171    HE1  PHE  20           HE1      PHE  20  -1.726   5.639   3.623
  172    HE2  PHE  20           HE2      PHE  20   1.983   7.495   2.641
  173    HZ   PHE  20           HZ       PHE  20   0.700   5.873   3.975
  174    H    GLU  21           H        GLU  21  -4.592  10.359   1.191
  175    HA   GLU  21           HA       GLU  21  -4.297  10.220   4.109
  176   1HB   GLU  21          2HB       GLU  21  -4.743  12.560   3.489
  177   2HB   GLU  21          1HB       GLU  21  -6.176  12.059   2.606
  178   1HG   GLU  21          2HG       GLU  21  -7.174  11.270   4.704
  179   2HG   GLU  21          1HG       GLU  21  -5.746  11.826   5.574
  180    H    LEU  22           H        LEU  22  -5.622   8.810   5.072
  181    HA   LEU  22           HA       LEU  22  -7.488   7.371   3.321
  182   1HB   LEU  22          2HB       LEU  22  -6.097   6.288   5.762
  183   2HB   LEU  22          1HB       LEU  22  -7.021   5.385   4.580
  184    HG   LEU  22           HG       LEU  22  -4.357   6.716   4.095
  185   1HD1  LEU  22          1HD1      LEU  22  -5.135   3.813   4.283
  186   2HD1  LEU  22          2HD1      LEU  22  -4.228   4.723   5.491
  187   3HD1  LEU  22          3HD1      LEU  22  -3.530   4.436   3.898
  188   1HD2  LEU  22          1HD2      LEU  22  -6.102   5.068   2.269
  189   2HD2  LEU  22          2HD2      LEU  22  -4.444   5.560   1.922
  190   3HD2  LEU  22          3HD2      LEU  22  -5.709   6.778   2.088
  191    H    ARG  23           H        ARG  23  -9.409   6.592   4.212
  192    HA   ARG  23           HA       ARG  23 -10.161   7.751   6.816
  193   1HB   ARG  23          2HB       ARG  23 -11.272   8.539   4.471
  194   2HB   ARG  23          1HB       ARG  23 -12.335   7.201   4.889
  195   1HG   ARG  23          2HG       ARG  23 -13.257   9.251   5.742
  196   2HG   ARG  23          1HG       ARG  23 -12.737   8.240   7.091
  197   1HD   ARG  23          2HD       ARG  23 -12.062  10.514   7.524
  198   2HD   ARG  23          1HD       ARG  23 -10.624   9.549   7.193
  199    HE   ARG  23           HE       ARG  23 -11.607  10.788   4.826
  200   1HH1  ARG  23          1HH1      ARG  23  -9.741  11.425   7.727
  201   2HH1  ARG  23          2HH1      ARG  23  -8.877  12.758   7.028
  202   1HH2  ARG  23          1HH2      ARG  23 -10.492  12.577   3.928
  203   2HH2  ARG  23          2HH2      ARG  23  -9.303  13.413   4.892
  204    H    ASN  24           H        ASN  24 -11.879   6.475   7.953
  205    HA   ASN  24           HA       ASN  24 -11.121   3.660   7.639
  206   1HB   ASN  24          2HB       ASN  24 -10.679   4.897   9.813
  207   2HB   ASN  24          1HB       ASN  24 -12.421   4.902  10.064
  208   1HD2  ASN  24          1HD2      ASN  24 -13.447   3.026  10.674
  209   2HD2  ASN  24          2HD2      ASN  24 -12.581   1.591  11.100
  210    H    ASP  25           H        ASP  25 -12.516   2.123   7.182
  211    HA   ASP  25           HA       ASP  25 -15.293   2.835   6.658
  212   1HB   ASP  25          2HB       ASP  25 -14.359   1.605   4.878
  213   2HB   ASP  25          1HB       ASP  25 -13.542   0.484   5.964
  214    H    GLY  26           H        GLY  26 -13.421   0.514   8.530
  215   1HA   GLY  26          2HA       GLY  26 -14.547   0.094  10.812
  216   2HA   GLY  26          1HA       GLY  26 -15.885  -0.451   9.804
  217    H    ASN  27           H        ASN  27 -14.701  -1.798   7.808
  218    HA   ASN  27           HA       ASN  27 -13.453  -4.080   9.156
  219   1HB   ASN  27          2HB       ASN  27 -14.572  -3.700   6.375
  220   2HB   ASN  27          1HB       ASN  27 -13.679  -5.139   6.845
  221   1HD2  ASN  27          1HD2      ASN  27 -15.456  -6.460   6.484
  222   2HD2  ASN  27          2HD2      ASN  27 -16.809  -6.490   7.565
  223    H    GLY  28           H        GLY  28 -12.380  -1.302   8.105
  224   1HA   GLY  28          2HA       GLY  28  -9.718  -1.788   8.076
  225   2HA   GLY  28          1HA       GLY  28 -10.197  -2.076   6.408
  226    H    SER  29           H        SER  29  -8.696  -0.265   6.042
  227    HA   SER  29           HA       SER  29 -10.150   2.282   6.232
  228   1HB   SER  29          2HB       SER  29  -7.151   1.967   6.543
  229   2HB   SER  29          1HB       SER  29  -8.071   3.468   6.661
  230    HG   SER  29           HG       SER  29  -9.235   1.981   8.379
  231    H    TYR  30           H        TYR  30 -10.122   3.518   4.379
  232    HA   TYR  30           HA       TYR  30  -8.843   2.231   2.056
  233   1HB   TYR  30          2HB       TYR  30 -10.839   2.945   0.733
  234   2HB   TYR  30          1HB       TYR  30 -11.214   1.768   1.983
  235    HD1  TYR  30           HD1      TYR  30 -11.650   5.231   0.887
  236    HD2  TYR  30           HD2      TYR  30 -12.525   2.399   3.934
  237    HE1  TYR  30           HE1      TYR  30 -13.378   6.735   1.783
  238    HE2  TYR  30           HE2      TYR  30 -14.255   3.892   4.838
  239    HH   TYR  30           HH       TYR  30 -15.409   6.608   3.154
  240    H    ILE  31           H        ILE  31  -8.972   3.842   0.090
  241    HA   ILE  31           HA       ILE  31  -7.503   6.206   1.009
  242    HB   ILE  31           HB       ILE  31  -7.746   5.169  -1.821
  243   1HG1  ILE  31          2HG1      ILE  31  -5.565   4.569   0.193
  244   2HG1  ILE  31          1HG1      ILE  31  -6.801   3.426  -0.319
  245   1HG2  ILE  31          1HG2      ILE  31  -5.767   7.004  -0.476
  246   2HG2  ILE  31          2HG2      ILE  31  -7.002   7.459  -1.649
  247   3HG2  ILE  31          3HG2      ILE  31  -5.657   6.431  -2.140
  248   1HD1  ILE  31          1HD1      ILE  31  -4.730   4.675  -2.102
  249   2HD1  ILE  31          2HD1      ILE  31  -5.958   3.509  -2.596
  250   3HD1  ILE  31          3HD1      ILE  31  -4.695   3.033  -1.459
  251    H    GLU  32           H        GLU  32  -8.267   8.252   0.757
  252    HA   GLU  32           HA       GLU  32 -10.212   8.684  -1.412
  253   1HB   GLU  32          2HB       GLU  32 -11.243  10.506  -0.105
  254   2HB   GLU  32          1HB       GLU  32 -11.436   8.931   0.648
  255   1HG   GLU  32          2HG       GLU  32  -9.817   9.422   2.299
  256   2HG   GLU  32          1HG       GLU  32  -9.288  10.872   1.446
  257    H    LYS  33           H        LYS  33  -7.335   9.694   0.202
  258    HA   LYS  33           HA       LYS  33  -6.998  11.866  -1.771
  259   1HB   LYS  33          2HB       LYS  33  -5.861  11.569   1.013
  260   2HB   LYS  33          1HB       LYS  33  -5.279  12.756  -0.140
  261   1HG   LYS  33          2HG       LYS  33  -8.166  12.665   0.599
  262   2HG   LYS  33          1HG       LYS  33  -6.995  13.449   1.651
  263   1HD   LYS  33          2HD       LYS  33  -6.267  14.626  -0.563
  264   2HD   LYS  33          1HD       LYS  33  -7.890  14.184  -1.081
  265   1HE   LYS  33          2HE       LYS  33  -7.857  16.434  -0.124
  266   2HE   LYS  33          1HE       LYS  33  -8.837  15.335   0.846
  267   1HZ   LYS  33          1HZ       LYS  33  -7.317  16.827   2.131
  268   2HZ   LYS  33          2HZ       LYS  33  -6.005  15.974   1.479
  269   3HZ   LYS  33          3HZ       LYS  33  -7.129  15.171   2.465
  270    H    TRP  34           H        TRP  34  -5.239  11.811  -3.082
  271    HA   TRP  34           HA       TRP  34  -3.002  10.038  -2.561
  272   1HB   TRP  34          2HB       TRP  34  -4.730   8.567  -3.586
  273   2HB   TRP  34          1HB       TRP  34  -4.797   9.637  -4.976
  274    HD1  TRP  34           HD1      TRP  34  -2.929   9.356  -6.827
  275    HE1  TRP  34           HE1      TRP  34  -1.092   7.598  -7.222
  276    HE3  TRP  34           HE3      TRP  34  -3.041   7.017  -2.270
  277    HZ2  TRP  34           HZ2      TRP  34   0.141   5.494  -5.792
  278    HZ3  TRP  34           HZ3      TRP  34  -1.500   5.140  -1.872
  279    HH2  TRP  34           HH2      TRP  34   0.057   4.396  -3.598
  280    H    ASN  35           H        ASN  35  -1.367  11.480  -2.938
  281    HA   ASN  35           HA       ASN  35  -1.640  13.207  -5.303
  282   1HB   ASN  35          2HB       ASN  35  -0.130  13.579  -2.736
  283   2HB   ASN  35          1HB       ASN  35   0.257  14.524  -4.170
  284   1HD2  ASN  35          1HD2      ASN  35  -2.039  13.942  -1.647
  285   2HD2  ASN  35          2HD2      ASN  35  -3.025  15.341  -1.944
  286    H    LEU  36           H        LEU  36  -0.049  10.513  -4.209
  287    HA   LEU  36           HA       LEU  36   2.547  10.812  -5.143
  288   1HB   LEU  36          2HB       LEU  36   0.813   8.368  -4.959
  289   2HB   LEU  36          1HB       LEU  36   2.481   8.296  -5.474
  290    HG   LEU  36           HG       LEU  36   1.540   9.296  -2.795
  291   1HD1  LEU  36          1HD1      LEU  36   2.896   6.716  -3.551
  292   2HD1  LEU  36          2HD1      LEU  36   1.221   6.894  -3.030
  293   3HD1  LEU  36          3HD1      LEU  36   2.534   7.251  -1.910
  294   1HD2  LEU  36          1HD2      LEU  36   4.317   8.831  -3.874
  295   2HD2  LEU  36          2HD2      LEU  36   3.923   9.249  -2.207
  296   3HD2  LEU  36          3HD2      LEU  36   3.588  10.394  -3.504
  297    H    ARG  37           H        ARG  37   3.518  10.744  -7.037
  298    HA   ARG  37           HA       ARG  37   1.896  10.941  -9.417
  299   1HB   ARG  37          2HB       ARG  37   4.857  11.214  -8.905
  300   2HB   ARG  37          1HB       ARG  37   4.160  11.308 -10.516
  301   1HG   ARG  37          2HG       ARG  37   2.822  13.228  -9.835
  302   2HG   ARG  37          1HG       ARG  37   3.497  13.127  -8.207
  303   1HD   ARG  37          2HD       ARG  37   5.693  13.616  -9.018
  304   2HD   ARG  37          1HD       ARG  37   5.157  13.494 -10.691
  305    HE   ARG  37           HE       ARG  37   3.620  15.489  -9.621
  306   1HH1  ARG  37          1HH1      ARG  37   7.055  14.887  -9.775
  307   2HH1  ARG  37          2HH1      ARG  37   7.477  16.563  -9.971
  308   1HH2  ARG  37          1HH2      ARG  37   4.151  17.705  -9.901
  309   2HH2  ARG  37          2HH2      ARG  37   5.822  18.160 -10.075
  310    H    ALA  38           H        ALA  38   1.456   8.536  -8.526
  311    HA   ALA  38           HA       ALA  38   2.744   6.803 -10.489
  312   1HB   ALA  38          1HB       ALA  38   2.467   6.089  -7.565
  313   2HB   ALA  38          2HB       ALA  38   3.980   6.404  -8.410
  314   3HB   ALA  38          3HB       ALA  38   3.010   4.997  -8.838
  315    HA   PRO  39           HA       PRO  39  -1.451   5.681 -11.244
  316   1HB   PRO  39          2HB       PRO  39  -1.087   3.097 -12.096
  317   2HB   PRO  39          1HB       PRO  39  -0.805   4.523 -13.101
  318   1HG   PRO  39          2HG       PRO  39   1.160   2.855 -11.581
  319   2HG   PRO  39          1HG       PRO  39   1.297   3.549 -13.209
  320   1HD   PRO  39          2HD       PRO  39   2.507   4.670 -11.084
  321   2HD   PRO  39          1HD       PRO  39   1.831   5.651 -12.403
  322    H    LEU  40           H        LEU  40  -3.157   4.630 -10.283
  323    HA   LEU  40           HA       LEU  40  -2.817   3.667  -7.659
  324   1HB   LEU  40          2HB       LEU  40  -5.111   3.814  -9.576
  325   2HB   LEU  40          1HB       LEU  40  -5.285   2.914  -8.089
  326    HG   LEU  40           HG       LEU  40  -6.203   5.105  -7.776
  327   1HD1  LEU  40          1HD1      LEU  40  -4.851   5.915  -5.890
  328   2HD1  LEU  40          2HD1      LEU  40  -3.542   4.841  -6.388
  329   3HD1  LEU  40          3HD1      LEU  40  -5.083   4.167  -5.857
  330   1HD2  LEU  40          1HD2      LEU  40  -5.023   6.286  -9.541
  331   2HD2  LEU  40          2HD2      LEU  40  -3.519   6.182  -8.627
  332   3HD2  LEU  40          3HD2      LEU  40  -4.863   7.138  -8.005
  333    HA   PRO  41           HA       PRO  41  -1.910  -0.604  -8.511
  334   1HB   PRO  41          2HB       PRO  41  -2.246  -1.544  -5.999
  335   2HB   PRO  41          1HB       PRO  41  -0.836  -0.589  -6.473
  336   1HG   PRO  41          2HG       PRO  41  -3.322   0.291  -5.053
  337   2HG   PRO  41          1HG       PRO  41  -1.631   0.695  -4.700
  338   1HD   PRO  41          2HD       PRO  41  -3.276   2.369  -6.044
  339   2HD   PRO  41          1HD       PRO  41  -1.533   2.280  -6.364
  340    H    THR  42           H        THR  42  -2.926  -2.738  -8.144
  341    HA   THR  42           HA       THR  42  -5.839  -2.481  -8.429
  342    HB   THR  42           HB       THR  42  -5.669  -4.844  -9.325
  343    HG1  THR  42           HG1      THR  42  -2.880  -4.220  -9.434
  344   1HG2  THR  42          1HG2      THR  42  -5.897  -2.937 -10.819
  345   2HG2  THR  42          2HG2      THR  42  -4.803  -4.130 -11.520
  346   3HG2  THR  42          3HG2      THR  42  -4.154  -2.669 -10.775
  347    H    GLN  43           H        GLN  43  -7.119  -4.393  -7.563
  348    HA   GLN  43           HA       GLN  43  -6.752  -4.558  -4.774
  349   1HB   GLN  43          2HB       GLN  43  -8.778  -5.154  -6.570
  350   2HB   GLN  43          1HB       GLN  43  -8.349  -6.721  -5.904
  351   1HG   GLN  43          2HG       GLN  43  -9.238  -4.281  -4.387
  352   2HG   GLN  43          1HG       GLN  43 -10.134  -5.778  -4.620
  353   1HE2  GLN  43          1HE2      GLN  43  -9.530  -7.611  -3.459
  354   2HE2  GLN  43          2HE2      GLN  43  -8.527  -7.517  -2.056
  355    H    ALA  44           H        ALA  44  -6.012  -6.735  -7.439
  356    HA   ALA  44           HA       ALA  44  -5.106  -8.952  -5.987
  357   1HB   ALA  44          1HB       ALA  44  -3.872  -9.560  -8.009
  358   2HB   ALA  44          2HB       ALA  44  -4.116  -7.935  -8.653
  359   3HB   ALA  44          3HB       ALA  44  -5.497  -9.003  -8.402
  360    H    GLU  45           H        GLU  45  -3.373  -6.102  -7.170
  361    HA   GLU  45           HA       GLU  45  -0.827  -6.766  -6.190
  362   1HB   GLU  45          2HB       GLU  45  -2.165  -4.162  -6.875
  363   2HB   GLU  45          1HB       GLU  45  -0.514  -4.209  -6.289
  364   1HG   GLU  45          2HG       GLU  45   0.135  -5.614  -8.156
  365   2HG   GLU  45          1HG       GLU  45  -1.533  -5.642  -8.727
  366    H    LEU  46           H        LEU  46  -3.476  -4.907  -4.730
  367    HA   LEU  46           HA       LEU  46  -2.189  -4.198  -2.355
  368   1HB   LEU  46          2HB       LEU  46  -5.107  -4.785  -2.862
  369   2HB   LEU  46          1HB       LEU  46  -4.477  -3.984  -1.441
  370    HG   LEU  46           HG       LEU  46  -4.297  -2.928  -4.260
  371   1HD1  LEU  46          1HD1      LEU  46  -6.579  -2.879  -3.374
  372   2HD1  LEU  46          2HD1      LEU  46  -5.908  -1.256  -3.528
  373   3HD1  LEU  46          3HD1      LEU  46  -6.003  -2.023  -1.943
  374   1HD2  LEU  46          1HD2      LEU  46  -3.471  -0.880  -3.220
  375   2HD2  LEU  46          2HD2      LEU  46  -2.401  -2.240  -2.884
  376   3HD2  LEU  46          3HD2      LEU  46  -3.507  -1.662  -1.639
  377    H    GLU  47           H        GLU  47  -4.135  -7.067  -3.161
  378    HA   GLU  47           HA       GLU  47  -4.023  -8.300  -0.649
  379   1HB   GLU  47          2HB       GLU  47  -4.186  -9.534  -3.396
  380   2HB   GLU  47          1HB       GLU  47  -4.409 -10.424  -1.899
  381   1HG   GLU  47          2HG       GLU  47  -6.307  -8.974  -1.347
  382   2HG   GLU  47          1HG       GLU  47  -6.107  -8.162  -2.898
  383    H    THR  48           H        THR  48  -1.795  -8.373  -3.367
  384    HA   THR  48           HA       THR  48  -0.155 -10.464  -2.414
  385    HB   THR  48           HB       THR  48   0.805  -8.218  -4.189
  386    HG1  THR  48           HG1      THR  48  -1.288  -9.351  -4.826
  387   1HG2  THR  48          1HG2      THR  48   2.240  -9.968  -5.134
  388   2HG2  THR  48          2HG2      THR  48   1.541 -11.150  -4.028
  389   3HG2  THR  48          3HG2      THR  48   2.503  -9.812  -3.397
  390    H    TRP  49           H        TRP  49   0.156  -6.913  -2.193
  391    HA   TRP  49           HA       TRP  49   2.584  -6.928  -0.770
  392   1HB   TRP  49          2HB       TRP  49   0.380  -4.867  -0.882
  393   2HB   TRP  49          1HB       TRP  49   1.928  -4.598  -0.085
  394    HD1  TRP  49           HD1      TRP  49   3.833  -5.887  -2.289
  395    HE1  TRP  49           HE1      TRP  49   4.174  -4.671  -4.536
  396    HE3  TRP  49           HE3      TRP  49  -0.371  -2.971  -2.269
  397    HZ2  TRP  49           HZ2      TRP  49   2.834  -2.730  -6.083
  398    HZ3  TRP  49           HZ3      TRP  49  -0.758  -1.454  -4.165
  399    HH2  TRP  49           HH2      TRP  49   0.813  -1.337  -6.030
  400    H    TRP  50           H        TRP  50  -0.763  -7.116   0.308
  401    HA   TRP  50           HA       TRP  50  -0.305  -6.820   3.062
  402   1HB   TRP  50          2HB       TRP  50  -2.555  -6.796   2.019
  403   2HB   TRP  50          1HB       TRP  50  -2.410  -8.521   1.695
  404    HD1  TRP  50           HD1      TRP  50  -2.803 -10.186   3.724
  405    HE1  TRP  50           HE1      TRP  50  -3.762  -9.869   6.097
  406    HE3  TRP  50           HE3      TRP  50  -2.664  -5.081   3.974
  407    HZ2  TRP  50           HZ2      TRP  50  -4.385  -7.727   7.833
  408    HZ3  TRP  50           HZ3      TRP  50  -3.461  -3.979   6.024
  409    HH2  TRP  50           HH2      TRP  50  -4.302  -5.277   7.911
  410    H    GLU  51           H        GLU  51  -0.569  -9.799   1.108
  411    HA   GLU  51           HA       GLU  51   0.097 -11.625   3.061
  412   1HB   GLU  51          2HB       GLU  51  -0.749 -11.815   0.560
  413   2HB   GLU  51          1HB       GLU  51   0.970 -12.029   0.245
  414   1HG   GLU  51          2HG       GLU  51   0.818 -13.719   2.172
  415   2HG   GLU  51          1HG       GLU  51  -0.895 -13.731   1.797
  416    H    GLU  52           H        GLU  52   2.158  -9.862   0.779
  417    HA   GLU  52           HA       GLU  52   4.585 -11.065   1.435
  418   1HB   GLU  52          2HB       GLU  52   3.959  -8.290   0.446
  419   2HB   GLU  52          1HB       GLU  52   5.604  -8.878   0.658
  420   1HG   GLU  52          2HG       GLU  52   5.085 -10.730  -0.906
  421   2HG   GLU  52          1HG       GLU  52   3.509  -9.992  -1.186
  422    H    LEU  53           H        LEU  53   3.013  -8.202   2.816
  423    HA   LEU  53           HA       LEU  53   5.059  -7.496   4.602
  424   1HB   LEU  53          2HB       LEU  53   3.220  -6.007   3.960
  425   2HB   LEU  53          1HB       LEU  53   2.082  -7.037   4.805
  426    HG   LEU  53           HG       LEU  53   3.267  -6.513   6.932
  427   1HD1  LEU  53          1HD1      LEU  53   4.793  -4.606   6.983
  428   2HD1  LEU  53          2HD1      LEU  53   4.731  -4.508   5.224
  429   3HD1  LEU  53          3HD1      LEU  53   5.438  -5.922   6.005
  430   1HD2  LEU  53          1HD2      LEU  53   2.350  -4.253   7.145
  431   2HD2  LEU  53          2HD2      LEU  53   1.238  -5.325   6.295
  432   3HD2  LEU  53          3HD2      LEU  53   2.196  -4.152   5.391
  433    H    GLN  54           H        GLN  54   2.472  -9.840   4.834
  434    HA   GLN  54           HA       GLN  54   2.764 -10.236   7.654
  435   1HB   GLN  54          2HB       GLN  54   1.295 -11.836   5.564
  436   2HB   GLN  54          1HB       GLN  54   1.171 -12.078   7.293
  437   1HG   GLN  54          2HG       GLN  54   0.368  -9.591   5.806
  438   2HG   GLN  54          1HG       GLN  54  -0.727 -10.824   6.426
  439   1HE2  GLN  54          1HE2      GLN  54   1.405  -8.207   7.246
  440   2HE2  GLN  54          2HE2      GLN  54   0.851  -7.999   8.869
  441    H    LYS  55           H        LYS  55   3.843 -11.873   4.714
  442    HA   LYS  55           HA       LYS  55   4.917 -14.101   6.204
  443   1HB   LYS  55          2HB       LYS  55   4.867 -13.388   3.303
  444   2HB   LYS  55          1HB       LYS  55   5.810 -14.745   3.894
  445   1HG   LYS  55          2HG       LYS  55   3.792 -15.770   4.789
  446   2HG   LYS  55          1HG       LYS  55   2.842 -14.392   4.229
  447   1HD   LYS  55          2HD       LYS  55   3.390 -14.893   1.940
  448   2HD   LYS  55          1HD       LYS  55   4.468 -16.193   2.444
  449   1HE   LYS  55          2HE       LYS  55   2.595 -17.436   3.352
  450   2HE   LYS  55          1HE       LYS  55   1.496 -16.114   2.953
  451   1HZ   LYS  55          1HZ       LYS  55   1.473 -17.961   1.323
  452   2HZ   LYS  55          2HZ       LYS  55   3.091 -17.617   0.947
  453   3HZ   LYS  55          3HZ       LYS  55   1.886 -16.463   0.636
  454    H    ASN  56           H        ASN  56   6.068 -11.101   5.224
  455    HA   ASN  56           HA       ASN  56   8.864 -11.952   5.264
  456   1HB   ASN  56          2HB       ASN  56   7.490  -9.418   4.420
  457   2HB   ASN  56          1HB       ASN  56   9.216  -9.421   4.760
  458   1HD2  ASN  56          1HD2      ASN  56   9.742  -8.931   2.654
  459   2HD2  ASN  56          2HD2      ASN  56   9.616 -10.087   1.369
  460    HA   PRO  57           HA       PRO  57   9.721 -10.550   9.391
  461   1HB   PRO  57          2HB       PRO  57  12.118  -9.239   8.958
  462   2HB   PRO  57          1HB       PRO  57  11.955 -10.982   9.193
  463   1HG   PRO  57          2HG       PRO  57  12.231  -9.426   6.658
  464   2HG   PRO  57          1HG       PRO  57  12.945 -10.988   7.101
  465   1HD   PRO  57          2HD       PRO  57  10.817 -10.819   5.470
  466   2HD   PRO  57          1HD       PRO  57  10.999 -12.152   6.631
  467    HA   PRO  58           HA       PRO  58   7.854  -6.529   9.103
  468   1HB   PRO  58          2HB       PRO  58   7.867  -5.985  11.792
  469   2HB   PRO  58          1HB       PRO  58   6.663  -7.001  10.990
  470   1HG   PRO  58          2HG       PRO  58   9.098  -7.805  12.527
  471   2HG   PRO  58          1HG       PRO  58   7.476  -8.518  12.544
  472   1HD   PRO  58          2HD       PRO  58   9.501  -9.637  11.174
  473   2HD   PRO  58          1HD       PRO  58   7.828  -9.688  10.582
  474    H    TYR  59           H        TYR  59   8.271  -4.310   9.899
  475    HA   TYR  59           HA       TYR  59  10.828  -3.457   9.182
  476   1HB   TYR  59          2HB       TYR  59   8.724  -2.098   9.106
  477   2HB   TYR  59          1HB       TYR  59   8.811  -1.941  10.855
  478    HD1  TYR  59           HD1      TYR  59  10.272  -0.916   7.662
  479    HD2  TYR  59           HD2      TYR  59  10.453  -0.468  11.890
  480    HE1  TYR  59           HE1      TYR  59  11.663   1.090   7.384
  481    HE2  TYR  59           HE2      TYR  59  11.848   1.541  11.621
  482    HH   TYR  59           HH       TYR  59  12.216   3.150   8.681
  483    H    GLU  60           H        GLU  60  12.659  -3.672  10.255
  484    HA   GLU  60           HA       GLU  60  12.736  -4.331  13.035
  485   1HB   GLU  60          2HB       GLU  60  14.370  -5.223  11.436
  486   2HB   GLU  60          1HB       GLU  60  14.971  -3.598  11.134
  487   1HG   GLU  60          2HG       GLU  60  15.769  -3.432  13.407
  488   2HG   GLU  60          1HG       GLU  60  15.065  -5.002  13.794
  Start of MODEL   12
    1   1H    MET   1          1H        MET   1 -10.229  -4.035   5.720
    2   2H    MET   1          2H        MET   1  -9.585  -4.777   7.095
    3   3H    MET   1          3H        MET   1 -10.099  -5.717   5.779
    4    HA   MET   1           HA       MET   1  -7.681  -5.522   5.875
    5   1HB   MET   1          2HB       MET   1  -8.790  -5.855   3.707
    6   2HB   MET   1          1HB       MET   1  -9.000  -4.118   3.539
    7   1HG   MET   1          2HG       MET   1  -6.574  -3.831   3.465
    8   2HG   MET   1          1HG       MET   1  -6.366  -5.575   3.621
    9   1HE   MET   1          1HE       MET   1  -5.008  -3.889   1.330
   10   2HE   MET   1          2HE       MET   1  -5.304  -4.906  -0.080
   11   3HE   MET   1          3HE       MET   1  -4.841  -5.636   1.460
   12    H    ILE   2           H        ILE   2  -5.887  -4.268   6.185
   13    HA   ILE   2           HA       ILE   2  -6.381  -1.397   6.618
   14    HB   ILE   2           HB       ILE   2  -4.036  -3.000   7.624
   15   1HG1  ILE   2          2HG1      ILE   2  -5.281  -2.467   9.897
   16   2HG1  ILE   2          1HG1      ILE   2  -6.702  -2.444   8.861
   17   1HG2  ILE   2          1HG2      ILE   2  -5.001  -0.224   8.280
   18   2HG2  ILE   2          2HG2      ILE   2  -3.536  -0.656   7.396
   19   3HG2  ILE   2          3HG2      ILE   2  -3.686  -1.063   9.106
   20   1HD1  ILE   2          1HD1      ILE   2  -6.268  -4.720   8.168
   21   2HD1  ILE   2          2HD1      ILE   2  -6.356  -4.616   9.927
   22   3HD1  ILE   2          3HD1      ILE   2  -4.790  -4.749   9.129
   23    H    LEU   3           H        LEU   3  -5.908  -0.321   4.832
   24    HA   LEU   3           HA       LEU   3  -3.988  -1.108   2.906
   25   1HB   LEU   3          2HB       LEU   3  -5.889   1.073   3.355
   26   2HB   LEU   3          1HB       LEU   3  -4.463   1.539   2.469
   27    HG   LEU   3           HG       LEU   3  -6.225   0.963   0.928
   28   1HD1  LEU   3          1HD1      LEU   3  -5.119  -0.796  -0.370
   29   2HD1  LEU   3          2HD1      LEU   3  -4.099  -1.164   1.021
   30   3HD1  LEU   3          3HD1      LEU   3  -3.980   0.408   0.230
   31   1HD2  LEU   3          1HD2      LEU   3  -7.181  -1.275   0.836
   32   2HD2  LEU   3          2HD2      LEU   3  -7.521  -0.497   2.383
   33   3HD2  LEU   3          3HD2      LEU   3  -6.264  -1.732   2.273
   34    H    TYR   4           H        TYR   4  -3.983   0.994   5.671
   35    HA   TYR   4           HA       TYR   4  -1.898   2.710   5.164
   36   1HB   TYR   4          2HB       TYR   4  -3.446   2.683   7.176
   37   2HB   TYR   4          1HB       TYR   4  -2.400   1.450   7.865
   38    HD1  TYR   4           HD1      TYR   4  -0.147   2.029   8.649
   39    HD2  TYR   4           HD2      TYR   4  -2.752   4.991   7.057
   40    HE1  TYR   4           HE1      TYR   4   1.265   3.789   9.629
   41    HE2  TYR   4           HE2      TYR   4  -1.345   6.759   8.026
   42    HH   TYR   4           HH       TYR   4   0.271   6.973   9.952
   43    H    ASP   5           H        ASP   5  -1.642  -0.427   6.824
   44    HA   ASP   5           HA       ASP   5   1.156  -0.394   7.063
   45   1HB   ASP   5          2HB       ASP   5  -0.893  -2.588   7.133
   46   2HB   ASP   5          1HB       ASP   5   0.820  -2.945   7.267
   47    H    ALA   6           H        ALA   6  -0.950  -1.926   4.676
   48    HA   ALA   6           HA       ALA   6   0.976  -3.280   3.199
   49   1HB   ALA   6          1HB       ALA   6  -1.465  -3.594   2.970
   50   2HB   ALA   6          2HB       ALA   6  -0.643  -3.399   1.423
   51   3HB   ALA   6          3HB       ALA   6  -1.555  -2.056   2.110
   52    H    ILE   7           H        ILE   7  -0.309   0.001   2.659
   53    HA   ILE   7           HA       ILE   7   1.288   0.480   0.356
   54    HB   ILE   7           HB       ILE   7  -0.046   2.484   2.187
   55   1HG1  ILE   7          2HG1      ILE   7  -1.008   1.317  -0.435
   56   2HG1  ILE   7          1HG1      ILE   7  -1.584   0.824   1.154
   57   1HG2  ILE   7          1HG2      ILE   7   0.097   4.012   0.267
   58   2HG2  ILE   7          2HG2      ILE   7   1.028   2.803  -0.618
   59   3HG2  ILE   7          3HG2      ILE   7   1.689   3.526   0.848
   60   1HD1  ILE   7          1HD1      ILE   7  -1.850   3.577  -0.024
   61   2HD1  ILE   7          2HD1      ILE   7  -2.457   3.053   1.547
   62   3HD1  ILE   7          3HD1      ILE   7  -3.127   2.364   0.067
   63    H    MET   8           H        MET   8   1.672   1.268   3.787
   64    HA   MET   8           HA       MET   8   3.914   2.952   3.502
   65   1HB   MET   8          2HB       MET   8   2.527   2.870   5.538
   66   2HB   MET   8          1HB       MET   8   3.113   1.247   5.867
   67   1HG   MET   8          2HG       MET   8   4.415   2.510   7.269
   68   2HG   MET   8          1HG       MET   8   5.455   2.356   5.857
   69   1HE   MET   8          1HE       MET   8   6.048   4.194   4.234
   70   2HE   MET   8          2HE       MET   8   5.515   5.872   4.317
   71   3HE   MET   8          3HE       MET   8   4.402   4.625   3.764
   72    H    TYR   9           H        TYR   9   3.587  -0.513   3.860
   73    HA   TYR   9           HA       TYR   9   6.354  -1.050   4.209
   74   1HB   TYR   9          2HB       TYR   9   4.873  -2.735   4.952
   75   2HB   TYR   9          1HB       TYR   9   3.985  -2.744   3.432
   76    HD1  TYR   9           HD1      TYR   9   7.472  -3.343   4.660
   77    HD2  TYR   9           HD2      TYR   9   4.359  -4.508   2.005
   78    HE1  TYR   9           HE1      TYR   9   8.864  -5.201   3.849
   79    HE2  TYR   9           HE2      TYR   9   5.742  -6.367   1.188
   80    HH   TYR   9           HH       TYR   9   8.007  -7.057   1.058
   81    H    LYS  10           H        LYS  10   4.211  -0.994   1.395
   82    HA   LYS  10           HA       LYS  10   6.147  -2.042  -0.407
   83   1HB   LYS  10          2HB       LYS  10   3.531  -1.921  -0.554
   84   2HB   LYS  10          1HB       LYS  10   3.836  -0.365  -1.309
   85   1HG   LYS  10          2HG       LYS  10   4.995  -2.969  -2.273
   86   2HG   LYS  10          1HG       LYS  10   3.517  -2.247  -2.902
   87   1HD   LYS  10          2HD       LYS  10   4.865  -0.221  -3.497
   88   2HD   LYS  10          1HD       LYS  10   6.311  -1.121  -3.036
   89   1HE   LYS  10          2HE       LYS  10   4.343  -1.962  -5.162
   90   2HE   LYS  10          1HE       LYS  10   5.886  -1.165  -5.465
   91   1HZ   LYS  10          1HZ       LYS  10   5.958  -3.595  -5.741
   92   2HZ   LYS  10          2HZ       LYS  10   5.603  -3.785  -4.094
   93   3HZ   LYS  10          3HZ       LYS  10   7.047  -3.034  -4.568
   94    H    TYR  11           H        TYR  11   4.941   1.236   0.226
   95    HA   TYR  11           HA       TYR  11   7.351   2.262  -1.121
   96   1HB   TYR  11          2HB       TYR  11   4.609   3.522  -0.986
   97   2HB   TYR  11          1HB       TYR  11   6.037   4.321  -1.624
   98    HD1  TYR  11           HD1      TYR  11   3.211   2.352  -2.432
   99    HD2  TYR  11           HD2      TYR  11   7.236   3.087  -3.593
  100    HE1  TYR  11           HE1      TYR  11   2.731   1.427  -4.662
  101    HE2  TYR  11           HE2      TYR  11   6.768   2.165  -5.823
  102    HH   TYR  11           HH       TYR  11   3.633   1.584  -6.963
  103    HA   PRO  12           HA       PRO  12   7.770   3.400   3.286
  104   1HB   PRO  12          2HB       PRO  12  10.561   3.813   2.420
  105   2HB   PRO  12          1HB       PRO  12   9.929   2.838   3.750
  106   1HG   PRO  12          2HG       PRO  12  10.919   1.704   1.535
  107   2HG   PRO  12          1HG       PRO  12   9.526   1.009   2.386
  108   1HD   PRO  12          2HD       PRO  12   9.597   2.663  -0.109
  109   2HD   PRO  12          1HD       PRO  12   8.602   1.239   0.271
  110    H    ASN  13           H        ASN  13   8.819   5.051   0.385
  111    HA   ASN  13           HA       ASN  13   9.160   7.566   1.813
  112   1HB   ASN  13          2HB       ASN  13   9.805   6.656  -0.980
  113   2HB   ASN  13          1HB       ASN  13   9.831   8.358  -0.540
  114   1HD2  ASN  13          1HD2      ASN  13  12.002   6.538  -1.361
  115   2HD2  ASN  13          2HD2      ASN  13  13.170   6.611  -0.078
  116    H    ALA  14           H        ALA  14   6.555   6.032   0.941
  117    HA   ALA  14           HA       ALA  14   5.211   8.221  -0.434
  118   1HB   ALA  14          1HB       ALA  14   3.266   6.760  -0.467
  119   2HB   ALA  14          2HB       ALA  14   4.117   5.581   0.532
  120   3HB   ALA  14          3HB       ALA  14   4.689   5.931  -1.098
  121    H    VAL  15           H        VAL  15   4.226   9.801   0.615
  122    HA   VAL  15           HA       VAL  15   3.904   9.542   3.515
  123    HB   VAL  15           HB       VAL  15   3.787  12.060   1.850
  124   1HG1  VAL  15          1HG1      VAL  15   2.727  12.243   4.028
  125   2HG1  VAL  15          2HG1      VAL  15   4.211  13.192   3.970
  126   3HG1  VAL  15          3HG1      VAL  15   4.190  11.640   4.807
  127   1HG2  VAL  15          1HG2      VAL  15   5.971  10.968   1.592
  128   2HG2  VAL  15          2HG2      VAL  15   6.159  10.946   3.345
  129   3HG2  VAL  15          3HG2      VAL  15   6.087  12.484   2.485
  130    H    SER  16           H        SER  16   1.893   8.747   3.974
  131    HA   SER  16           HA       SER  16  -0.343   9.415   2.274
  132   1HB   SER  16          2HB       SER  16  -1.578   7.930   3.975
  133   2HB   SER  16          1HB       SER  16  -0.326   7.160   3.002
  134    HG   SER  16           HG       SER  16  -0.476   7.396   5.669
  135    H    ARG  17           H        ARG  17   0.714  11.586   3.481
  136    HA   ARG  17           HA       ARG  17  -1.183  12.369   5.509
  137   1HB   ARG  17          2HB       ARG  17   1.314  13.753   4.555
  138   2HB   ARG  17          1HB       ARG  17   0.231  14.385   5.793
  139   1HG   ARG  17          2HG       ARG  17   0.643  12.400   7.160
  140   2HG   ARG  17          1HG       ARG  17   1.741  11.784   5.929
  141   1HD   ARG  17          2HD       ARG  17   3.131  13.819   6.244
  142   2HD   ARG  17          1HD       ARG  17   2.078  14.276   7.585
  143    HE   ARG  17           HE       ARG  17   3.287  11.629   7.719
  144   1HH1  ARG  17          1HH1      ARG  17   3.361  14.971   8.762
  145   2HH1  ARG  17          2HH1      ARG  17   4.427  14.657  10.100
  146   1HH2  ARG  17          1HH2      ARG  17   4.641  11.200   9.483
  147   2HH2  ARG  17          2HH2      ARG  17   5.119  12.496  10.547
  148    H    LYS  18           H        LYS  18   0.253  14.093   2.746
  149    HA   LYS  18           HA       LYS  18  -2.412  15.208   2.185
  150   1HB   LYS  18          2HB       LYS  18   0.333  16.400   1.800
  151   2HB   LYS  18          1HB       LYS  18  -1.134  17.109   1.164
  152   1HG   LYS  18          2HG       LYS  18  -0.750  18.299   3.118
  153   2HG   LYS  18          1HG       LYS  18  -1.964  17.109   3.591
  154   1HD   LYS  18          2HD       LYS  18  -0.182  15.686   4.514
  155   2HD   LYS  18          1HD       LYS  18   1.011  16.904   4.059
  156   1HE   LYS  18          2HE       LYS  18   0.471  17.113   6.408
  157   2HE   LYS  18          1HE       LYS  18  -0.108  18.526   5.528
  158   1HZ   LYS  18          1HZ       LYS  18  -1.746  17.772   7.111
  159   2HZ   LYS  18          2HZ       LYS  18  -1.770  16.224   6.416
  160   3HZ   LYS  18          3HZ       LYS  18  -2.335  17.559   5.534
  161    H    ASP  19           H        ASP  19   0.530  13.885   0.758
  162    HA   ASP  19           HA       ASP  19  -0.056  14.277  -1.956
  163   1HB   ASP  19          2HB       ASP  19   1.460  11.988  -0.667
  164   2HB   ASP  19          1HB       ASP  19   1.497  12.397  -2.379
  165    H    PHE  20           H        PHE  20  -0.746  11.553   0.158
  166    HA   PHE  20           HA       PHE  20  -3.288  11.234  -1.174
  167   1HB   PHE  20          2HB       PHE  20  -3.105   8.850  -1.506
  168   2HB   PHE  20          1HB       PHE  20  -1.763   9.619  -2.337
  169    HD1  PHE  20           HD1      PHE  20  -2.740   7.104  -0.051
  170    HD2  PHE  20           HD2      PHE  20   0.502   9.658  -1.092
  171    HE1  PHE  20           HE1      PHE  20  -1.185   5.592   1.103
  172    HE2  PHE  20           HE2      PHE  20   2.062   8.151   0.066
  173    HZ   PHE  20           HZ       PHE  20   1.220   6.118   1.161
  174    H    GLU  21           H        GLU  21  -4.831  10.202   0.261
  175    HA   GLU  21           HA       GLU  21  -3.856   9.970   3.007
  176   1HB   GLU  21          2HB       GLU  21  -4.585  12.297   2.704
  177   2HB   GLU  21          1HB       GLU  21  -6.169  11.732   2.190
  178   1HG   GLU  21          2HG       GLU  21  -6.683  10.911   4.340
  179   2HG   GLU  21          1HG       GLU  21  -5.014  11.072   4.879
  180    H    LEU  22           H        LEU  22  -4.773   8.445   4.152
  181    HA   LEU  22           HA       LEU  22  -6.794   6.796   2.850
  182   1HB   LEU  22          2HB       LEU  22  -5.210   6.207   5.348
  183   2HB   LEU  22          1HB       LEU  22  -6.140   5.068   4.394
  184    HG   LEU  22           HG       LEU  22  -3.611   6.457   3.497
  185   1HD1  LEU  22          1HD1      LEU  22  -3.191   4.764   5.184
  186   2HD1  LEU  22          2HD1      LEU  22  -2.640   4.207   3.604
  187   3HD1  LEU  22          3HD1      LEU  22  -4.151   3.597   4.277
  188   1HD2  LEU  22          1HD2      LEU  22  -5.125   6.064   1.631
  189   2HD2  LEU  22          2HD2      LEU  22  -5.306   4.379   2.119
  190   3HD2  LEU  22          3HD2      LEU  22  -3.743   4.969   1.556
  191    H    ARG  23           H        ARG  23  -8.619   6.007   4.052
  192    HA   ARG  23           HA       ARG  23  -9.363   7.658   6.366
  193   1HB   ARG  23          2HB       ARG  23 -10.329   8.495   4.125
  194   2HB   ARG  23          1HB       ARG  23 -11.327   7.047   4.167
  195   1HG   ARG  23          2HG       ARG  23 -12.608   8.840   5.055
  196   2HG   ARG  23          1HG       ARG  23 -12.171   7.782   6.398
  197   1HD   ARG  23          2HD       ARG  23 -11.865  10.079   7.071
  198   2HD   ARG  23          1HD       ARG  23 -10.288   9.305   6.921
  199    HE   ARG  23           HE       ARG  23 -11.225  10.762   4.584
  200   1HH1  ARG  23          1HH1      ARG  23  -9.291  10.842   7.521
  201   2HH1  ARG  23          2HH1      ARG  23  -8.286  12.148   6.968
  202   1HH2  ARG  23          1HH2      ARG  23  -9.942  12.473   3.876
  203   2HH2  ARG  23          2HH2      ARG  23  -8.657  13.086   4.888
  204    H    ASN  24           H        ASN  24 -10.970   6.695   7.721
  205    HA   ASN  24           HA       ASN  24 -10.831   3.831   7.784
  206   1HB   ASN  24          2HB       ASN  24 -10.879   5.109   9.868
  207   2HB   ASN  24          1HB       ASN  24 -12.459   5.762   9.451
  208   1HD2  ASN  24          1HD2      ASN  24 -13.381   4.929  11.319
  209   2HD2  ASN  24          2HD2      ASN  24 -13.718   3.238  11.499
  210    H    ASP  25           H        ASP  25 -12.125   2.465   6.834
  211    HA   ASP  25           HA       ASP  25 -14.407   3.451   5.335
  212   1HB   ASP  25          2HB       ASP  25 -12.893   1.965   4.189
  213   2HB   ASP  25          1HB       ASP  25 -13.020   0.766   5.471
  214    H    GLY  26           H        GLY  26 -13.711   1.671   8.199
  215   1HA   GLY  26          2HA       GLY  26 -15.450   1.326   9.855
  216   2HA   GLY  26          1HA       GLY  26 -16.573   1.033   8.529
  217    H    ASN  27           H        ASN  27 -15.112  -0.627   6.930
  218    HA   ASN  27           HA       ASN  27 -14.859  -3.048   8.573
  219   1HB   ASN  27          2HB       ASN  27 -16.389  -2.951   6.538
  220   2HB   ASN  27          1HB       ASN  27 -14.937  -2.847   5.553
  221   1HD2  ASN  27          1HD2      ASN  27 -13.775  -4.669   5.143
  222   2HD2  ASN  27          2HD2      ASN  27 -14.238  -6.246   5.683
  223    H    GLY  28           H        GLY  28 -12.950  -0.687   7.892
  224   1HA   GLY  28          2HA       GLY  28 -10.502  -1.711   8.313
  225   2HA   GLY  28          1HA       GLY  28 -10.722  -1.988   6.588
  226    H    SER  29           H        SER  29  -8.882  -0.533   6.370
  227    HA   SER  29           HA       SER  29  -9.819   2.254   6.282
  228   1HB   SER  29          2HB       SER  29  -7.002   1.388   6.996
  229   2HB   SER  29          1HB       SER  29  -7.609   3.043   6.937
  230    HG   SER  29           HG       SER  29  -9.243   1.837   8.531
  231    H    TYR  30           H        TYR  30  -9.726   3.046   4.250
  232    HA   TYR  30           HA       TYR  30  -7.966   1.663   2.338
  233   1HB   TYR  30          2HB       TYR  30  -9.680   1.578   0.690
  234   2HB   TYR  30          1HB       TYR  30 -10.378   0.941   2.170
  235    HD1  TYR  30           HD1      TYR  30 -11.218   2.702  -0.573
  236    HD2  TYR  30           HD2      TYR  30 -11.360   3.146   3.657
  237    HE1  TYR  30           HE1      TYR  30 -13.094   4.273  -0.807
  238    HE2  TYR  30           HE2      TYR  30 -13.241   4.711   3.433
  239    HH   TYR  30           HH       TYR  30 -14.144   6.273   1.666
  240    H    ILE  31           H        ILE  31  -8.234   3.033   0.107
  241    HA   ILE  31           HA       ILE  31  -6.941   5.524   0.830
  242    HB   ILE  31           HB       ILE  31  -7.431   4.516  -1.972
  243   1HG1  ILE  31          2HG1      ILE  31  -5.057   3.908  -0.181
  244   2HG1  ILE  31          1HG1      ILE  31  -6.320   2.756  -0.600
  245   1HG2  ILE  31          1HG2      ILE  31  -5.331   6.326  -0.784
  246   2HG2  ILE  31          2HG2      ILE  31  -6.709   6.834  -1.759
  247   3HG2  ILE  31          3HG2      ILE  31  -5.436   5.844  -2.477
  248   1HD1  ILE  31          1HD1      ILE  31  -4.375   4.052  -2.496
  249   2HD1  ILE  31          2HD1      ILE  31  -5.683   2.967  -2.970
  250   3HD1  ILE  31          3HD1      ILE  31  -4.367   2.373  -1.956
  251    H    GLU  32           H        GLU  32  -8.022   7.353   1.049
  252    HA   GLU  32           HA       GLU  32 -10.600   7.721  -0.253
  253   1HB   GLU  32          2HB       GLU  32 -10.421   8.421   2.073
  254   2HB   GLU  32          1HB       GLU  32  -9.068   9.475   1.681
  255   1HG   GLU  32          2HG       GLU  32 -10.625  10.733   0.163
  256   2HG   GLU  32          1HG       GLU  32 -11.939   9.779   0.850
  257    H    LYS  33           H        LYS  33  -7.526   9.474   0.015
  258    HA   LYS  33           HA       LYS  33  -8.095  10.712  -2.598
  259   1HB   LYS  33          2HB       LYS  33  -6.579  11.796  -0.226
  260   2HB   LYS  33          1HB       LYS  33  -6.509  12.520  -1.826
  261   1HG   LYS  33          2HG       LYS  33  -8.980  12.821  -1.713
  262   2HG   LYS  33          1HG       LYS  33  -8.914  12.275  -0.041
  263   1HD   LYS  33          2HD       LYS  33  -7.309  14.562  -1.108
  264   2HD   LYS  33          1HD       LYS  33  -8.895  14.754  -0.370
  265   1HE   LYS  33          2HE       LYS  33  -6.625  13.371   1.024
  266   2HE   LYS  33          1HE       LYS  33  -6.865  15.113   1.112
  267   1HZ   LYS  33          1HZ       LYS  33  -8.939  13.126   1.870
  268   2HZ   LYS  33          2HZ       LYS  33  -8.976  14.805   2.125
  269   3HZ   LYS  33          3HZ       LYS  33  -7.864  13.842   2.974
  270    H    TRP  34           H        TRP  34  -6.435  10.922  -4.054
  271    HA   TRP  34           HA       TRP  34  -3.829   9.791  -3.475
  272   1HB   TRP  34          2HB       TRP  34  -5.237   7.850  -4.141
  273   2HB   TRP  34          1HB       TRP  34  -5.601   8.657  -5.659
  274    HD1  TRP  34           HD1      TRP  34  -3.608   8.806  -7.478
  275    HE1  TRP  34           HE1      TRP  34  -1.532   7.326  -7.825
  276    HE3  TRP  34           HE3      TRP  34  -3.474   6.523  -2.902
  277    HZ2  TRP  34           HZ2      TRP  34  -0.033   5.445  -6.349
  278    HZ3  TRP  34           HZ3      TRP  34  -1.686   4.894  -2.454
  279    HH2  TRP  34           HH2      TRP  34  -0.001   4.365  -4.143
  280    H    ASN  35           H        ASN  35  -2.579  11.418  -4.150
  281    HA   ASN  35           HA       ASN  35  -3.209  12.654  -6.751
  282   1HB   ASN  35          2HB       ASN  35  -2.095  13.886  -4.237
  283   2HB   ASN  35          1HB       ASN  35  -1.906  14.655  -5.810
  284   1HD2  ASN  35          1HD2      ASN  35  -3.357  15.498  -3.412
  285   2HD2  ASN  35          2HD2      ASN  35  -4.986  15.773  -3.926
  286    H    LEU  36           H        LEU  36  -1.302  10.464  -5.477
  287    HA   LEU  36           HA       LEU  36   1.305  11.274  -6.259
  288   1HB   LEU  36          2HB       LEU  36   0.133   8.507  -5.940
  289   2HB   LEU  36          1HB       LEU  36   1.833   8.849  -6.182
  290    HG   LEU  36           HG       LEU  36   0.179   9.634  -3.796
  291   1HD1  LEU  36          1HD1      LEU  36   2.453   7.688  -4.116
  292   2HD1  LEU  36          2HD1      LEU  36   0.757   7.273  -3.873
  293   3HD1  LEU  36          3HD1      LEU  36   1.654   8.099  -2.598
  294   1HD2  LEU  36          1HD2      LEU  36   3.088  10.149  -4.387
  295   2HD2  LEU  36          2HD2      LEU  36   2.278  10.474  -2.855
  296   3HD2  LEU  36          3HD2      LEU  36   1.814  11.365  -4.304
  297    H    ARG  37           H        ARG  37   2.465  10.746  -8.121
  298    HA   ARG  37           HA       ARG  37   0.802  10.532 -10.494
  299   1HB   ARG  37          2HB       ARG  37   3.795  10.866 -10.293
  300   2HB   ARG  37          1HB       ARG  37   2.801  11.116 -11.722
  301   1HG   ARG  37          2HG       ARG  37   1.619  12.935 -10.457
  302   2HG   ARG  37          1HG       ARG  37   2.857  12.769  -9.211
  303   1HD   ARG  37          2HD       ARG  37   3.496  14.556 -10.661
  304   2HD   ARG  37          1HD       ARG  37   4.573  13.191 -10.971
  305    HE   ARG  37           HE       ARG  37   2.258  13.340 -12.703
  306   1HH1  ARG  37          1HH1      ARG  37   5.639  14.132 -12.243
  307   2HH1  ARG  37          2HH1      ARG  37   5.916  14.496 -13.921
  308   1HH2  ARG  37          1HH2      ARG  37   2.609  13.812 -14.908
  309   2HH2  ARG  37          2HH2      ARG  37   4.177  14.335 -15.441
  310    H    ALA  38           H        ALA  38   0.530   8.286  -9.218
  311    HA   ALA  38           HA       ALA  38   2.004   6.329 -10.830
  312   1HB   ALA  38          1HB       ALA  38   1.425   6.024  -7.875
  313   2HB   ALA  38          2HB       ALA  38   3.010   6.344  -8.577
  314   3HB   ALA  38          3HB       ALA  38   2.190   4.822  -8.917
  315    HA   PRO  39           HA       PRO  39  -2.001   4.851 -11.896
  316   1HB   PRO  39          2HB       PRO  39  -1.486   2.128 -11.937
  317   2HB   PRO  39          1HB       PRO  39  -1.156   3.244 -13.264
  318   1HG   PRO  39          2HG       PRO  39   0.698   2.176 -11.178
  319   2HG   PRO  39          1HG       PRO  39   0.990   2.452 -12.905
  320   1HD   PRO  39          2HD       PRO  39   1.917   4.150 -11.059
  321   2HD   PRO  39          1HD       PRO  39   1.293   4.733 -12.617
  322    H    LEU  40           H        LEU  40  -3.812   4.406 -10.801
  323    HA   LEU  40           HA       LEU  40  -3.830   3.863  -8.048
  324   1HB   LEU  40          2HB       LEU  40  -5.851   4.068 -10.200
  325   2HB   LEU  40          1HB       LEU  40  -6.330   3.160  -8.784
  326    HG   LEU  40           HG       LEU  40  -7.081   5.452  -8.595
  327   1HD1  LEU  40          1HD1      LEU  40  -6.090   6.036  -6.439
  328   2HD1  LEU  40          2HD1      LEU  40  -4.781   4.889  -6.729
  329   3HD1  LEU  40          3HD1      LEU  40  -6.435   4.307  -6.544
  330   1HD2  LEU  40          1HD2      LEU  40  -4.174   6.205  -8.852
  331   2HD2  LEU  40          2HD2      LEU  40  -5.493   7.308  -8.459
  332   3HD2  LEU  40          3HD2      LEU  40  -5.442   6.520 -10.038
  333    HA   PRO  41           HA       PRO  41  -2.872  -0.473  -8.327
  334   1HB   PRO  41          2HB       PRO  41  -3.689  -0.512  -5.505
  335   2HB   PRO  41          1HB       PRO  41  -2.143  -0.943  -6.237
  336   1HG   PRO  41          2HG       PRO  41  -2.478   1.306  -4.786
  337   2HG   PRO  41          1HG       PRO  41  -1.341   1.199  -6.142
  338   1HD   PRO  41          2HD       PRO  41  -4.017   2.498  -6.010
  339   2HD   PRO  41          1HD       PRO  41  -2.574   2.962  -6.923
  340    H    THR  42           H        THR  42  -3.944  -2.372  -8.288
  341    HA   THR  42           HA       THR  42  -6.866  -2.140  -8.277
  342    HB   THR  42           HB       THR  42  -6.764  -4.339  -9.527
  343    HG1  THR  42           HG1      THR  42  -4.055  -3.754 -10.082
  344   1HG2  THR  42          1HG2      THR  42  -5.333  -1.985 -10.769
  345   2HG2  THR  42          2HG2      THR  42  -7.081  -2.205 -10.683
  346   3HG2  THR  42          3HG2      THR  42  -6.103  -3.309 -11.650
  347    H    GLN  43           H        GLN  43  -7.928  -4.389  -7.732
  348    HA   GLN  43           HA       GLN  43  -7.710  -4.822  -5.009
  349   1HB   GLN  43          2HB       GLN  43  -9.611  -5.498  -6.515
  350   2HB   GLN  43          1HB       GLN  43  -8.640  -6.862  -7.034
  351   1HG   GLN  43          2HG       GLN  43 -10.181  -7.606  -5.370
  352   2HG   GLN  43          1HG       GLN  43  -8.552  -7.646  -4.694
  353   1HE2  GLN  43          1HE2      GLN  43  -9.204  -7.525  -2.596
  354   2HE2  GLN  43          2HE2      GLN  43  -9.924  -6.106  -1.900
  355    H    ALA  44           H        ALA  44  -6.478  -6.845  -7.641
  356    HA   ALA  44           HA       ALA  44  -5.170  -8.760  -6.097
  357   1HB   ALA  44          1HB       ALA  44  -5.546  -9.001  -8.495
  358   2HB   ALA  44          2HB       ALA  44  -3.846  -9.231  -8.091
  359   3HB   ALA  44          3HB       ALA  44  -4.382  -7.714  -8.812
  360    H    GLU  45           H        GLU  45  -3.907  -5.736  -7.439
  361    HA   GLU  45           HA       GLU  45  -1.279  -5.972  -6.521
  362   1HB   GLU  45          2HB       GLU  45  -2.995  -3.583  -7.163
  363   2HB   GLU  45          1HB       GLU  45  -1.319  -3.410  -6.670
  364   1HG   GLU  45          2HG       GLU  45  -0.530  -4.514  -8.593
  365   2HG   GLU  45          1HG       GLU  45  -2.137  -5.126  -8.987
  366    H    LEU  46           H        LEU  46  -4.056  -4.346  -5.007
  367    HA   LEU  46           HA       LEU  46  -2.752  -3.360  -2.755
  368   1HB   LEU  46          2HB       LEU  46  -5.605  -4.245  -3.146
  369   2HB   LEU  46          1HB       LEU  46  -5.038  -3.395  -1.728
  370    HG   LEU  46           HG       LEU  46  -5.047  -2.325  -4.546
  371   1HD1  LEU  46          1HD1      LEU  46  -7.271  -2.452  -3.570
  372   2HD1  LEU  46          2HD1      LEU  46  -6.737  -0.776  -3.693
  373   3HD1  LEU  46          3HD1      LEU  46  -6.703  -1.601  -2.134
  374   1HD2  LEU  46          1HD2      LEU  46  -4.368  -0.202  -3.490
  375   2HD2  LEU  46          2HD2      LEU  46  -3.147  -1.462  -3.328
  376   3HD2  LEU  46          3HD2      LEU  46  -4.175  -1.051  -1.956
  377    H    GLU  47           H        GLU  47  -4.504  -6.425  -3.192
  378    HA   GLU  47           HA       GLU  47  -4.040  -7.295  -0.539
  379   1HB   GLU  47          2HB       GLU  47  -4.932  -8.752  -3.015
  380   2HB   GLU  47          1HB       GLU  47  -4.728  -9.561  -1.465
  381   1HG   GLU  47          2HG       GLU  47  -6.320  -7.923  -0.477
  382   2HG   GLU  47          1HG       GLU  47  -6.609  -7.304  -2.100
  383    H    THR  48           H        THR  48  -2.237  -7.711  -3.542
  384    HA   THR  48           HA       THR  48  -0.533  -9.789  -2.666
  385    HB   THR  48           HB       THR  48   0.071  -7.573  -4.644
  386    HG1  THR  48           HG1      THR  48  -1.734  -8.902  -5.207
  387   1HG2  THR  48          1HG2      THR  48   2.119  -8.670  -3.875
  388   2HG2  THR  48          2HG2      THR  48   1.764  -9.108  -5.545
  389   3HG2  THR  48          3HG2      THR  48   1.423 -10.247  -4.243
  390    H    TRP  49           H        TRP  49  -0.270  -6.255  -2.397
  391    HA   TRP  49           HA       TRP  49   2.312  -6.269  -1.239
  392   1HB   TRP  49          2HB       TRP  49   0.112  -4.198  -1.078
  393   2HB   TRP  49          1HB       TRP  49   1.775  -3.941  -0.550
  394    HD1  TRP  49           HD1      TRP  49   2.912  -5.621  -3.218
  395    HE1  TRP  49           HE1      TRP  49   3.041  -4.313  -5.430
  396    HE3  TRP  49           HE3      TRP  49  -0.325  -1.835  -2.086
  397    HZ2  TRP  49           HZ2      TRP  49   1.914  -1.977  -6.540
  398    HZ3  TRP  49           HZ3      TRP  49  -0.741  -0.102  -3.780
  399    HH2  TRP  49           HH2      TRP  49   0.356  -0.171  -5.961
  400    H    TRP  50           H        TRP  50  -0.940  -6.439   0.085
  401    HA   TRP  50           HA       TRP  50  -0.197  -6.357   2.816
  402   1HB   TRP  50          2HB       TRP  50  -2.520  -6.032   2.086
  403   2HB   TRP  50          1HB       TRP  50  -2.582  -7.692   1.508
  404    HD1  TRP  50           HD1      TRP  50  -3.397  -9.468   3.199
  405    HE1  TRP  50           HE1      TRP  50  -3.915  -9.486   5.727
  406    HE3  TRP  50           HE3      TRP  50  -1.615  -4.826   4.424
  407    HZ2  TRP  50           HZ2      TRP  50  -3.596  -7.760   7.931
  408    HZ3  TRP  50           HZ3      TRP  50  -1.760  -4.097   6.767
  409    HH2  TRP  50           HH2      TRP  50  -2.730  -5.534   8.480
  410    H    GLU  51           H        GLU  51  -0.580  -8.981   0.482
  411    HA   GLU  51           HA       GLU  51  -0.077 -11.131   2.201
  412   1HB   GLU  51          2HB       GLU  51   0.260 -10.735  -0.762
  413   2HB   GLU  51          1HB       GLU  51   0.626 -12.253   0.016
  414   1HG   GLU  51          2HG       GLU  51  -1.725 -12.261   0.902
  415   2HG   GLU  51          1HG       GLU  51  -2.029 -10.881  -0.152
  416    H    GLU  52           H        GLU  52   2.111  -9.195   0.180
  417    HA   GLU  52           HA       GLU  52   4.451 -10.602   0.804
  418   1HB   GLU  52          2HB       GLU  52   4.013  -7.753  -0.062
  419   2HB   GLU  52          1HB       GLU  52   5.618  -8.424   0.201
  420   1HG   GLU  52          2HG       GLU  52   5.066 -10.201  -1.457
  421   2HG   GLU  52          1HG       GLU  52   3.572  -9.335  -1.798
  422    H    LEU  53           H        LEU  53   2.886  -7.855   2.381
  423    HA   LEU  53           HA       LEU  53   4.827  -7.487   4.400
  424   1HB   LEU  53          2HB       LEU  53   3.151  -5.794   3.911
  425   2HB   LEU  53          1HB       LEU  53   1.867  -6.893   4.372
  426    HG   LEU  53           HG       LEU  53   2.746  -6.875   6.699
  427   1HD1  LEU  53          1HD1      LEU  53   4.338  -5.147   7.346
  428   2HD1  LEU  53          2HD1      LEU  53   4.529  -4.681   5.656
  429   3HD1  LEU  53          3HD1      LEU  53   5.059  -6.274   6.197
  430   1HD2  LEU  53          1HD2      LEU  53   1.901  -4.661   7.247
  431   2HD2  LEU  53          2HD2      LEU  53   0.896  -5.434   6.021
  432   3HD2  LEU  53          3HD2      LEU  53   2.044  -4.180   5.557
  433    H    GLN  54           H        GLN  54   1.942  -9.494   4.175
  434    HA   GLN  54           HA       GLN  54   1.919 -10.428   6.841
  435   1HB   GLN  54          2HB       GLN  54   0.087 -10.534   5.037
  436   2HB   GLN  54          1HB       GLN  54   0.912 -11.976   4.476
  437   1HG   GLN  54          2HG       GLN  54  -0.892 -12.642   5.873
  438   2HG   GLN  54          1HG       GLN  54   0.615 -12.964   6.726
  439   1HE2  GLN  54          1HE2      GLN  54  -0.726  -9.762   6.382
  440   2HE2  GLN  54          2HE2      GLN  54  -1.144  -9.548   8.046
  441    H    LYS  55           H        LYS  55   3.587 -11.434   3.966
  442    HA   LYS  55           HA       LYS  55   4.683 -13.817   5.275
  443   1HB   LYS  55          2HB       LYS  55   3.655 -13.911   2.984
  444   2HB   LYS  55          1HB       LYS  55   4.975 -12.905   2.414
  445   1HG   LYS  55          2HG       LYS  55   6.541 -14.685   3.236
  446   2HG   LYS  55          1HG       LYS  55   5.122 -15.701   3.491
  447   1HD   LYS  55          2HD       LYS  55   4.551 -15.592   1.164
  448   2HD   LYS  55          1HD       LYS  55   5.813 -14.399   0.865
  449   1HE   LYS  55          2HE       LYS  55   6.256 -17.251   1.745
  450   2HE   LYS  55          1HE       LYS  55   6.456 -16.642   0.103
  451   1HZ   LYS  55          1HZ       LYS  55   8.150 -15.070   1.060
  452   2HZ   LYS  55          2HZ       LYS  55   8.588 -16.705   1.069
  453   3HZ   LYS  55          3HZ       LYS  55   8.067 -15.965   2.499
  454    H    ASN  56           H        ASN  56   5.463 -10.802   5.583
  455    HA   ASN  56           HA       ASN  56   8.271 -10.983   4.754
  456   1HB   ASN  56          2HB       ASN  56   6.924  -8.940   4.160
  457   2HB   ASN  56          1HB       ASN  56   6.818  -8.580   5.882
  458   1HD2  ASN  56          1HD2      ASN  56   8.014  -6.772   6.021
  459   2HD2  ASN  56          2HD2      ASN  56   9.687  -6.669   5.582
  460    HA   PRO  57           HA       PRO  57   9.514 -11.556   9.075
  461   1HB   PRO  57          2HB       PRO  57  12.159 -10.988   7.878
  462   2HB   PRO  57          1HB       PRO  57  11.642 -12.374   8.843
  463   1HG   PRO  57          2HG       PRO  57  12.100 -12.590   6.211
  464   2HG   PRO  57          1HG       PRO  57  10.808 -13.507   7.010
  465   1HD   PRO  57          2HD       PRO  57  10.624 -11.026   5.343
  466   2HD   PRO  57          1HD       PRO  57   9.551 -12.442   5.380
  467    HA   PRO  58           HA       PRO  58   9.223  -7.264   9.952
  468   1HB   PRO  58          2HB       PRO  58  10.719  -7.853  12.435
  469   2HB   PRO  58          1HB       PRO  58   9.123  -7.132  12.224
  470   1HG   PRO  58          2HG       PRO  58   9.390  -9.647  13.092
  471   2HG   PRO  58          1HG       PRO  58   8.070  -9.176  12.005
  472   1HD   PRO  58          2HD       PRO  58  10.596 -10.654  11.393
  473   2HD   PRO  58          1HD       PRO  58   8.962 -10.885  10.737
  474    H    TYR  59           H        TYR  59  10.364  -5.416   9.838
  475    HA   TYR  59           HA       TYR  59  13.140  -5.609   9.053
  476   1HB   TYR  59          2HB       TYR  59  11.540  -4.133   7.862
  477   2HB   TYR  59          1HB       TYR  59  11.348  -3.182   9.328
  478    HD1  TYR  59           HD1      TYR  59  12.993  -1.554   9.968
  479    HD2  TYR  59           HD2      TYR  59  13.663  -4.066   6.598
  480    HE1  TYR  59           HE1      TYR  59  14.855  -0.113   9.269
  481    HE2  TYR  59           HE2      TYR  59  15.529  -2.626   5.893
  482    HH   TYR  59           HH       TYR  59  16.255  -0.258   6.216
  483    H    GLU  60           H        GLU  60  14.624  -5.756  10.576
  484    HA   GLU  60           HA       GLU  60  14.191  -5.090  13.277
  485   1HB   GLU  60          2HB       GLU  60  16.831  -5.503  11.861
  486   2HB   GLU  60          1HB       GLU  60  16.556  -5.578  13.594
  487   1HG   GLU  60          2HG       GLU  60  14.976  -7.474  13.164
  488   2HG   GLU  60          1HG       GLU  60  15.552  -7.474  11.497
  Start of MODEL   13
    1   1H    MET   1          1H        MET   1 -10.187  -4.053   5.091
    2   2H    MET   1          2H        MET   1  -9.283  -4.592   6.421
    3   3H    MET   1          3H        MET   1  -9.820  -5.700   5.258
    4    HA   MET   1           HA       MET   1  -7.515  -5.319   4.902
    5   1HB   MET   1          2HB       MET   1  -9.296  -5.367   2.990
    6   2HB   MET   1          1HB       MET   1  -8.905  -3.663   2.815
    7   1HG   MET   1          2HG       MET   1  -6.876  -5.870   2.654
    8   2HG   MET   1          1HG       MET   1  -7.711  -5.191   1.261
    9   1HE   MET   1          1HE       MET   1  -5.550  -4.537   0.006
   10   2HE   MET   1          2HE       MET   1  -4.627  -5.326   1.285
   11   3HE   MET   1          3HE       MET   1  -4.182  -3.706   0.747
   12    H    ILE   2           H        ILE   2  -5.843  -4.030   5.435
   13    HA   ILE   2           HA       ILE   2  -6.400  -1.176   5.870
   14    HB   ILE   2           HB       ILE   2  -4.077  -2.778   6.943
   15   1HG1  ILE   2          2HG1      ILE   2  -5.343  -2.199   9.172
   16   2HG1  ILE   2          1HG1      ILE   2  -6.745  -2.094   8.117
   17   1HG2  ILE   2          1HG2      ILE   2  -5.014   0.024   7.521
   18   2HG2  ILE   2          2HG2      ILE   2  -3.538  -0.441   6.672
   19   3HG2  ILE   2          3HG2      ILE   2  -3.725  -0.812   8.388
   20   1HD1  ILE   2          1HD1      ILE   2  -6.403  -4.391   7.409
   21   2HD1  ILE   2          2HD1      ILE   2  -6.565  -4.281   9.162
   22   3HD1  ILE   2          3HD1      ILE   2  -4.975  -4.503   8.435
   23    H    LEU   3           H        LEU   3  -5.790   0.065   4.276
   24    HA   LEU   3           HA       LEU   3  -3.993  -0.704   2.231
   25   1HB   LEU   3          2HB       LEU   3  -5.760   1.509   2.883
   26   2HB   LEU   3          1HB       LEU   3  -4.299   2.033   2.088
   27    HG   LEU   3           HG       LEU   3  -6.038   1.708   0.459
   28   1HD1  LEU   3          1HD1      LEU   3  -4.009  -0.512   0.306
   29   2HD1  LEU   3          2HD1      LEU   3  -3.773   1.152  -0.233
   30   3HD1  LEU   3          3HD1      LEU   3  -4.952   0.121  -1.044
   31   1HD2  LEU   3          1HD2      LEU   3  -6.201  -1.134   1.457
   32   2HD2  LEU   3          2HD2      LEU   3  -7.079  -0.467   0.080
   33   3HD2  LEU   3          3HD2      LEU   3  -7.414   0.121   1.708
   34    H    TYR   4           H        TYR   4  -3.695   1.142   5.156
   35    HA   TYR   4           HA       TYR   4  -1.583   2.816   4.668
   36   1HB   TYR   4          2HB       TYR   4  -2.893   2.767   6.760
   37   2HB   TYR   4          1HB       TYR   4  -2.083   1.276   7.223
   38    HD1  TYR   4           HD1      TYR   4   0.154   1.309   8.122
   39    HD2  TYR   4           HD2      TYR   4  -1.663   4.900   6.733
   40    HE1  TYR   4           HE1      TYR   4   1.922   2.622   9.218
   41    HE2  TYR   4           HE2      TYR   4   0.098   6.220   7.825
   42    HH   TYR   4           HH       TYR   4   1.699   5.991   9.656
   43    H    ASP   5           H        ASP   5  -1.348  -0.504   5.915
   44    HA   ASP   5           HA       ASP   5   1.478  -0.521   6.001
   45   1HB   ASP   5          2HB       ASP   5  -0.581  -2.730   5.969
   46   2HB   ASP   5          1HB       ASP   5   1.138  -3.040   6.132
   47    H    ALA   6           H        ALA   6  -0.835  -1.878   3.685
   48    HA   ALA   6           HA       ALA   6   0.945  -3.075   1.932
   49   1HB   ALA   6          1HB       ALA   6  -1.478  -3.398   1.837
   50   2HB   ALA   6          2HB       ALA   6  -0.825  -2.944   0.263
   51   3HB   ALA   6          3HB       ALA   6  -1.676  -1.748   1.241
   52    H    ILE   7           H        ILE   7  -0.222   0.276   1.958
   53    HA   ILE   7           HA       ILE   7   0.974   1.002  -0.502
   54    HB   ILE   7           HB       ILE   7   0.186   2.805   1.792
   55   1HG1  ILE   7          2HG1      ILE   7  -1.339   2.056  -0.711
   56   2HG1  ILE   7          1HG1      ILE   7  -1.655   1.404   0.893
   57   1HG2  ILE   7          1HG2      ILE   7   1.712   3.926   0.299
   58   2HG2  ILE   7          2HG2      ILE   7   0.082   4.554   0.049
   59   3HG2  ILE   7          3HG2      ILE   7   0.774   3.411  -1.101
   60   1HD1  ILE   7          1HD1      ILE   7  -1.903   4.292   0.093
   61   2HD1  ILE   7          2HD1      ILE   7  -2.221   3.633   1.697
   62   3HD1  ILE   7          3HD1      ILE   7  -3.233   3.158   0.330
   63    H    MET   8           H        MET   8   2.052   1.463   2.879
   64    HA   MET   8           HA       MET   8   4.377   2.921   2.032
   65   1HB   MET   8          2HB       MET   8   3.710   1.747   4.735
   66   2HB   MET   8          1HB       MET   8   5.064   2.818   4.402
   67   1HG   MET   8          2HG       MET   8   3.292   4.463   3.538
   68   2HG   MET   8          1HG       MET   8   2.135   3.436   4.382
   69   1HE   MET   8          1HE       MET   8   5.843   4.403   5.374
   70   2HE   MET   8          2HE       MET   8   5.545   5.822   6.378
   71   3HE   MET   8          3HE       MET   8   5.155   5.859   4.654
   72    H    TYR   9           H        TYR   9   3.640  -0.402   2.560
   73    HA   TYR   9           HA       TYR   9   6.331  -1.329   2.680
   74   1HB   TYR   9          2HB       TYR   9   4.710  -2.831   3.490
   75   2HB   TYR   9          1HB       TYR   9   3.684  -2.627   2.077
   76    HD1  TYR   9           HD1      TYR   9   3.586  -4.408   0.648
   77    HD2  TYR   9           HD2      TYR   9   7.179  -3.768   2.826
   78    HE1  TYR   9           HE1      TYR   9   4.553  -6.416  -0.376
   79    HE2  TYR   9           HE2      TYR   9   8.161  -5.785   1.809
   80    HH   TYR   9           HH       TYR   9   6.434  -7.564  -0.735
   81    H    LYS  10           H        LYS  10   4.039  -0.684   0.106
   82    HA   LYS  10           HA       LYS  10   5.733  -1.757  -1.955
   83   1HB   LYS  10          2HB       LYS  10   3.269  -1.768  -2.156
   84   2HB   LYS  10          1HB       LYS  10   3.276  -0.011  -2.184
   85   1HG   LYS  10          2HG       LYS  10   3.041  -0.853  -4.420
   86   2HG   LYS  10          1HG       LYS  10   4.614  -0.073  -4.248
   87   1HD   LYS  10          2HD       LYS  10   5.665  -2.260  -3.938
   88   2HD   LYS  10          1HD       LYS  10   4.095  -3.046  -4.117
   89   1HE   LYS  10          2HE       LYS  10   3.920  -2.109  -6.388
   90   2HE   LYS  10          1HE       LYS  10   5.520  -1.395  -6.200
   91   1HZ   LYS  10          1HZ       LYS  10   5.690  -3.434  -7.410
   92   2HZ   LYS  10          2HZ       LYS  10   4.866  -4.290  -6.206
   93   3HZ   LYS  10          3HZ       LYS  10   6.404  -3.652  -5.891
   94    H    TYR  11           H        TYR  11   4.754   1.497  -0.920
   95    HA   TYR  11           HA       TYR  11   6.952   2.595  -2.552
   96   1HB   TYR  11          2HB       TYR  11   4.359   3.940  -1.758
   97   2HB   TYR  11          1HB       TYR  11   5.651   4.679  -2.695
   98    HD1  TYR  11           HD1      TYR  11   6.286   3.449  -4.916
   99    HD2  TYR  11           HD2      TYR  11   2.595   2.910  -2.863
  100    HE1  TYR  11           HE1      TYR  11   5.250   2.645  -6.995
  101    HE2  TYR  11           HE2      TYR  11   1.555   2.094  -4.938
  102    HH   TYR  11           HH       TYR  11   1.912   2.312  -7.388
  103    HA   PRO  12           HA       PRO  12   8.331   3.580   1.669
  104   1HB   PRO  12          2HB       PRO  12  10.921   3.941   0.994
  105   2HB   PRO  12          1HB       PRO  12  10.214   2.341   1.229
  106   1HG   PRO  12          2HG       PRO  12  10.736   3.820  -1.319
  107   2HG   PRO  12          1HG       PRO  12  11.048   2.116  -0.931
  108   1HD   PRO  12          2HD       PRO  12   8.879   2.918  -2.344
  109   2HD   PRO  12          1HD       PRO  12   8.850   1.508  -1.267
  110    H    ASN  13           H        ASN  13   8.388   5.314  -1.255
  111    HA   ASN  13           HA       ASN  13   9.387   7.767  -0.056
  112   1HB   ASN  13          2HB       ASN  13   8.554   7.117  -2.886
  113   2HB   ASN  13          1HB       ASN  13   9.190   8.666  -2.363
  114   1HD2  ASN  13          1HD2      ASN  13  10.236   6.832  -4.335
  115   2HD2  ASN  13          2HD2      ASN  13  11.831   6.404  -3.820
  116    H    ALA  14           H        ALA  14   6.543   6.293   0.097
  117    HA   ALA  14           HA       ALA  14   4.910   8.639  -0.568
  118   1HB   ALA  14          1HB       ALA  14   4.211   6.500  -1.553
  119   2HB   ALA  14          2HB       ALA  14   2.992   7.147  -0.457
  120   3HB   ALA  14          3HB       ALA  14   4.030   5.820   0.062
  121    H    VAL  15           H        VAL  15   4.418   9.973   1.021
  122    HA   VAL  15           HA       VAL  15   4.660   9.042   3.786
  123    HB   VAL  15           HB       VAL  15   4.300  11.864   2.761
  124   1HG1  VAL  15          1HG1      VAL  15   5.097  10.824   5.480
  125   2HG1  VAL  15          2HG1      VAL  15   3.560  11.583   5.069
  126   3HG1  VAL  15          3HG1      VAL  15   5.051  12.522   5.005
  127   1HG2  VAL  15          1HG2      VAL  15   6.806  10.423   3.621
  128   2HG2  VAL  15          2HG2      VAL  15   6.694  12.138   3.233
  129   3HG2  VAL  15          3HG2      VAL  15   6.408  10.929   1.979
  130    H    SER  16           H        SER  16   2.963   8.729   5.074
  131    HA   SER  16           HA       SER  16   0.329   8.799   4.033
  132   1HB   SER  16          2HB       SER  16   1.117   7.183   5.774
  133   2HB   SER  16          1HB       SER  16   1.166   8.513   6.930
  134    HG   SER  16           HG       SER  16  -0.816   7.753   7.245
  135    H    ARG  17           H        ARG  17  -1.311  10.164   4.370
  136    HA   ARG  17           HA       ARG  17  -2.435  12.075   4.708
  137   1HB   ARG  17          2HB       ARG  17  -0.559  12.387   7.048
  138   2HB   ARG  17          1HB       ARG  17  -1.935  13.440   6.739
  139   1HG   ARG  17          2HG       ARG  17  -3.398  11.418   6.821
  140   2HG   ARG  17          1HG       ARG  17  -1.987  10.496   7.347
  141   1HD   ARG  17          2HD       ARG  17  -1.760  11.964   9.291
  142   2HD   ARG  17          1HD       ARG  17  -3.170  12.883   8.766
  143    HE   ARG  17           HE       ARG  17  -3.241  10.051   9.611
  144   1HH1  ARG  17          1HH1      ARG  17  -4.754  13.196   9.235
  145   2HH1  ARG  17          2HH1      ARG  17  -6.175  12.763  10.144
  146   1HH2  ARG  17          1HH2      ARG  17  -5.098   9.477  10.817
  147   2HH2  ARG  17          2HH2      ARG  17  -6.372  10.640  11.049
  148    H    LYS  18           H        LYS  18   0.565  11.948   3.568
  149    HA   LYS  18           HA       LYS  18   0.525  14.797   2.845
  150   1HB   LYS  18          2HB       LYS  18   2.698  14.210   3.681
  151   2HB   LYS  18          1HB       LYS  18   2.748  12.754   2.693
  152   1HG   LYS  18          2HG       LYS  18   2.810  14.154   0.666
  153   2HG   LYS  18          1HG       LYS  18   2.820  15.595   1.682
  154   1HD   LYS  18          2HD       LYS  18   4.943  14.969   2.636
  155   2HD   LYS  18          1HD       LYS  18   4.918  13.431   1.765
  156   1HE   LYS  18          2HE       LYS  18   4.854  16.106   0.383
  157   2HE   LYS  18          1HE       LYS  18   6.355  15.266   0.764
  158   1HZ   LYS  18          1HZ       LYS  18   5.505  14.899  -1.535
  159   2HZ   LYS  18          2HZ       LYS  18   4.181  14.068  -0.878
  160   3HZ   LYS  18          3HZ       LYS  18   5.750  13.473  -0.654
  161    H    ASP  19           H        ASP  19   1.402  11.682   1.381
  162    HA   ASP  19           HA       ASP  19   0.522  12.683  -1.214
  163   1HB   ASP  19          2HB       ASP  19   1.981  10.135  -0.476
  164   2HB   ASP  19          1HB       ASP  19   1.634  10.675  -2.118
  165    H    PHE  20           H        PHE  20  -0.419  10.450   1.253
  166    HA   PHE  20           HA       PHE  20  -2.915  10.000  -0.161
  167   1HB   PHE  20          2HB       PHE  20  -2.867   7.574   0.168
  168   2HB   PHE  20          1HB       PHE  20  -1.521   8.086  -0.840
  169    HD1  PHE  20           HD1      PHE  20  -2.522   6.482   2.234
  170    HD2  PHE  20           HD2      PHE  20   0.776   8.160   0.131
  171    HE1  PHE  20           HE1      PHE  20  -0.971   5.315   3.744
  172    HE2  PHE  20           HE2      PHE  20   2.331   6.994   1.639
  173    HZ   PHE  20           HZ       PHE  20   1.460   5.570   3.446
  174    H    GLU  21           H        GLU  21  -4.606  10.094   1.204
  175    HA   GLU  21           HA       GLU  21  -4.052   9.702   4.073
  176   1HB   GLU  21          2HB       GLU  21  -4.543  12.080   3.421
  177   2HB   GLU  21          1HB       GLU  21  -6.144  11.552   2.924
  178   1HG   GLU  21          2HG       GLU  21  -6.711  10.931   5.152
  179   2HG   GLU  21          1HG       GLU  21  -5.059  11.200   5.702
  180    H    LEU  22           H        LEU  22  -5.423   8.420   5.204
  181    HA   LEU  22           HA       LEU  22  -7.018   6.665   3.502
  182   1HB   LEU  22          2HB       LEU  22  -6.171   6.210   6.351
  183   2HB   LEU  22          1HB       LEU  22  -6.768   5.020   5.212
  184    HG   LEU  22           HG       LEU  22  -4.128   6.468   4.981
  185   1HD1  LEU  22          1HD1      LEU  22  -3.169   4.286   5.553
  186   2HD1  LEU  22          2HD1      LEU  22  -4.792   3.655   5.827
  187   3HD1  LEU  22          3HD1      LEU  22  -4.159   4.938   6.857
  188   1HD2  LEU  22          1HD2      LEU  22  -5.079   5.838   2.813
  189   2HD2  LEU  22          2HD2      LEU  22  -5.277   4.179   3.383
  190   3HD2  LEU  22          3HD2      LEU  22  -3.662   4.865   3.207
  191    H    ARG  23           H        ARG  23  -9.044   5.913   4.113
  192    HA   ARG  23           HA       ARG  23 -10.413   7.249   6.328
  193   1HB   ARG  23          2HB       ARG  23 -10.904   7.794   3.578
  194   2HB   ARG  23          1HB       ARG  23 -12.277   6.890   4.203
  195   1HG   ARG  23          2HG       ARG  23 -12.709   9.224   4.460
  196   2HG   ARG  23          1HG       ARG  23 -12.449   8.524   6.053
  197   1HD   ARG  23          2HD       ARG  23 -10.495   9.630   6.383
  198   2HD   ARG  23          1HD       ARG  23 -10.065   9.601   4.674
  199    HE   ARG  23           HE       ARG  23 -11.988  11.343   4.543
  200   1HH1  ARG  23          1HH1      ARG  23  -9.665  11.019   7.153
  201   2HH1  ARG  23          2HH1      ARG  23  -9.604  12.726   7.476
  202   1HH2  ARG  23          1HH2      ARG  23 -11.924  13.585   4.985
  203   2HH2  ARG  23          2HH2      ARG  23 -10.900  14.179   6.261
  204    H    ASN  24           H        ASN  24 -12.480   6.125   6.845
  205    HA   ASN  24           HA       ASN  24 -11.995   3.239   6.596
  206   1HB   ASN  24          2HB       ASN  24 -12.184   4.452   8.858
  207   2HB   ASN  24          1HB       ASN  24 -13.906   4.557   8.517
  208   1HD2  ASN  24          1HD2      ASN  24 -12.503   3.187  10.642
  209   2HD2  ASN  24          2HD2      ASN  24 -12.976   1.531  10.523
  210    H    ASP  25           H        ASP  25 -13.398   1.912   5.621
  211    HA   ASP  25           HA       ASP  25 -15.868   3.047   4.517
  212   1HB   ASP  25          2HB       ASP  25 -14.457   1.920   2.889
  213   2HB   ASP  25          1HB       ASP  25 -14.406   0.470   3.887
  214    H    GLY  26           H        GLY  26 -14.647   0.405   6.477
  215   1HA   GLY  26          2HA       GLY  26 -16.761   0.229   8.236
  216   2HA   GLY  26          1HA       GLY  26 -17.155  -0.863   6.911
  217    H    ASN  27           H        ASN  27 -15.131  -2.226   6.231
  218    HA   ASN  27           HA       ASN  27 -14.053  -3.400   8.720
  219   1HB   ASN  27          2HB       ASN  27 -15.654  -4.793   7.339
  220   2HB   ASN  27          1HB       ASN  27 -14.448  -4.788   6.059
  221   1HD2  ASN  27          1HD2      ASN  27 -14.184  -7.000   6.108
  222   2HD2  ASN  27          2HD2      ASN  27 -13.384  -7.826   7.403
  223    H    GLY  28           H        GLY  28 -13.033  -1.239   6.800
  224   1HA   GLY  28          2HA       GLY  28 -10.292  -1.978   6.918
  225   2HA   GLY  28          1HA       GLY  28 -10.900  -2.105   5.273
  226    H    SER  29           H        SER  29  -8.856  -0.400   5.907
  227    HA   SER  29           HA       SER  29 -10.116   2.257   5.735
  228   1HB   SER  29          2HB       SER  29  -7.304   1.616   6.656
  229   2HB   SER  29          1HB       SER  29  -8.096   3.193   6.695
  230    HG   SER  29           HG       SER  29  -9.690   1.588   7.989
  231    H    TYR  30           H        TYR  30 -10.036   3.076   3.755
  232    HA   TYR  30           HA       TYR  30  -7.937   2.121   1.924
  233   1HB   TYR  30          2HB       TYR  30  -9.512   2.419   0.090
  234   2HB   TYR  30          1HB       TYR  30 -10.202   1.357   1.311
  235    HD1  TYR  30           HD1      TYR  30 -10.717   4.254  -0.676
  236    HD2  TYR  30           HD2      TYR  30 -11.831   2.451   3.014
  237    HE1  TYR  30           HE1      TYR  30 -12.718   5.677  -0.590
  238    HE2  TYR  30           HE2      TYR  30 -13.835   3.873   3.108
  239    HH   TYR  30           HH       TYR  30 -14.997   5.571   0.472
  240    H    ILE  31           H        ILE  31  -8.084   3.853  -0.119
  241    HA   ILE  31           HA       ILE  31  -6.949   6.242   1.116
  242    HB   ILE  31           HB       ILE  31  -7.022   5.515  -1.815
  243   1HG1  ILE  31          2HG1      ILE  31  -4.776   5.011   0.146
  244   2HG1  ILE  31          1HG1      ILE  31  -5.910   3.773  -0.378
  245   1HG2  ILE  31          1HG2      ILE  31  -6.555   7.865  -1.360
  246   2HG2  ILE  31          2HG2      ILE  31  -5.116   7.048  -1.973
  247   3HG2  ILE  31          3HG2      ILE  31  -5.262   7.400  -0.251
  248   1HD1  ILE  31          1HD1      ILE  31  -5.157   4.081  -2.691
  249   2HD1  ILE  31          2HD1      ILE  31  -3.842   3.608  -1.614
  250   3HD1  ILE  31          3HD1      ILE  31  -3.996   5.285  -2.134
  251    H    GLU  32           H        GLU  32  -8.031   8.110   1.282
  252    HA   GLU  32           HA       GLU  32 -10.258   8.607  -0.573
  253   1HB   GLU  32          2HB       GLU  32 -10.765   8.811   1.855
  254   2HB   GLU  32          1HB       GLU  32  -9.563  10.093   1.970
  255   1HG   GLU  32          2HG       GLU  32 -10.883  11.357   0.258
  256   2HG   GLU  32          1HG       GLU  32 -12.133  10.126   0.408
  257    H    LYS  33           H        LYS  33  -7.564  10.318   0.996
  258    HA   LYS  33           HA       LYS  33  -7.524  12.303  -1.117
  259   1HB   LYS  33          2HB       LYS  33  -6.147  11.968   1.504
  260   2HB   LYS  33          1HB       LYS  33  -5.367  12.961   0.285
  261   1HG   LYS  33          2HG       LYS  33  -8.135  13.388   1.373
  262   2HG   LYS  33          1HG       LYS  33  -6.697  14.300   1.817
  263   1HD   LYS  33          2HD       LYS  33  -6.580  14.620  -0.811
  264   2HD   LYS  33          1HD       LYS  33  -8.314  14.378  -0.654
  265   1HE   LYS  33          2HE       LYS  33  -6.642  16.487   0.694
  266   2HE   LYS  33          1HE       LYS  33  -7.868  16.731  -0.548
  267   1HZ   LYS  33          1HZ       LYS  33  -8.811  17.284   1.536
  268   2HZ   LYS  33          2HZ       LYS  33  -8.289  15.837   2.247
  269   3HZ   LYS  33          3HZ       LYS  33  -9.504  15.808   1.062
  270    H    TRP  34           H        TRP  34  -6.741  11.514  -2.988
  271    HA   TRP  34           HA       TRP  34  -4.157  10.124  -2.921
  272   1HB   TRP  34          2HB       TRP  34  -6.138   9.201  -4.248
  273   2HB   TRP  34          1HB       TRP  34  -5.917  10.565  -5.337
  274    HD1  TRP  34           HD1      TRP  34  -4.673   9.820  -7.436
  275    HE1  TRP  34           HE1      TRP  34  -2.778   8.165  -7.986
  276    HE3  TRP  34           HE3      TRP  34  -3.790   8.003  -2.736
  277    HZ2  TRP  34           HZ2      TRP  34  -1.132   6.338  -6.613
  278    HZ3  TRP  34           HZ3      TRP  34  -2.041   6.298  -2.445
  279    HH2  TRP  34           HH2      TRP  34  -0.740   5.484  -4.346
  280    H    ASN  35           H        ASN  35  -2.451  11.425  -3.034
  281    HA   ASN  35           HA       ASN  35  -2.712  13.957  -4.529
  282   1HB   ASN  35          2HB       ASN  35  -0.946  13.344  -2.147
  283   2HB   ASN  35          1HB       ASN  35  -1.050  14.888  -2.980
  284   1HD2  ASN  35          1HD2      ASN  35  -2.619  12.696  -0.796
  285   2HD2  ASN  35          2HD2      ASN  35  -3.816  13.804  -0.224
  286    H    LEU  36           H        LEU  36  -1.730  11.132  -5.212
  287    HA   LEU  36           HA       LEU  36   0.976  11.840  -6.106
  288   1HB   LEU  36          2HB       LEU  36  -0.375   9.168  -5.755
  289   2HB   LEU  36          1HB       LEU  36   1.161   9.360  -6.573
  290    HG   LEU  36           HG       LEU  36   0.657  10.126  -3.707
  291   1HD1  LEU  36          1HD1      LEU  36   2.033   7.696  -4.844
  292   2HD1  LEU  36          2HD1      LEU  36   0.483   7.712  -4.002
  293   3HD1  LEU  36          3HD1      LEU  36   1.960   8.138  -3.139
  294   1HD2  LEU  36          1HD2      LEU  36   2.433  11.413  -4.742
  295   2HD2  LEU  36          2HD2      LEU  36   3.191   9.933  -5.324
  296   3HD2  LEU  36          3HD2      LEU  36   3.106  10.256  -3.594
  297    H    ARG  37           H        ARG  37   1.562  11.530  -8.266
  298    HA   ARG  37           HA       ARG  37  -0.653  11.682 -10.151
  299   1HB   ARG  37          2HB       ARG  37   2.309  11.861 -10.711
  300   2HB   ARG  37          1HB       ARG  37   1.005  12.328 -11.792
  301   1HG   ARG  37          2HG       ARG  37   0.364  14.100 -10.213
  302   2HG   ARG  37          1HG       ARG  37   1.732  13.655  -9.191
  303   1HD   ARG  37          2HD       ARG  37   3.196  14.060 -11.219
  304   2HD   ARG  37          1HD       ARG  37   1.782  14.796 -11.974
  305    HE   ARG  37           HE       ARG  37   2.616  15.807  -9.371
  306   1HH1  ARG  37          1HH1      ARG  37   2.445  16.264 -12.839
  307   2HH1  ARG  37          2HH1      ARG  37   2.870  17.947 -12.767
  308   1HH2  ARG  37          1HH2      ARG  37   3.135  18.017  -9.263
  309   2HH2  ARG  37          2HH2      ARG  37   3.218  18.957 -10.726
  310    H    ALA  38           H        ALA  38  -0.329   9.245  -8.876
  311    HA   ALA  38           HA       ALA  38   0.752   7.485 -10.978
  312   1HB   ALA  38          1HB       ALA  38   2.002   7.297  -8.897
  313   2HB   ALA  38          2HB       ALA  38   1.102   5.813  -9.216
  314   3HB   ALA  38          3HB       ALA  38   0.511   6.963  -8.015
  315    HA   PRO  39           HA       PRO  39  -3.390   5.916 -11.527
  316   1HB   PRO  39          2HB       PRO  39  -2.078   3.401 -12.333
  317   2HB   PRO  39          1HB       PRO  39  -3.136   4.461 -13.266
  318   1HG   PRO  39          2HG       PRO  39  -0.505   4.282 -13.759
  319   2HG   PRO  39          1HG       PRO  39  -1.402   5.798 -13.967
  320   1HD   PRO  39          2HD       PRO  39   0.415   4.955 -11.742
  321   2HD   PRO  39          1HD       PRO  39   0.231   6.548 -12.504
  322    H    LEU  40           H        LEU  40  -4.799   4.764 -10.311
  323    HA   LEU  40           HA       LEU  40  -3.956   3.635  -7.868
  324   1HB   LEU  40          2HB       LEU  40  -6.556   3.731  -9.353
  325   2HB   LEU  40          1HB       LEU  40  -6.403   2.744  -7.921
  326    HG   LEU  40           HG       LEU  40  -7.396   4.824  -7.292
  327   1HD1  LEU  40          1HD1      LEU  40  -4.505   4.758  -6.465
  328   2HD1  LEU  40          2HD1      LEU  40  -5.845   3.922  -5.679
  329   3HD1  LEU  40          3HD1      LEU  40  -5.774   5.686  -5.668
  330   1HD2  LEU  40          1HD2      LEU  40  -6.285   6.979  -7.644
  331   2HD2  LEU  40          2HD2      LEU  40  -6.689   6.194  -9.171
  332   3HD2  LEU  40          3HD2      LEU  40  -5.027   6.171  -8.582
  333    HA   PRO  41           HA       PRO  41  -3.020  -0.477  -9.268
  334   1HB   PRO  41          2HB       PRO  41  -3.135  -1.430  -6.553
  335   2HB   PRO  41          1HB       PRO  41  -1.710  -1.090  -7.535
  336   1HG   PRO  41          2HG       PRO  41  -2.438   0.366  -5.331
  337   2HG   PRO  41          1HG       PRO  41  -1.448   0.997  -6.656
  338   1HD   PRO  41          2HD       PRO  41  -4.365   1.384  -6.115
  339   2HD   PRO  41          1HD       PRO  41  -3.163   2.531  -6.734
  340    H    THR  42           H        THR  42  -3.696  -2.788  -8.429
  341    HA   THR  42           HA       THR  42  -6.632  -2.832  -8.606
  342    HB   THR  42           HB       THR  42  -6.398  -5.109  -9.510
  343    HG1  THR  42           HG1      THR  42  -4.079  -5.612 -10.144
  344   1HG2  THR  42          1HG2      THR  42  -6.410  -3.210 -11.054
  345   2HG2  THR  42          2HG2      THR  42  -5.386  -4.507 -11.664
  346   3HG2  THR  42          3HG2      THR  42  -4.656  -3.083 -10.923
  347    H    GLN  43           H        GLN  43  -7.600  -4.909  -7.592
  348    HA   GLN  43           HA       GLN  43  -7.172  -4.840  -4.852
  349   1HB   GLN  43          2HB       GLN  43  -8.740  -6.463  -6.733
  350   2HB   GLN  43          1HB       GLN  43  -8.511  -7.103  -5.132
  351   1HG   GLN  43          2HG       GLN  43  -9.868  -4.565  -5.943
  352   2HG   GLN  43          1HG       GLN  43 -10.556  -5.945  -5.087
  353   1HE2  GLN  43          1HE2      GLN  43  -9.928  -6.291  -2.885
  354   2HE2  GLN  43          2HE2      GLN  43  -9.385  -4.957  -1.925
  355    H    ALA  44           H        ALA  44  -6.310  -7.285  -7.273
  356    HA   ALA  44           HA       ALA  44  -5.024  -9.108  -5.635
  357   1HB   ALA  44          1HB       ALA  44  -5.499  -9.521  -8.003
  358   2HB   ALA  44          2HB       ALA  44  -3.803  -9.827  -7.627
  359   3HB   ALA  44          3HB       ALA  44  -4.266  -8.341  -8.457
  360    H    GLU  45           H        GLU  45  -3.716  -6.212  -7.204
  361    HA   GLU  45           HA       GLU  45  -1.066  -6.439  -6.374
  362   1HB   GLU  45          2HB       GLU  45  -2.806  -4.188  -7.200
  363   2HB   GLU  45          1HB       GLU  45  -1.212  -3.844  -6.535
  364   1HG   GLU  45          2HG       GLU  45  -1.764  -5.675  -8.851
  365   2HG   GLU  45          1HG       GLU  45  -1.209  -4.023  -8.954
  366    H    LEU  46           H        LEU  46  -3.711  -4.573  -4.875
  367    HA   LEU  46           HA       LEU  46  -2.315  -3.633  -2.662
  368   1HB   LEU  46          2HB       LEU  46  -5.237  -4.365  -2.865
  369   2HB   LEU  46          1HB       LEU  46  -4.524  -3.355  -1.627
  370    HG   LEU  46           HG       LEU  46  -4.620  -2.687  -4.564
  371   1HD1  LEU  46          1HD1      LEU  46  -6.261  -1.005  -3.916
  372   2HD1  LEU  46          2HD1      LEU  46  -6.202  -1.582  -2.251
  373   3HD1  LEU  46          3HD1      LEU  46  -6.825  -2.631  -3.523
  374   1HD2  LEU  46          1HD2      LEU  46  -3.874  -0.463  -3.847
  375   2HD2  LEU  46          2HD2      LEU  46  -2.680  -1.708  -3.481
  376   3HD2  LEU  46          3HD2      LEU  46  -3.703  -1.062  -2.197
  377    H    GLU  47           H        GLU  47  -4.232  -6.601  -3.029
  378    HA   GLU  47           HA       GLU  47  -3.937  -7.395  -0.328
  379   1HB   GLU  47          2HB       GLU  47  -4.717  -8.961  -2.782
  380   2HB   GLU  47          1HB       GLU  47  -4.780  -9.602  -1.143
  381   1HG   GLU  47          2HG       GLU  47  -6.356  -7.834  -0.522
  382   2HG   GLU  47          1HG       GLU  47  -6.311  -7.224  -2.175
  383    H    THR  48           H        THR  48  -1.967  -7.937  -3.195
  384    HA   THR  48           HA       THR  48  -0.462 -10.098  -2.116
  385    HB   THR  48           HB       THR  48   0.367  -8.071  -4.215
  386    HG1  THR  48           HG1      THR  48  -1.453  -9.262  -4.863
  387   1HG2  THR  48          1HG2      THR  48   2.277  -9.261  -3.223
  388   2HG2  THR  48          2HG2      THR  48   2.010  -9.736  -4.901
  389   3HG2  THR  48          3HG2      THR  48   1.499 -10.799  -3.588
  390    H    TRP  49           H        TRP  49   0.034  -6.577  -2.131
  391    HA   TRP  49           HA       TRP  49   2.527  -6.569  -0.837
  392   1HB   TRP  49          2HB       TRP  49   0.367  -4.465  -0.559
  393   2HB   TRP  49          1HB       TRP  49   2.097  -4.244  -0.325
  394    HD1  TRP  49           HD1      TRP  49   2.732  -5.970  -3.135
  395    HE1  TRP  49           HE1      TRP  49   2.488  -4.675  -5.345
  396    HE3  TRP  49           HE3      TRP  49  -0.182  -2.112  -1.486
  397    HZ2  TRP  49           HZ2      TRP  49   1.228  -2.318  -6.262
  398    HZ3  TRP  49           HZ3      TRP  49  -0.855  -0.374  -3.092
  399    HH2  TRP  49           HH2      TRP  49  -0.163  -0.475  -5.431
  400    H    TRP  50           H        TRP  50  -0.761  -6.383   0.437
  401    HA   TRP  50           HA       TRP  50  -0.154  -6.227   3.152
  402   1HB   TRP  50          2HB       TRP  50  -2.392  -5.823   2.275
  403   2HB   TRP  50          1HB       TRP  50  -2.525  -7.504   1.774
  404    HD1  TRP  50           HD1      TRP  50  -3.796  -9.004   3.406
  405    HE1  TRP  50           HE1      TRP  50  -4.424  -8.914   5.903
  406    HE3  TRP  50           HE3      TRP  50  -1.298  -4.734   4.716
  407    HZ2  TRP  50           HZ2      TRP  50  -3.913  -7.256   8.133
  408    HZ3  TRP  50           HZ3      TRP  50  -1.420  -3.968   7.049
  409    HH2  TRP  50           HH2      TRP  50  -2.701  -5.203   8.719
  410    H    GLU  51           H        GLU  51  -0.719  -9.080   1.108
  411    HA   GLU  51           HA       GLU  51  -0.409 -10.978   3.153
  412   1HB   GLU  51          2HB       GLU  51  -0.628 -10.970   0.224
  413   2HB   GLU  51          1HB       GLU  51   0.225 -12.350   0.895
  414   1HG   GLU  51          2HG       GLU  51  -1.723 -12.677   2.436
  415   2HG   GLU  51          1HG       GLU  51  -2.566 -11.436   1.518
  416    H    GLU  52           H        GLU  52   1.932  -9.638   0.824
  417    HA   GLU  52           HA       GLU  52   4.079 -11.290   1.530
  418   1HB   GLU  52          2HB       GLU  52   4.048  -8.460   0.494
  419   2HB   GLU  52          1HB       GLU  52   5.529  -9.365   0.761
  420   1HG   GLU  52          2HG       GLU  52   4.702 -11.094  -0.801
  421   2HG   GLU  52          1HG       GLU  52   3.313 -10.069  -1.137
  422    H    LEU  53           H        LEU  53   2.934  -8.261   2.927
  423    HA   LEU  53           HA       LEU  53   5.054  -7.882   4.746
  424   1HB   LEU  53          2HB       LEU  53   3.387  -6.165   4.027
  425   2HB   LEU  53          1HB       LEU  53   2.187  -6.969   5.015
  426    HG   LEU  53           HG       LEU  53   4.707  -6.021   6.311
  427   1HD1  LEU  53          1HD1      LEU  53   3.954  -4.135   4.945
  428   2HD1  LEU  53          2HD1      LEU  53   3.719  -3.826   6.664
  429   3HD1  LEU  53          3HD1      LEU  53   2.346  -4.271   5.651
  430   1HD2  LEU  53          1HD2      LEU  53   3.116  -7.326   7.622
  431   2HD2  LEU  53          2HD2      LEU  53   1.826  -6.200   7.197
  432   3HD2  LEU  53          3HD2      LEU  53   3.174  -5.661   8.197
  433    H    GLN  54           H        GLN  54   1.944  -9.550   5.046
  434    HA   GLN  54           HA       GLN  54   2.180 -10.162   7.800
  435   1HB   GLN  54          2HB       GLN  54   0.560 -11.450   5.603
  436   2HB   GLN  54          1HB       GLN  54   0.367 -11.788   7.309
  437   1HG   GLN  54          2HG       GLN  54   0.009  -9.069   6.093
  438   2HG   GLN  54          1HG       GLN  54  -1.306 -10.211   6.355
  439   1HE2  GLN  54          1HE2      GLN  54   0.967  -8.062   7.847
  440   2HE2  GLN  54          2HE2      GLN  54   0.241  -8.042   9.414
  441    H    LYS  55           H        LYS  55   3.178 -11.782   4.851
  442    HA   LYS  55           HA       LYS  55   3.895 -14.218   6.283
  443   1HB   LYS  55          2HB       LYS  55   2.758 -13.967   3.932
  444   2HB   LYS  55          1HB       LYS  55   4.414 -13.772   3.376
  445   1HG   LYS  55          2HG       LYS  55   5.008 -15.930   4.267
  446   2HG   LYS  55          1HG       LYS  55   3.390 -16.130   4.940
  447   1HD   LYS  55          2HD       LYS  55   2.467 -15.971   2.648
  448   2HD   LYS  55          1HD       LYS  55   4.115 -15.902   2.025
  449   1HE   LYS  55          2HE       LYS  55   4.570 -18.108   2.956
  450   2HE   LYS  55          1HE       LYS  55   2.941 -18.171   3.627
  451   1HZ   LYS  55          1HZ       LYS  55   2.054 -18.071   1.374
  452   2HZ   LYS  55          2HZ       LYS  55   3.075 -19.411   1.566
  453   3HZ   LYS  55          3HZ       LYS  55   3.626 -18.036   0.737
  454    H    ASN  56           H        ASN  56   5.315 -11.370   6.013
  455    HA   ASN  56           HA       ASN  56   8.013 -12.287   5.374
  456   1HB   ASN  56          2HB       ASN  56   7.225 -10.090   4.511
  457   2HB   ASN  56          1HB       ASN  56   7.030  -9.531   6.166
  458   1HD2  ASN  56          1HD2      ASN  56   8.509  -7.932   6.181
  459   2HD2  ASN  56          2HD2      ASN  56  10.207  -8.166   5.942
  460    HA   PRO  57           HA       PRO  57   9.022 -13.194   9.662
  461   1HB   PRO  57          2HB       PRO  57  11.695 -12.361   8.602
  462   2HB   PRO  57          1HB       PRO  57  11.259 -13.777   9.569
  463   1HG   PRO  57          2HG       PRO  57  11.708 -14.027   6.969
  464   2HG   PRO  57          1HG       PRO  57  10.385 -14.919   7.743
  465   1HD   PRO  57          2HD       PRO  57  10.279 -12.494   6.008
  466   2HD   PRO  57          1HD       PRO  57   9.142 -13.852   6.125
  467    HA   PRO  58           HA       PRO  58   8.992  -9.399  11.815
  468   1HB   PRO  58          2HB       PRO  58  10.957  -9.796  13.730
  469   2HB   PRO  58          1HB       PRO  58   9.290 -10.367  13.844
  470   1HG   PRO  58          2HG       PRO  58  11.747 -11.839  12.992
  471   2HG   PRO  58          1HG       PRO  58  10.388 -12.402  13.986
  472   1HD   PRO  58          2HD       PRO  58  10.609 -13.105  11.415
  473   2HD   PRO  58          1HD       PRO  58   9.026 -12.754  12.137
  474    H    TYR  59           H        TYR  59  10.059  -7.451  12.234
  475    HA   TYR  59           HA       TYR  59  12.240  -6.898  10.418
  476   1HB   TYR  59          2HB       TYR  59  10.452  -5.291  10.496
  477   2HB   TYR  59          1HB       TYR  59  10.569  -5.160  12.246
  478    HD1  TYR  59           HD1      TYR  59  12.431  -4.447   9.099
  479    HD2  TYR  59           HD2      TYR  59  11.925  -3.518  13.224
  480    HE1  TYR  59           HE1      TYR  59  13.943  -2.525   8.847
  481    HE2  TYR  59           HE2      TYR  59  13.437  -1.594  12.981
  482    HH   TYR  59           HH       TYR  59  15.248  -0.862  11.499
  483    H    GLU  60           H        GLU  60  14.300  -6.271  10.981
  484    HA   GLU  60           HA       GLU  60  15.132  -6.958  13.688
  485   1HB   GLU  60          2HB       GLU  60  16.443  -7.896  11.882
  486   2HB   GLU  60          1HB       GLU  60  16.714  -6.299  11.201
  487   1HG   GLU  60          2HG       GLU  60  17.925  -5.701  13.309
  488   2HG   GLU  60          1HG       GLU  60  17.804  -7.397  13.780
  Start of MODEL   14
    1   1H    MET   1          1H        MET   1  -8.762  -4.715   7.255
    2   2H    MET   1          2H        MET   1  -9.200  -5.963   6.194
    3   3H    MET   1          3H        MET   1  -9.798  -4.398   5.950
    4    HA   MET   1           HA       MET   1  -6.971  -5.254   5.714
    5   1HB   MET   1          2HB       MET   1  -8.792  -5.791   3.904
    6   2HB   MET   1          1HB       MET   1  -8.671  -4.078   3.535
    7   1HG   MET   1          2HG       MET   1  -6.348  -5.995   3.493
    8   2HG   MET   1          1HG       MET   1  -7.298  -5.535   2.084
    9   1HE   MET   1          1HE       MET   1  -5.210  -4.733   0.727
   10   2HE   MET   1          2HE       MET   1  -4.184  -5.267   2.058
   11   3HE   MET   1          3HE       MET   1  -3.971  -3.655   1.374
   12    H    ILE   2           H        ILE   2  -5.512  -3.669   5.916
   13    HA   ILE   2           HA       ILE   2  -6.524  -0.905   6.057
   14    HB   ILE   2           HB       ILE   2  -3.956  -1.839   7.348
   15   1HG1  ILE   2          2HG1      ILE   2  -5.473  -1.529   9.503
   16   2HG1  ILE   2          1HG1      ILE   2  -6.757  -1.979   8.387
   17   1HG2  ILE   2          1HG2      ILE   2  -5.703   0.578   7.823
   18   2HG2  ILE   2          2HG2      ILE   2  -4.188   0.553   6.919
   19   3HG2  ILE   2          3HG2      ILE   2  -4.186   0.212   8.648
   20   1HD1  ILE   2          1HD1      ILE   2  -4.313  -3.611   9.035
   21   2HD1  ILE   2          2HD1      ILE   2  -5.559  -4.053   7.866
   22   3HD1  ILE   2          3HD1      ILE   2  -5.963  -3.915   9.576
   23    H    LEU   3           H        LEU   3  -5.941   0.271   4.338
   24    HA   LEU   3           HA       LEU   3  -4.056  -0.526   2.414
   25   1HB   LEU   3          2HB       LEU   3  -5.841   1.708   2.934
   26   2HB   LEU   3          1HB       LEU   3  -4.356   2.219   2.176
   27    HG   LEU   3           HG       LEU   3  -6.056   1.820   0.504
   28   1HD1  LEU   3          1HD1      LEU   3  -4.859   0.263  -0.929
   29   2HD1  LEU   3          2HD1      LEU   3  -3.955  -0.334   0.461
   30   3HD1  LEU   3          3HD1      LEU   3  -3.736   1.330  -0.082
   31   1HD2  LEU   3          1HD2      LEU   3  -6.978  -0.421   0.140
   32   2HD2  LEU   3          2HD2      LEU   3  -7.420   0.214   1.725
   33   3HD2  LEU   3          3HD2      LEU   3  -6.142  -0.992   1.584
   34    H    TYR   4           H        TYR   4  -3.846   1.472   5.253
   35    HA   TYR   4           HA       TYR   4  -1.506   2.876   4.862
   36   1HB   TYR   4          2HB       TYR   4  -2.902   3.245   6.808
   37   2HB   TYR   4          1HB       TYR   4  -2.575   1.621   7.399
   38    HD1  TYR   4           HD1      TYR   4  -1.022   4.939   6.780
   39    HD2  TYR   4           HD2      TYR   4  -0.683   1.174   8.738
   40    HE1  TYR   4           HE1      TYR   4   0.850   5.808   8.118
   41    HE2  TYR   4           HE2      TYR   4   1.192   2.030  10.076
   42    HH   TYR   4           HH       TYR   4   2.895   3.801   9.951
   43    H    ASP   5           H        ASP   5  -1.870  -0.401   6.178
   44    HA   ASP   5           HA       ASP   5   0.841  -0.873   6.687
   45   1HB   ASP   5          2HB       ASP   5  -1.463  -2.740   6.142
   46   2HB   ASP   5          1HB       ASP   5   0.147  -3.314   6.552
   47    H    ALA   6           H        ALA   6  -1.138  -1.814   3.900
   48    HA   ALA   6           HA       ALA   6   0.866  -3.100   2.441
   49   1HB   ALA   6          1HB       ALA   6  -1.515  -3.289   1.918
   50   2HB   ALA   6          2HB       ALA   6  -0.580  -2.803   0.502
   51   3HB   ALA   6          3HB       ALA   6  -1.534  -1.610   1.384
   52    H    ILE   7           H        ILE   7  -0.178   0.300   2.343
   53    HA   ILE   7           HA       ILE   7   1.597   1.055   0.267
   54    HB   ILE   7           HB       ILE   7   0.292   2.784   2.375
   55   1HG1  ILE   7          2HG1      ILE   7  -0.546   2.259  -0.488
   56   2HG1  ILE   7          1HG1      ILE   7  -1.260   1.467   0.915
   57   1HG2  ILE   7          1HG2      ILE   7   1.593   3.530  -0.246
   58   2HG2  ILE   7          2HG2      ILE   7   2.202   3.899   1.367
   59   3HG2  ILE   7          3HG2      ILE   7   0.702   4.633   0.803
   60   1HD1  ILE   7          1HD1      ILE   7  -1.310   4.421   0.326
   61   2HD1  ILE   7          2HD1      ILE   7  -2.019   3.640   1.739
   62   3HD1  ILE   7          3HD1      ILE   7  -2.650   3.291   0.130
   63    H    MET   8           H        MET   8   1.796   1.285   3.813
   64    HA   MET   8           HA       MET   8   4.239   2.722   3.858
   65   1HB   MET   8          2HB       MET   8   2.611   2.560   5.759
   66   2HB   MET   8          1HB       MET   8   3.141   0.905   6.010
   67   1HG   MET   8          2HG       MET   8   4.467   1.907   7.533
   68   2HG   MET   8          1HG       MET   8   5.514   2.088   6.131
   69   1HE   MET   8          1HE       MET   8   4.776   5.846   5.124
   70   2HE   MET   8          2HE       MET   8   3.914   4.427   4.527
   71   3HE   MET   8          3HE       MET   8   5.666   4.384   4.703
   72    H    TYR   9           H        TYR   9   3.453  -0.676   3.728
   73    HA   TYR   9           HA       TYR   9   5.993  -1.721   4.329
   74   1HB   TYR   9          2HB       TYR   9   4.284  -3.303   4.379
   75   2HB   TYR   9          1HB       TYR   9   3.595  -2.755   2.857
   76    HD1  TYR   9           HD1      TYR   9   6.789  -4.282   4.113
   77    HD2  TYR   9           HD2      TYR   9   3.856  -4.122   1.034
   78    HE1  TYR   9           HE1      TYR   9   7.952  -6.090   2.916
   79    HE2  TYR   9           HE2      TYR   9   5.011  -5.925  -0.170
   80    HH   TYR   9           HH       TYR   9   6.952  -7.095  -0.318
   81    H    LYS  10           H        LYS  10   4.488  -0.950   1.187
   82    HA   LYS  10           HA       LYS  10   6.892  -1.768  -0.178
   83   1HB   LYS  10          2HB       LYS  10   4.604  -2.164  -1.100
   84   2HB   LYS  10          1HB       LYS  10   4.462  -0.430  -1.360
   85   1HG   LYS  10          2HG       LYS  10   6.210  -0.433  -2.959
   86   2HG   LYS  10          1HG       LYS  10   6.668  -2.086  -2.549
   87   1HD   LYS  10          2HD       LYS  10   4.483  -2.867  -3.388
   88   2HD   LYS  10          1HD       LYS  10   4.095  -1.210  -3.852
   89   1HE   LYS  10          2HE       LYS  10   4.903  -2.555  -5.748
   90   2HE   LYS  10          1HE       LYS  10   5.939  -1.171  -5.413
   91   1HZ   LYS  10          1HZ       LYS  10   7.528  -2.582  -4.371
   92   2HZ   LYS  10          2HZ       LYS  10   7.141  -3.275  -5.870
   93   3HZ   LYS  10          3HZ       LYS  10   6.494  -3.925  -4.444
   94    H    TYR  11           H        TYR  11   5.234   1.300   0.456
   95    HA   TYR  11           HA       TYR  11   7.708   2.668  -0.380
   96   1HB   TYR  11          2HB       TYR  11   4.865   3.647  -0.724
   97   2HB   TYR  11          1HB       TYR  11   6.305   4.603  -1.052
   98    HD1  TYR  11           HD1      TYR  11   3.901   2.401  -2.428
   99    HD2  TYR  11           HD2      TYR  11   7.973   3.589  -2.792
  100    HE1  TYR  11           HE1      TYR  11   3.954   1.504  -4.717
  101    HE2  TYR  11           HE2      TYR  11   8.034   2.697  -5.083
  102    HH   TYR  11           HH       TYR  11   6.812   0.969  -6.421
  103    HA   PRO  12           HA       PRO  12   7.140   3.624   4.032
  104   1HB   PRO  12          2HB       PRO  12   9.761   3.985   4.563
  105   2HB   PRO  12          1HB       PRO  12   9.031   2.384   4.439
  106   1HG   PRO  12          2HG       PRO  12  10.627   3.894   2.410
  107   2HG   PRO  12          1HG       PRO  12  10.720   2.178   2.854
  108   1HD   PRO  12          2HD       PRO  12   9.396   3.081   0.655
  109   2HD   PRO  12          1HD       PRO  12   8.926   1.614   1.536
  110    H    ASN  13           H        ASN  13   8.558   5.397   1.455
  111    HA   ASN  13           HA       ASN  13   9.024   7.801   2.982
  112   1HB   ASN  13          2HB       ASN  13   9.167   7.260   0.012
  113   2HB   ASN  13          1HB       ASN  13   9.668   8.754   0.786
  114   1HD2  ASN  13          1HD2      ASN  13  11.184   6.850  -0.802
  115   2HD2  ASN  13          2HD2      ASN  13  12.499   6.318   0.197
  116    H    ALA  14           H        ALA  14   6.286   6.396   1.980
  117    HA   ALA  14           HA       ALA  14   4.980   8.734   0.871
  118   1HB   ALA  14          1HB       ALA  14   4.432   6.555  -0.052
  119   2HB   ALA  14          2HB       ALA  14   3.011   7.275   0.707
  120   3HB   ALA  14          3HB       ALA  14   3.901   5.999   1.535
  121    H    VAL  15           H        VAL  15   3.425   9.941   1.859
  122    HA   VAL  15           HA       VAL  15   2.845   9.391   4.699
  123    HB   VAL  15           HB       VAL  15   3.316  12.107   3.441
  124   1HG1  VAL  15          1HG1      VAL  15   1.571  12.156   5.162
  125   2HG1  VAL  15          2HG1      VAL  15   3.019  13.028   5.663
  126   3HG1  VAL  15          3HG1      VAL  15   2.692  11.417   6.307
  127   1HG2  VAL  15          1HG2      VAL  15   4.942  10.601   5.484
  128   2HG2  VAL  15          2HG2      VAL  15   5.254  12.246   4.932
  129   3HG2  VAL  15          3HG2      VAL  15   5.396  10.896   3.806
  130    H    SER  16           H        SER  16   0.672   9.190   5.061
  131    HA   SER  16           HA       SER  16  -1.081   9.845   2.841
  132   1HB   SER  16          2HB       SER  16  -1.899   8.553   5.445
  133   2HB   SER  16          1HB       SER  16  -2.687   8.423   3.872
  134    HG   SER  16           HG       SER  16  -0.403   7.520   3.328
  135    H    ARG  17           H        ARG  17  -0.003  11.977   4.247
  136    HA   ARG  17           HA       ARG  17  -2.357  13.205   5.387
  137   1HB   ARG  17          2HB       ARG  17   0.487  14.183   5.372
  138   2HB   ARG  17          1HB       ARG  17  -0.876  15.095   6.012
  139   1HG   ARG  17          2HG       ARG  17  -1.322  13.169   7.551
  140   2HG   ARG  17          1HG       ARG  17   0.210  12.477   7.017
  141   1HD   ARG  17          2HD       ARG  17   0.555  13.657   9.075
  142   2HD   ARG  17          1HD       ARG  17   1.347  14.541   7.772
  143    HE   ARG  17           HE       ARG  17  -0.650  16.033   7.813
  144   1HH1  ARG  17          1HH1      ARG  17   0.151  14.115  10.630
  145   2HH1  ARG  17          2HH1      ARG  17  -0.539  15.247  11.753
  146   1HH2  ARG  17          1HH2      ARG  17  -1.576  17.520   9.291
  147   2HH2  ARG  17          2HH2      ARG  17  -1.498  17.184  10.998
  148    H    LYS  18           H        LYS  18   0.117  13.812   2.956
  149    HA   LYS  18           HA       LYS  18  -1.476  16.000   1.839
  150   1HB   LYS  18          2HB       LYS  18   1.450  15.351   1.462
  151   2HB   LYS  18          1HB       LYS  18   0.626  16.801   0.931
  152   1HG   LYS  18          2HG       LYS  18   0.397  17.605   3.132
  153   2HG   LYS  18          1HG       LYS  18   0.837  16.040   3.824
  154   1HD   LYS  18          2HD       LYS  18   3.089  16.257   2.945
  155   2HD   LYS  18          1HD       LYS  18   2.665  17.780   2.172
  156   1HE   LYS  18          2HE       LYS  18   2.285  18.801   4.338
  157   2HE   LYS  18          1HE       LYS  18   2.615  17.265   5.139
  158   1HZ   LYS  18          1HZ       LYS  18   4.866  17.346   4.170
  159   2HZ   LYS  18          2HZ       LYS  18   4.560  18.624   5.242
  160   3HZ   LYS  18          3HZ       LYS  18   4.539  18.898   3.569
  161    H    ASP  19           H        ASP  19   0.947  13.707   0.615
  162    HA   ASP  19           HA       ASP  19   0.359  13.893  -2.079
  163   1HB   ASP  19          2HB       ASP  19   1.300  11.379  -0.680
  164   2HB   ASP  19          1HB       ASP  19   1.606  11.847  -2.350
  165    H    PHE  20           H        PHE  20  -0.952  11.769   0.352
  166    HA   PHE  20           HA       PHE  20  -3.426  11.529  -1.062
  167   1HB   PHE  20          2HB       PHE  20  -3.449   9.049  -1.079
  168   2HB   PHE  20          1HB       PHE  20  -2.217   9.701  -2.150
  169    HD1  PHE  20           HD1      PHE  20  -2.894   7.626   0.712
  170    HD2  PHE  20           HD2      PHE  20   0.171   9.638  -1.447
  171    HE1  PHE  20           HE1      PHE  20  -1.202   6.217   1.803
  172    HE2  PHE  20           HE2      PHE  20   1.866   8.236  -0.354
  173    HZ   PHE  20           HZ       PHE  20   1.179   6.520   1.272
  174    H    GLU  21           H        GLU  21  -4.848   9.921   0.407
  175    HA   GLU  21           HA       GLU  21  -4.002   9.971   3.175
  176   1HB   GLU  21          2HB       GLU  21  -4.997  12.235   2.792
  177   2HB   GLU  21          1HB       GLU  21  -6.514  11.448   2.378
  178   1HG   GLU  21          2HG       GLU  21  -6.587  10.448   4.624
  179   2HG   GLU  21          1HG       GLU  21  -5.101  11.301   5.032
  180    H    LEU  22           H        LEU  22  -5.226   8.653   4.506
  181    HA   LEU  22           HA       LEU  22  -7.056   6.837   3.083
  182   1HB   LEU  22          2HB       LEU  22  -5.419   6.101   5.494
  183   2HB   LEU  22          1HB       LEU  22  -6.245   5.033   4.382
  184    HG   LEU  22           HG       LEU  22  -3.849   6.706   3.624
  185   1HD1  LEU  22          1HD1      LEU  22  -3.997   3.789   4.351
  186   2HD1  LEU  22          2HD1      LEU  22  -3.259   5.063   5.323
  187   3HD1  LEU  22          3HD1      LEU  22  -2.576   4.643   3.752
  188   1HD2  LEU  22          1HD2      LEU  22  -5.231   4.418   2.231
  189   2HD2  LEU  22          2HD2      LEU  22  -3.770   5.238   1.679
  190   3HD2  LEU  22          3HD2      LEU  22  -5.298   6.116   1.757
  191    H    ARG  23           H        ARG  23  -8.899   6.190   4.165
  192    HA   ARG  23           HA       ARG  23  -9.371   7.238   6.836
  193   1HB   ARG  23          2HB       ARG  23 -10.686   8.259   4.423
  194   2HB   ARG  23          1HB       ARG  23 -11.806   7.770   5.692
  195   1HG   ARG  23          2HG       ARG  23 -10.939   9.301   7.214
  196   2HG   ARG  23          1HG       ARG  23  -9.456   9.514   6.297
  197   1HD   ARG  23          2HD       ARG  23 -11.018  10.470   4.460
  198   2HD   ARG  23          1HD       ARG  23 -12.196  10.612   5.762
  199    HE   ARG  23           HE       ARG  23  -9.537  11.898   5.899
  200   1HH1  ARG  23          1HH1      ARG  23 -13.035  12.042   6.181
  201   2HH1  ARG  23          2HH1      ARG  23 -13.044  13.691   6.742
  202   1HH2  ARG  23          1HH2      ARG  23  -9.551  14.062   6.615
  203   2HH2  ARG  23          2HH2      ARG  23 -11.065  14.848   6.967
  204    H    ASN  24           H        ASN  24 -10.973   6.236   7.974
  205    HA   ASN  24           HA       ASN  24 -11.351   3.470   7.114
  206   1HB   ASN  24          2HB       ASN  24 -10.362   4.066   9.350
  207   2HB   ASN  24          1HB       ASN  24 -11.937   4.693   9.813
  208   1HD2  ASN  24          1HD2      ASN  24 -10.319   2.527  10.887
  209   2HD2  ASN  24          2HD2      ASN  24 -11.338   1.125  10.838
  210    H    ASP  25           H        ASP  25 -13.191   2.795   6.297
  211    HA   ASP  25           HA       ASP  25 -15.601   4.427   6.563
  212   1HB   ASP  25          2HB       ASP  25 -15.347   3.838   4.337
  213   2HB   ASP  25          1HB       ASP  25 -14.716   2.238   4.721
  214    H    GLY  26           H        GLY  26 -14.495   1.139   7.188
  215   1HA   GLY  26          2HA       GLY  26 -15.703   0.218   9.283
  216   2HA   GLY  26          1HA       GLY  26 -17.135   0.464   8.287
  217    H    ASN  27           H        ASN  27 -16.024  -0.250   5.795
  218    HA   ASN  27           HA       ASN  27 -15.800  -3.106   5.969
  219   1HB   ASN  27          2HB       ASN  27 -16.831  -2.168   3.988
  220   2HB   ASN  27          1HB       ASN  27 -15.417  -1.173   3.669
  221   1HD2  ASN  27          1HD2      ASN  27 -16.803  -4.338   3.459
  222   2HD2  ASN  27          2HD2      ASN  27 -15.579  -5.029   2.451
  223    H    GLY  28           H        GLY  28 -13.734  -0.423   5.971
  224   1HA   GLY  28          2HA       GLY  28 -11.477  -1.590   6.958
  225   2HA   GLY  28          1HA       GLY  28 -11.319  -1.752   5.214
  226    H    SER  29           H        SER  29  -9.376  -0.373   6.001
  227    HA   SER  29           HA       SER  29 -10.119   2.473   5.887
  228   1HB   SER  29          2HB       SER  29  -7.493   1.227   6.751
  229   2HB   SER  29          1HB       SER  29  -7.917   2.937   6.838
  230    HG   SER  29           HG       SER  29  -9.370   0.893   8.176
  231    H    TYR  30           H        TYR  30 -10.032   3.246   3.862
  232    HA   TYR  30           HA       TYR  30  -7.990   2.119   2.065
  233   1HB   TYR  30          2HB       TYR  30  -9.571   2.262   0.216
  234   2HB   TYR  30          1HB       TYR  30 -10.219   1.252   1.502
  235    HD1  TYR  30           HD1      TYR  30 -11.975   2.264   3.051
  236    HD2  TYR  30           HD2      TYR  30 -10.755   4.116  -0.578
  237    HE1  TYR  30           HE1      TYR  30 -14.041   3.595   3.041
  238    HE2  TYR  30           HE2      TYR  30 -12.812   5.461  -0.589
  239    HH   TYR  30           HH       TYR  30 -15.185   5.173   0.376
  240    H    ILE  31           H        ILE  31  -8.146   3.638  -0.088
  241    HA   ILE  31           HA       ILE  31  -7.001   6.124   0.863
  242    HB   ILE  31           HB       ILE  31  -7.265   5.268  -2.019
  243   1HG1  ILE  31          2HG1      ILE  31  -5.045   4.519  -0.097
  244   2HG1  ILE  31          1HG1      ILE  31  -6.268   3.410  -0.704
  245   1HG2  ILE  31          1HG2      ILE  31  -5.219   6.588  -2.288
  246   2HG2  ILE  31          2HG2      ILE  31  -5.247   6.977  -0.569
  247   3HG2  ILE  31          3HG2      ILE  31  -6.536   7.557  -1.625
  248   1HD1  ILE  31          1HD1      ILE  31  -5.436   3.736  -2.976
  249   2HD1  ILE  31          2HD1      ILE  31  -4.178   3.137  -1.892
  250   3HD1  ILE  31          3HD1      ILE  31  -4.204   4.837  -2.358
  251    H    GLU  32           H        GLU  32  -8.071   8.004   0.934
  252    HA   GLU  32           HA       GLU  32 -10.530   8.232  -0.670
  253   1HB   GLU  32          2HB       GLU  32 -11.387   9.758   1.024
  254   2HB   GLU  32          1HB       GLU  32 -10.952   8.213   1.737
  255   1HG   GLU  32          2HG       GLU  32 -10.023   9.538   3.297
  256   2HG   GLU  32          1HG       GLU  32  -8.669   9.535   2.170
  257    H    LYS  33           H        LYS  33  -7.438   9.538  -0.080
  258    HA   LYS  33           HA       LYS  33  -8.017  11.784  -1.887
  259   1HB   LYS  33          2HB       LYS  33  -7.638  12.648   0.336
  260   2HB   LYS  33          1HB       LYS  33  -6.202  11.655   0.524
  261   1HG   LYS  33          2HG       LYS  33  -5.137  12.953  -1.291
  262   2HG   LYS  33          1HG       LYS  33  -6.550  14.005  -1.305
  263   1HD   LYS  33          2HD       LYS  33  -4.950  13.473   1.163
  264   2HD   LYS  33          1HD       LYS  33  -4.575  14.778   0.052
  265   1HE   LYS  33          2HE       LYS  33  -5.887  15.787   1.686
  266   2HE   LYS  33          1HE       LYS  33  -7.005  15.500   0.361
  267   1HZ   LYS  33          1HZ       LYS  33  -7.651  13.401   1.581
  268   2HZ   LYS  33          2HZ       LYS  33  -8.105  14.854   2.316
  269   3HZ   LYS  33          3HZ       LYS  33  -6.774  13.993   2.909
  270    H    TRP  34           H        TRP  34  -6.509  12.097  -3.536
  271    HA   TRP  34           HA       TRP  34  -4.071  10.534  -3.576
  272   1HB   TRP  34          2HB       TRP  34  -5.943   9.016  -4.359
  273   2HB   TRP  34          1HB       TRP  34  -6.136  10.092  -5.737
  274    HD1  TRP  34           HD1      TRP  34  -4.601   9.671  -7.774
  275    HE1  TRP  34           HE1      TRP  34  -2.673   8.040  -8.280
  276    HE3  TRP  34           HE3      TRP  34  -3.860   7.816  -3.071
  277    HZ2  TRP  34           HZ2      TRP  34  -1.044   6.222  -6.865
  278    HZ3  TRP  34           HZ3      TRP  34  -2.097   6.136  -2.730
  279    HH2  TRP  34           HH2      TRP  34  -0.717   5.354  -4.588
  280    H    ASN  35           H        ASN  35  -2.642  12.037  -4.172
  281    HA   ASN  35           HA       ASN  35  -3.360  13.806  -6.413
  282   1HB   ASN  35          2HB       ASN  35  -1.444  14.326  -4.136
  283   2HB   ASN  35          1HB       ASN  35  -1.680  15.396  -5.509
  284   1HD2  ASN  35          1HD2      ASN  35  -2.874  14.343  -2.480
  285   2HD2  ASN  35          2HD2      ASN  35  -4.203  15.453  -2.374
  286    H    LEU  36           H        LEU  36  -1.657  11.143  -5.724
  287    HA   LEU  36           HA       LEU  36   0.918  11.797  -6.776
  288   1HB   LEU  36          2HB       LEU  36  -0.386   9.142  -6.191
  289   2HB   LEU  36          1HB       LEU  36   1.269   9.318  -6.731
  290    HG   LEU  36           HG       LEU  36   0.153  10.412  -4.158
  291   1HD1  LEU  36          1HD1      LEU  36   0.337   7.989  -4.116
  292   2HD1  LEU  36          2HD1      LEU  36   1.579   8.722  -3.099
  293   3HD1  LEU  36          3HD1      LEU  36   2.000   8.094  -4.693
  294   1HD2  LEU  36          1HD2      LEU  36   2.956  10.407  -5.264
  295   2HD2  LEU  36          2HD2      LEU  36   2.501  10.919  -3.639
  296   3HD2  LEU  36          3HD2      LEU  36   1.924  11.820  -5.042
  297    H    ARG  37           H        ARG  37   1.880  11.016  -8.671
  298    HA   ARG  37           HA       ARG  37   0.071  11.031 -10.943
  299   1HB   ARG  37          2HB       ARG  37   3.088  10.999 -10.760
  300   2HB   ARG  37          1HB       ARG  37   2.182  11.108 -12.264
  301   1HG   ARG  37          2HG       ARG  37   1.227  13.221 -11.569
  302   2HG   ARG  37          1HG       ARG  37   2.057  13.106 -10.016
  303   1HD   ARG  37          2HD       ARG  37   4.200  13.245 -11.090
  304   2HD   ARG  37          1HD       ARG  37   3.452  13.176 -12.686
  305    HE   ARG  37           HE       ARG  37   2.330  15.355 -11.913
  306   1HH1  ARG  37          1HH1      ARG  37   5.557  14.363 -10.959
  307   2HH1  ARG  37          2HH1      ARG  37   6.150  15.990 -10.815
  308   1HH2  ARG  37          1HH2      ARG  37   3.127  17.490 -11.740
  309   2HH2  ARG  37          2HH2      ARG  37   4.776  17.752 -11.250
  310    H    ALA  38           H        ALA  38  -0.361   8.783  -9.524
  311    HA   ALA  38           HA       ALA  38   0.660   6.696 -11.307
  312   1HB   ALA  38          1HB       ALA  38   0.512   6.426  -8.303
  313   2HB   ALA  38          2HB       ALA  38   1.991   6.610  -9.247
  314   3HB   ALA  38          3HB       ALA  38   0.993   5.170  -9.445
  315    HA   PRO  39           HA       PRO  39  -3.664   5.623 -11.400
  316   1HB   PRO  39          2HB       PRO  39  -3.401   3.103 -12.410
  317   2HB   PRO  39          1HB       PRO  39  -3.287   4.561 -13.402
  318   1HG   PRO  39          2HG       PRO  39  -1.101   2.866 -12.263
  319   2HG   PRO  39          1HG       PRO  39  -1.220   3.613 -13.867
  320   1HD   PRO  39          2HD       PRO  39   0.285   4.668 -11.882
  321   2HD   PRO  39          1HD       PRO  39  -0.531   5.669 -13.102
  322    H    LEU  40           H        LEU  40  -5.082   4.513 -10.106
  323    HA   LEU  40           HA       LEU  40  -4.117   3.527  -7.647
  324   1HB   LEU  40          2HB       LEU  40  -6.804   3.626  -8.960
  325   2HB   LEU  40          1HB       LEU  40  -6.591   2.719  -7.484
  326    HG   LEU  40           HG       LEU  40  -7.469   4.882  -6.940
  327   1HD1  LEU  40          1HD1      LEU  40  -4.542   4.746  -6.240
  328   2HD1  LEU  40          2HD1      LEU  40  -5.858   3.952  -5.375
  329   3HD1  LEU  40          3HD1      LEU  40  -5.761   5.713  -5.408
  330   1HD2  LEU  40          1HD2      LEU  40  -5.088   6.041  -8.382
  331   2HD2  LEU  40          2HD2      LEU  40  -6.287   6.954  -7.464
  332   3HD2  LEU  40          3HD2      LEU  40  -6.763   6.099  -8.932
  333    HA   PRO  41           HA       PRO  41  -3.188  -0.667  -8.851
  334   1HB   PRO  41          2HB       PRO  41  -3.028  -1.661  -6.302
  335   2HB   PRO  41          1HB       PRO  41  -1.720  -0.777  -7.099
  336   1HG   PRO  41          2HG       PRO  41  -3.758   0.210  -5.141
  337   2HG   PRO  41          1HG       PRO  41  -2.021   0.560  -5.221
  338   1HD   PRO  41          2HD       PRO  41  -3.850   2.305  -6.122
  339   2HD   PRO  41          1HD       PRO  41  -2.284   2.100  -6.929
  340    H    THR  42           H        THR  42  -4.101  -2.850  -8.454
  341    HA   THR  42           HA       THR  42  -7.006  -2.581  -8.209
  342    HB   THR  42           HB       THR  42  -7.053  -4.848  -9.304
  343    HG1  THR  42           HG1      THR  42  -4.323  -4.345  -9.945
  344   1HG2  THR  42          1HG2      THR  42  -6.536  -3.996 -11.534
  345   2HG2  THR  42          2HG2      THR  42  -5.630  -2.659 -10.825
  346   3HG2  THR  42          3HG2      THR  42  -7.372  -2.771 -10.576
  347    H    GLN  43           H        GLN  43  -8.123  -4.643  -7.424
  348    HA   GLN  43           HA       GLN  43  -7.765  -5.011  -4.712
  349   1HB   GLN  43          2HB       GLN  43  -9.770  -5.669  -6.005
  350   2HB   GLN  43          1HB       GLN  43  -8.879  -7.008  -6.695
  351   1HG   GLN  43          2HG       GLN  43 -10.337  -7.763  -4.919
  352   2HG   GLN  43          1HG       GLN  43  -8.647  -8.012  -4.491
  353   1HE2  GLN  43          1HE2      GLN  43  -7.748  -6.833  -2.826
  354   2HE2  GLN  43          2HE2      GLN  43  -8.707  -5.920  -1.712
  355    H    ALA  44           H        ALA  44  -6.787  -7.266  -7.263
  356    HA   ALA  44           HA       ALA  44  -5.442  -9.125  -5.696
  357   1HB   ALA  44          1HB       ALA  44  -4.742  -8.313  -8.517
  358   2HB   ALA  44          2HB       ALA  44  -6.003  -9.461  -8.069
  359   3HB   ALA  44          3HB       ALA  44  -4.314  -9.830  -7.724
  360    H    GLU  45           H        GLU  45  -4.157  -6.234  -7.299
  361    HA   GLU  45           HA       GLU  45  -1.478  -6.533  -6.568
  362   1HB   GLU  45          2HB       GLU  45  -3.159  -4.127  -7.219
  363   2HB   GLU  45          1HB       GLU  45  -1.454  -3.973  -6.835
  364   1HG   GLU  45          2HG       GLU  45  -0.856  -5.360  -8.705
  365   2HG   GLU  45          1HG       GLU  45  -2.555  -5.692  -9.039
  366    H    LEU  46           H        LEU  46  -4.116  -4.846  -4.894
  367    HA   LEU  46           HA       LEU  46  -2.620  -3.839  -2.753
  368   1HB   LEU  46          2HB       LEU  46  -5.520  -4.648  -2.942
  369   2HB   LEU  46          1HB       LEU  46  -4.834  -3.782  -1.588
  370    HG   LEU  46           HG       LEU  46  -4.956  -2.767  -4.425
  371   1HD1  LEU  46          1HD1      LEU  46  -6.594  -1.173  -3.536
  372   2HD1  LEU  46          2HD1      LEU  46  -6.528  -1.989  -1.974
  373   3HD1  LEU  46          3HD1      LEU  46  -7.153  -2.839  -3.388
  374   1HD2  LEU  46          1HD2      LEU  46  -3.000  -1.944  -3.203
  375   2HD2  LEU  46          2HD2      LEU  46  -4.049  -1.405  -1.891
  376   3HD2  LEU  46          3HD2      LEU  46  -4.174  -0.658  -3.485
  377    H    GLU  47           H        GLU  47  -4.342  -6.914  -3.146
  378    HA   GLU  47           HA       GLU  47  -3.824  -7.797  -0.497
  379   1HB   GLU  47          2HB       GLU  47  -4.668  -9.307  -2.962
  380   2HB   GLU  47          1HB       GLU  47  -4.559 -10.023  -1.358
  381   1HG   GLU  47          2HG       GLU  47  -6.197  -8.379  -0.545
  382   2HG   GLU  47          1HG       GLU  47  -6.344  -7.753  -2.186
  383    H    THR  48           H        THR  48  -2.091  -8.023  -3.512
  384    HA   THR  48           HA       THR  48  -0.286 -10.083  -2.834
  385    HB   THR  48           HB       THR  48   0.163  -7.682  -4.633
  386    HG1  THR  48           HG1      THR  48  -1.651  -9.112  -5.160
  387   1HG2  THR  48          1HG2      THR  48   1.595 -10.338  -4.523
  388   2HG2  THR  48          2HG2      THR  48   2.269  -8.773  -4.069
  389   3HG2  THR  48          3HG2      THR  48   1.838  -9.096  -5.749
  390    H    TRP  49           H        TRP  49  -0.108  -6.549  -2.394
  391    HA   TRP  49           HA       TRP  49   2.464  -6.585  -1.197
  392   1HB   TRP  49          2HB       TRP  49   0.273  -4.512  -0.951
  393   2HB   TRP  49          1HB       TRP  49   1.955  -4.285  -0.482
  394    HD1  TRP  49           HD1      TRP  49   3.122  -5.776  -3.173
  395    HE1  TRP  49           HE1      TRP  49   3.113  -4.444  -5.376
  396    HE3  TRP  49           HE3      TRP  49  -0.390  -2.269  -1.959
  397    HZ2  TRP  49           HZ2      TRP  49   1.783  -2.187  -6.446
  398    HZ3  TRP  49           HZ3      TRP  49  -0.971  -0.557  -3.626
  399    HH2  TRP  49           HH2      TRP  49   0.095  -0.517  -5.821
  400    H    TRP  50           H        TRP  50  -0.816  -6.723   0.084
  401    HA   TRP  50           HA       TRP  50  -0.189  -6.675   2.820
  402   1HB   TRP  50          2HB       TRP  50  -2.486  -6.488   1.957
  403   2HB   TRP  50          1HB       TRP  50  -2.419  -8.154   1.396
  404    HD1  TRP  50           HD1      TRP  50  -2.837 -10.063   3.168
  405    HE1  TRP  50           HE1      TRP  50  -3.626 -10.064   5.621
  406    HE3  TRP  50           HE3      TRP  50  -2.346  -5.073   4.171
  407    HZ2  TRP  50           HZ2      TRP  50  -3.997  -8.193   7.697
  408    HZ3  TRP  50           HZ3      TRP  50  -2.941  -4.262   6.418
  409    HH2  TRP  50           HH2      TRP  50  -3.748  -5.789   8.142
  410    H    GLU  51           H        GLU  51  -0.556  -9.403   0.568
  411    HA   GLU  51           HA       GLU  51   0.056 -11.469   2.326
  412   1HB   GLU  51          2HB       GLU  51   0.002 -11.093  -0.610
  413   2HB   GLU  51          1HB       GLU  51   0.944 -12.448  -0.030
  414   1HG   GLU  51          2HG       GLU  51  -1.083 -13.159   1.276
  415   2HG   GLU  51          1HG       GLU  51  -1.976 -11.915   0.400
  416    H    GLU  52           H        GLU  52   2.208  -9.508   0.296
  417    HA   GLU  52           HA       GLU  52   4.582 -10.863   0.931
  418   1HB   GLU  52          2HB       GLU  52   4.043  -8.032   0.077
  419   2HB   GLU  52          1HB       GLU  52   5.673  -8.625   0.370
  420   1HG   GLU  52          2HG       GLU  52   5.312 -10.371  -1.323
  421   2HG   GLU  52          1HG       GLU  52   3.722  -9.691  -1.658
  422    H    LEU  53           H        LEU  53   3.027  -8.065   2.470
  423    HA   LEU  53           HA       LEU  53   4.983  -7.573   4.409
  424   1HB   LEU  53          2HB       LEU  53   3.192  -6.002   3.928
  425   2HB   LEU  53          1HB       LEU  53   1.996  -7.145   4.506
  426    HG   LEU  53           HG       LEU  53   2.978  -6.971   6.780
  427   1HD1  LEU  53          1HD1      LEU  53   5.231  -6.317   6.215
  428   2HD1  LEU  53          2HD1      LEU  53   4.502  -5.090   7.250
  429   3HD1  LEU  53          3HD1      LEU  53   4.651  -4.808   5.515
  430   1HD2  LEU  53          1HD2      LEU  53   2.064  -4.395   5.505
  431   2HD2  LEU  53          2HD2      LEU  53   2.115  -4.705   7.240
  432   3HD2  LEU  53          3HD2      LEU  53   1.039  -5.647   6.209
  433    H    GLN  54           H        GLN  54   2.392  -9.936   4.298
  434    HA   GLN  54           HA       GLN  54   2.604 -10.625   7.072
  435   1HB   GLN  54          2HB       GLN  54   1.180 -11.996   4.799
  436   2HB   GLN  54          1HB       GLN  54   0.986 -12.369   6.496
  437   1HG   GLN  54          2HG       GLN  54   0.284  -9.762   5.185
  438   2HG   GLN  54          1HG       GLN  54  -0.854 -11.022   5.648
  439   1HE2  GLN  54          1HE2      GLN  54   1.249  -8.513   6.754
  440   2HE2  GLN  54          2HE2      GLN  54   0.634  -8.415   8.370
  441    H    LYS  55           H        LYS  55   3.716 -11.989   3.997
  442    HA   LYS  55           HA       LYS  55   4.634 -14.427   5.253
  443   1HB   LYS  55          2HB       LYS  55   4.892 -13.429   2.434
  444   2HB   LYS  55          1HB       LYS  55   5.384 -15.019   2.978
  445   1HG   LYS  55          2HG       LYS  55   3.115 -15.611   3.489
  446   2HG   LYS  55          1HG       LYS  55   2.572 -13.966   3.146
  447   1HD   LYS  55          2HD       LYS  55   3.467 -14.292   0.812
  448   2HD   LYS  55          1HD       LYS  55   3.656 -16.001   1.211
  449   1HE   LYS  55          2HE       LYS  55   1.279 -16.185   1.654
  450   2HE   LYS  55          1HE       LYS  55   1.067 -14.458   1.366
  451   1HZ   LYS  55          1HZ       LYS  55   0.423 -15.513  -0.603
  452   2HZ   LYS  55          2HZ       LYS  55   1.759 -16.566  -0.595
  453   3HZ   LYS  55          3HZ       LYS  55   1.982 -14.920  -0.928
  454    H    ASN  56           H        ASN  56   5.928 -11.408   4.560
  455    HA   ASN  56           HA       ASN  56   8.674 -12.421   4.537
  456   1HB   ASN  56          2HB       ASN  56   7.528  -9.718   3.843
  457   2HB   ASN  56          1HB       ASN  56   9.257 -10.003   4.001
  458   1HD2  ASN  56          1HD2      ASN  56   7.689  -9.188   1.681
  459   2HD2  ASN  56          2HD2      ASN  56   8.003 -10.368   0.460
  460    HA   PRO  57           HA       PRO  57   9.495 -11.335   8.757
  461   1HB   PRO  57          2HB       PRO  57  12.148 -10.505   7.701
  462   2HB   PRO  57          1HB       PRO  57  11.757 -11.645   8.995
  463   1HG   PRO  57          2HG       PRO  57  12.597 -12.513   6.619
  464   2HG   PRO  57          1HG       PRO  57  11.339 -13.381   7.517
  465   1HD   PRO  57          2HD       PRO  57  11.073 -11.559   5.162
  466   2HD   PRO  57          1HD       PRO  57  10.195 -13.056   5.535
  467    HA   PRO  58           HA       PRO  58   8.683  -6.997   8.612
  468   1HB   PRO  58          2HB       PRO  58   8.874  -6.457  11.261
  469   2HB   PRO  58          1HB       PRO  58   7.498  -7.308  10.554
  470   1HG   PRO  58          2HG       PRO  58   9.881  -8.417  11.984
  471   2HG   PRO  58          1HG       PRO  58   8.175  -8.876  12.135
  472   1HD   PRO  58          2HD       PRO  58   9.954 -10.302  10.673
  473   2HD   PRO  58          1HD       PRO  58   8.234 -10.190  10.245
  474    H    TYR  59           H        TYR  59   9.602  -4.930   9.403
  475    HA   TYR  59           HA       TYR  59  12.231  -4.459   8.790
  476   1HB   TYR  59          2HB       TYR  59  10.532  -2.713   9.063
  477   2HB   TYR  59          1HB       TYR  59  10.488  -3.003  10.794
  478    HD1  TYR  59           HD1      TYR  59  11.903  -1.820  12.227
  479    HD2  TYR  59           HD2      TYR  59  12.718  -1.851   8.049
  480    HE1  TYR  59           HE1      TYR  59  13.606  -0.078  12.553
  481    HE2  TYR  59           HE2      TYR  59  14.428  -0.112   8.364
  482    HH   TYR  59           HH       TYR  59  15.519   0.860  11.496
  483    H    GLU  60           H        GLU  60  14.124  -4.951   9.706
  484    HA   GLU  60           HA       GLU  60  14.106  -6.228  12.323
  485   1HB   GLU  60          2HB       GLU  60  15.274  -7.277  10.388
  486   2HB   GLU  60          1HB       GLU  60  16.378  -5.911  10.346
  487   1HG   GLU  60          2HG       GLU  60  17.250  -6.477  12.509
  488   2HG   GLU  60          1HG       GLU  60  16.047  -7.752  12.702
  Start of MODEL   15
    1   1H    MET   1          1H        MET   1  -9.753  -4.232   6.022
    2   2H    MET   1          2H        MET   1  -9.988  -5.285   4.720
    3   3H    MET   1          3H        MET   1 -10.098  -3.611   4.482
    4    HA   MET   1           HA       MET   1  -7.654  -5.109   5.243
    5   1HB   MET   1          2HB       MET   1  -8.285  -5.503   2.925
    6   2HB   MET   1          1HB       MET   1  -8.485  -3.778   2.653
    7   1HG   MET   1          2HG       MET   1  -6.082  -3.457   3.083
    8   2HG   MET   1          1HG       MET   1  -5.902  -5.201   3.266
    9   1HE   MET   1          1HE       MET   1  -3.938  -4.990   1.438
   10   2HE   MET   1          2HE       MET   1  -4.261  -3.272   1.215
   11   3HE   MET   1          3HE       MET   1  -4.180  -4.343  -0.183
   12    H    ILE   2           H        ILE   2  -5.918  -3.889   5.859
   13    HA   ILE   2           HA       ILE   2  -6.376  -1.018   6.180
   14    HB   ILE   2           HB       ILE   2  -4.124  -2.704   7.268
   15   1HG1  ILE   2          2HG1      ILE   2  -5.296  -2.066   9.493
   16   2HG1  ILE   2          1HG1      ILE   2  -6.698  -1.730   8.486
   17   1HG2  ILE   2          1HG2      ILE   2  -4.851   0.171   7.796
   18   2HG2  ILE   2          2HG2      ILE   2  -3.435  -0.408   6.919
   19   3HG2  ILE   2          3HG2      ILE   2  -3.596  -0.732   8.646
   20   1HD1  ILE   2          1HD1      ILE   2  -6.839  -3.942   9.445
   21   2HD1  ILE   2          2HD1      ILE   2  -5.280  -4.372   8.742
   22   3HD1  ILE   2          3HD1      ILE   2  -6.660  -4.051   7.693
   23    H    LEU   3           H        LEU   3  -5.838   0.114   4.473
   24    HA   LEU   3           HA       LEU   3  -4.067  -0.784   2.452
   25   1HB   LEU   3          2HB       LEU   3  -5.954   1.362   2.891
   26   2HB   LEU   3          1HB       LEU   3  -4.523   1.917   2.060
   27    HG   LEU   3           HG       LEU   3  -6.252   1.305   0.479
   28   1HD1  LEU   3          1HD1      LEU   3  -4.984  -0.255  -0.903
   29   2HD1  LEU   3          2HD1      LEU   3  -3.973  -0.663   0.483
   30   3HD1  LEU   3          3HD1      LEU   3  -3.937   0.969  -0.184
   31   1HD2  LEU   3          1HD2      LEU   3  -7.016  -1.014   0.278
   32   2HD2  LEU   3          2HD2      LEU   3  -7.438  -0.322   1.845
   33   3HD2  LEU   3          3HD2      LEU   3  -6.082  -1.441   1.710
   34    H    TYR   4           H        TYR   4  -3.775   1.382   5.161
   35    HA   TYR   4           HA       TYR   4  -1.719   3.033   4.391
   36   1HB   TYR   4          2HB       TYR   4  -2.878   3.406   6.474
   37   2HB   TYR   4          1HB       TYR   4  -2.278   1.886   7.132
   38    HD1  TYR   4           HD1      TYR   4  -1.163   5.226   5.927
   39    HD2  TYR   4           HD2      TYR   4  -0.248   1.821   8.305
   40    HE1  TYR   4           HE1      TYR   4   0.797   6.394   6.832
   41    HE2  TYR   4           HE2      TYR   4   1.715   2.985   9.227
   42    HH   TYR   4           HH       TYR   4   3.262   4.865   8.454
   43    H    ASP   5           H        ASP   5  -1.373  -0.093   6.055
   44    HA   ASP   5           HA       ASP   5   1.415  -0.108   6.200
   45   1HB   ASP   5          2HB       ASP   5  -0.623  -2.321   6.104
   46   2HB   ASP   5          1HB       ASP   5   1.094  -2.645   6.275
   47    H    ALA   6           H        ALA   6  -0.741  -1.445   3.750
   48    HA   ALA   6           HA       ALA   6   1.218  -2.587   2.109
   49   1HB   ALA   6          1HB       ALA   6  -1.431  -1.484   1.191
   50   2HB   ALA   6          2HB       ALA   6  -1.233  -3.035   2.007
   51   3HB   ALA   6          3HB       ALA   6  -0.478  -2.762   0.439
   52    H    ILE   7           H        ILE   7  -0.328   0.620   1.940
   53    HA   ILE   7           HA       ILE   7   1.071   1.483  -0.361
   54    HB   ILE   7           HB       ILE   7  -0.144   3.171   1.832
   55   1HG1  ILE   7          2HG1      ILE   7  -1.305   2.272  -0.819
   56   2HG1  ILE   7          1HG1      ILE   7  -1.745   1.616   0.755
   57   1HG2  ILE   7          1HG2      ILE   7   1.411   4.460   0.509
   58   2HG2  ILE   7          2HG2      ILE   7  -0.238   4.925   0.093
   59   3HG2  ILE   7          3HG2      ILE   7   0.679   3.872  -0.984
   60   1HD1  ILE   7          1HD1      ILE   7  -2.616   3.788   1.426
   61   2HD1  ILE   7          2HD1      ILE   7  -3.396   3.215  -0.047
   62   3HD1  ILE   7          3HD1      ILE   7  -2.155   4.464  -0.138
   63    H    MET   8           H        MET   8   1.700   1.854   3.098
   64    HA   MET   8           HA       MET   8   3.978   3.505   2.891
   65   1HB   MET   8          2HB       MET   8   2.708   3.146   4.982
   66   2HB   MET   8          1HB       MET   8   3.275   1.483   5.029
   67   1HG   MET   8          2HG       MET   8   4.807   2.351   6.422
   68   2HG   MET   8          1HG       MET   8   5.633   2.745   4.919
   69   1HE   MET   8          1HE       MET   8   5.689   5.207   3.851
   70   2HE   MET   8          2HE       MET   8   4.719   6.543   4.472
   71   3HE   MET   8          3HE       MET   8   3.930   5.134   3.761
   72    H    TYR   9           H        TYR   9   3.485   0.099   2.543
   73    HA   TYR   9           HA       TYR   9   6.197  -0.707   2.800
   74   1HB   TYR   9          2HB       TYR   9   4.367  -2.281   3.129
   75   2HB   TYR   9          1HB       TYR   9   3.841  -2.060   1.467
   76    HD1  TYR   9           HD1      TYR   9   6.967  -2.996   3.301
   77    HD2  TYR   9           HD2      TYR   9   4.391  -3.740  -0.005
   78    HE1  TYR   9           HE1      TYR   9   8.390  -4.884   2.622
   79    HE2  TYR   9           HE2      TYR   9   5.809  -5.627  -0.693
   80    HH   TYR   9           HH       TYR   9   8.084  -6.421  -0.413
   81    H    LYS  10           H        LYS  10   4.180   0.294   0.085
   82    HA   LYS  10           HA       LYS  10   6.285  -0.330  -1.814
   83   1HB   LYS  10          2HB       LYS  10   3.853  -0.654  -2.343
   84   2HB   LYS  10          1HB       LYS  10   3.674   1.096  -2.336
   85   1HG   LYS  10          2HG       LYS  10   5.207   1.301  -4.191
   86   2HG   LYS  10          1HG       LYS  10   5.512  -0.437  -4.163
   87   1HD   LYS  10          2HD       LYS  10   3.101  -0.810  -4.640
   88   2HD   LYS  10          1HD       LYS  10   2.902   0.936  -4.800
   89   1HE   LYS  10          2HE       LYS  10   4.450   0.972  -6.665
   90   2HE   LYS  10          1HE       LYS  10   4.773  -0.748  -6.462
   91   1HZ   LYS  10          1HZ       LYS  10   3.216  -0.353  -8.258
   92   2HZ   LYS  10          2HZ       LYS  10   2.153   0.444  -7.211
   93   3HZ   LYS  10          3HZ       LYS  10   2.461  -1.215  -7.011
   94    H    TYR  11           H        TYR  11   4.867   2.531  -0.301
   95    HA   TYR  11           HA       TYR  11   7.083   4.100  -1.432
   96   1HB   TYR  11          2HB       TYR  11   4.222   5.034  -1.105
   97   2HB   TYR  11          1HB       TYR  11   5.572   6.051  -1.591
   98    HD1  TYR  11           HD1      TYR  11   2.935   3.988  -2.735
   99    HD2  TYR  11           HD2      TYR  11   6.863   5.289  -3.726
  100    HE1  TYR  11           HE1      TYR  11   2.545   3.361  -5.082
  101    HE2  TYR  11           HE2      TYR  11   6.482   4.676  -6.074
  102    HH   TYR  11           HH       TYR  11   3.442   3.982  -7.336
  103    HA   PRO  12           HA       PRO  12   7.219   4.515   3.116
  104   1HB   PRO  12          2HB       PRO  12   9.899   4.495   3.338
  105   2HB   PRO  12          1HB       PRO  12   8.964   3.015   3.127
  106   1HG   PRO  12          2HG       PRO  12  10.501   4.580   1.101
  107   2HG   PRO  12          1HG       PRO  12  10.424   2.823   1.334
  108   1HD   PRO  12          2HD       PRO  12   8.981   4.160  -0.564
  109   2HD   PRO  12          1HD       PRO  12   8.455   2.635   0.173
  110    H    ASN  13           H        ASN  13   8.644   6.393   0.562
  111    HA   ASN  13           HA       ASN  13   9.410   8.549   2.352
  112   1HB   ASN  13          2HB       ASN  13   9.712   8.149  -0.620
  113   2HB   ASN  13          1HB       ASN  13  10.139   9.648   0.184
  114   1HD2  ASN  13          1HD2      ASN  13  11.010   6.374  -0.408
  115   2HD2  ASN  13          2HD2      ASN  13  12.558   6.403   0.381
  116    H    ALA  14           H        ALA  14   6.552   7.610   1.252
  117    HA   ALA  14           HA       ALA  14   5.568  10.210   0.387
  118   1HB   ALA  14          1HB       ALA  14   4.760   8.233  -0.777
  119   2HB   ALA  14          2HB       ALA  14   3.438   9.058   0.050
  120   3HB   ALA  14          3HB       ALA  14   4.125   7.585   0.736
  121    H    VAL  15           H        VAL  15   4.002  11.404   1.533
  122    HA   VAL  15           HA       VAL  15   4.197  10.983   4.427
  123    HB   VAL  15           HB       VAL  15   3.125  13.384   2.947
  124   1HG1  VAL  15          1HG1      VAL  15   3.959  13.013   5.829
  125   2HG1  VAL  15          2HG1      VAL  15   2.311  13.221   5.239
  126   3HG1  VAL  15          3HG1      VAL  15   3.469  14.544   5.102
  127   1HG2  VAL  15          1HG2      VAL  15   5.287  14.438   3.436
  128   2HG2  VAL  15          2HG2      VAL  15   5.466  13.034   2.384
  129   3HG2  VAL  15          3HG2      VAL  15   5.876  12.911   4.095
  130    H    SER  16           H        SER  16   2.561  10.288   5.621
  131    HA   SER  16           HA       SER  16   0.143   9.375   4.558
  132   1HB   SER  16          2HB       SER  16   0.639  10.092   7.452
  133   2HB   SER  16          1HB       SER  16  -0.461   8.866   6.817
  134    HG   SER  16           HG       SER  16   1.243   7.660   7.280
  135    H    ARG  17           H        ARG  17  -1.870  10.230   4.411
  136    HA   ARG  17           HA       ARG  17  -3.583  11.687   4.397
  137   1HB   ARG  17          2HB       ARG  17  -2.413  12.122   6.884
  138   2HB   ARG  17          1HB       ARG  17  -2.617  13.732   6.202
  139   1HG   ARG  17          2HG       ARG  17  -4.994  13.063   5.689
  140   2HG   ARG  17          1HG       ARG  17  -4.715  11.649   6.701
  141   1HD   ARG  17          2HD       ARG  17  -4.198  13.053   8.597
  142   2HD   ARG  17          1HD       ARG  17  -4.347  14.500   7.603
  143    HE   ARG  17           HE       ARG  17  -6.620  12.702   8.198
  144   1HH1  ARG  17          1HH1      ARG  17  -5.242  15.901   7.786
  145   2HH1  ARG  17          2HH1      ARG  17  -6.750  16.728   8.069
  146   1HH2  ARG  17          1HH2      ARG  17  -8.607  13.802   8.592
  147   2HH2  ARG  17          2HH2      ARG  17  -8.646  15.534   8.523
  148    H    LYS  18           H        LYS  18  -0.541  12.425   3.424
  149    HA   LYS  18           HA       LYS  18  -1.366  15.006   2.274
  150   1HB   LYS  18          2HB       LYS  18   0.633  15.070   3.752
  151   2HB   LYS  18          1HB       LYS  18   1.439  13.944   2.668
  152   1HG   LYS  18          2HG       LYS  18   1.337  15.567   0.869
  153   2HG   LYS  18          1HG       LYS  18   0.469  16.691   1.917
  154   1HD   LYS  18          2HD       LYS  18   2.408  16.726   3.437
  155   2HD   LYS  18          1HD       LYS  18   3.275  15.665   2.326
  156   1HE   LYS  18          2HE       LYS  18   3.933  17.983   1.996
  157   2HE   LYS  18          1HE       LYS  18   3.103  17.360   0.570
  158   1HZ   LYS  18          1HZ       LYS  18   1.907  19.085   2.675
  159   2HZ   LYS  18          2HZ       LYS  18   1.073  18.459   1.337
  160   3HZ   LYS  18          3HZ       LYS  18   2.333  19.568   1.106
  161    H    ASP  19           H        ASP  19   0.831  12.301   1.478
  162    HA   ASP  19           HA       ASP  19   0.274  12.648  -1.350
  163   1HB   ASP  19          2HB       ASP  19   2.017  10.681   0.145
  164   2HB   ASP  19          1HB       ASP  19   1.857  10.713  -1.608
  165    H    PHE  20           H        PHE  20  -0.363  10.337   1.220
  166    HA   PHE  20           HA       PHE  20  -2.626   9.389  -0.369
  167   1HB   PHE  20          2HB       PHE  20  -2.302   7.088   0.497
  168   2HB   PHE  20          1HB       PHE  20  -0.992   7.618  -0.544
  169    HD1  PHE  20           HD1      PHE  20   1.165   8.404   0.563
  170    HD2  PHE  20           HD2      PHE  20  -1.890   6.291   2.643
  171    HE1  PHE  20           HE1      PHE  20   2.786   7.775   2.295
  172    HE2  PHE  20           HE2      PHE  20  -0.269   5.668   4.386
  173    HZ   PHE  20           HZ       PHE  20   2.074   6.409   4.213
  174    H    GLU  21           H        GLU  21  -4.375   9.950   0.621
  175    HA   GLU  21           HA       GLU  21  -4.367  10.299   3.527
  176   1HB   GLU  21          2HB       GLU  21  -5.156  12.161   2.142
  177   2HB   GLU  21          1HB       GLU  21  -6.377  11.122   1.427
  178   1HG   GLU  21          2HG       GLU  21  -7.532  10.950   3.523
  179   2HG   GLU  21          1HG       GLU  21  -6.248  11.841   4.343
  180    H    LEU  22           H        LEU  22  -5.824   9.198   4.868
  181    HA   LEU  22           HA       LEU  22  -6.792   6.707   3.648
  182   1HB   LEU  22          2HB       LEU  22  -6.130   7.202   6.541
  183   2HB   LEU  22          1HB       LEU  22  -6.493   5.663   5.792
  184    HG   LEU  22           HG       LEU  22  -4.058   7.329   5.161
  185   1HD1  LEU  22          1HD1      LEU  22  -3.989   6.501   7.450
  186   2HD1  LEU  22          2HD1      LEU  22  -2.825   5.648   6.435
  187   3HD1  LEU  22          3HD1      LEU  22  -4.344   4.871   6.882
  188   1HD2  LEU  22          1HD2      LEU  22  -4.754   5.915   3.308
  189   2HD2  LEU  22          2HD2      LEU  22  -4.833   4.519   4.381
  190   3HD2  LEU  22          3HD2      LEU  22  -3.280   5.284   4.044
  191    H    ARG  23           H        ARG  23  -8.721   5.802   4.326
  192    HA   ARG  23           HA       ARG  23 -10.523   7.465   5.956
  193   1HB   ARG  23          2HB       ARG  23 -11.102   7.726   3.556
  194   2HB   ARG  23          1HB       ARG  23 -11.269   5.986   3.419
  195   1HG   ARG  23          2HG       ARG  23 -13.150   6.036   4.963
  196   2HG   ARG  23          1HG       ARG  23 -12.962   7.785   5.139
  197   1HD   ARG  23          2HD       ARG  23 -13.284   7.981   2.669
  198   2HD   ARG  23          1HD       ARG  23 -13.671   6.263   2.638
  199    HE   ARG  23           HE       ARG  23 -15.502   6.963   4.305
  200   1HH1  ARG  23          1HH1      ARG  23 -14.273   8.993   1.740
  201   2HH1  ARG  23          2HH1      ARG  23 -15.791   9.793   1.455
  202   1HH2  ARG  23          1HH2      ARG  23 -17.525   8.026   3.952
  203   2HH2  ARG  23          2HH2      ARG  23 -17.638   9.249   2.715
  204    H    ASN  24           H        ASN  24 -11.212   6.316   7.658
  205    HA   ASN  24           HA       ASN  24 -10.906   3.409   7.563
  206   1HB   ASN  24          2HB       ASN  24  -9.855   4.582   9.444
  207   2HB   ASN  24          1HB       ASN  24 -11.422   5.234   9.919
  208   1HD2  ASN  24          1HD2      ASN  24 -11.398   4.276  11.921
  209   2HD2  ASN  24          2HD2      ASN  24 -11.577   2.564  12.144
  210    H    ASP  25           H        ASP  25 -12.581   2.234   7.069
  211    HA   ASP  25           HA       ASP  25 -15.284   3.308   7.417
  212   1HB   ASP  25          2HB       ASP  25 -14.654   2.408   5.217
  213   2HB   ASP  25          1HB       ASP  25 -14.296   0.849   5.951
  214    H    GLY  26           H        GLY  26 -13.115   1.361   9.045
  215   1HA   GLY  26          2HA       GLY  26 -13.692   0.340  11.151
  216   2HA   GLY  26          1HA       GLY  26 -15.281  -0.029  10.487
  217    H    ASN  27           H        ASN  27 -14.764  -1.167   8.127
  218    HA   ASN  27           HA       ASN  27 -13.692  -3.725   8.741
  219   1HB   ASN  27          2HB       ASN  27 -15.507  -3.369   7.085
  220   2HB   ASN  27          1HB       ASN  27 -14.365  -2.531   6.041
  221   1HD2  ASN  27          1HD2      ASN  27 -12.974  -3.710   4.780
  222   2HD2  ASN  27          2HD2      ASN  27 -13.023  -5.438   4.675
  223    H    GLY  28           H        GLY  28 -12.369  -0.804   7.737
  224   1HA   GLY  28          2HA       GLY  28  -9.746  -1.435   8.080
  225   2HA   GLY  28          1HA       GLY  28 -10.055  -1.829   6.395
  226    H    SER  29           H        SER  29  -8.245   0.120   7.232
  227    HA   SER  29           HA       SER  29  -9.536   2.638   6.480
  228   1HB   SER  29          2HB       SER  29  -6.687   2.142   7.395
  229   2HB   SER  29          1HB       SER  29  -7.466   3.711   7.198
  230    HG   SER  29           HG       SER  29  -8.496   1.737   8.962
  231    H    TYR  30           H        TYR  30  -9.674   2.909   4.337
  232    HA   TYR  30           HA       TYR  30  -7.476   1.877   2.674
  233   1HB   TYR  30          2HB       TYR  30  -9.154   1.788   0.825
  234   2HB   TYR  30          1HB       TYR  30  -9.501   0.703   2.163
  235    HD1  TYR  30           HD1      TYR  30 -11.443   1.040   3.567
  236    HD2  TYR  30           HD2      TYR  30 -10.562   3.733   0.397
  237    HE1  TYR  30           HE1      TYR  30 -13.714   1.966   3.729
  238    HE2  TYR  30           HE2      TYR  30 -12.826   4.667   0.555
  239    HH   TYR  30           HH       TYR  30 -15.052   3.935   1.343
  240    H    ILE  31           H        ILE  31  -8.115   3.172   0.304
  241    HA   ILE  31           HA       ILE  31  -6.766   5.643   0.824
  242    HB   ILE  31           HB       ILE  31  -7.831   4.612  -1.809
  243   1HG1  ILE  31          2HG1      ILE  31  -5.067   4.291  -0.616
  244   2HG1  ILE  31          1HG1      ILE  31  -6.283   3.017  -0.681
  245   1HG2  ILE  31          1HG2      ILE  31  -6.153   6.080  -2.800
  246   2HG2  ILE  31          2HG2      ILE  31  -5.681   6.642  -1.196
  247   3HG2  ILE  31          3HG2      ILE  31  -7.295   6.995  -1.816
  248   1HD1  ILE  31          1HD1      ILE  31  -6.230   3.118  -3.129
  249   2HD1  ILE  31          2HD1      ILE  31  -4.648   2.749  -2.445
  250   3HD1  ILE  31          3HD1      ILE  31  -4.993   4.372  -3.047
  251    H    GLU  32           H        GLU  32  -7.682   7.493   1.254
  252    HA   GLU  32           HA       GLU  32 -10.419   8.082   0.398
  253   1HB   GLU  32          2HB       GLU  32  -9.882   8.611   2.710
  254   2HB   GLU  32          1HB       GLU  32  -8.475   9.529   2.213
  255   1HG   GLU  32          2HG       GLU  32 -10.162  11.072   2.828
  256   2HG   GLU  32          1HG       GLU  32 -10.002  11.131   1.076
  257    H    LYS  33           H        LYS  33  -7.265   9.711   0.441
  258    HA   LYS  33           HA       LYS  33  -7.980  11.045  -2.083
  259   1HB   LYS  33          2HB       LYS  33  -7.842  12.435   0.092
  260   2HB   LYS  33          1HB       LYS  33  -6.109  12.179  -0.013
  261   1HG   LYS  33          2HG       LYS  33  -6.528  14.276  -0.974
  262   2HG   LYS  33          1HG       LYS  33  -6.227  13.186  -2.321
  263   1HD   LYS  33          2HD       LYS  33  -8.082  14.428  -2.980
  264   2HD   LYS  33          1HD       LYS  33  -8.748  12.901  -2.423
  265   1HE   LYS  33          2HE       LYS  33  -8.559  15.338  -0.672
  266   2HE   LYS  33          1HE       LYS  33  -9.960  14.982  -1.670
  267   1HZ   LYS  33          1HZ       LYS  33 -10.399  14.183   0.508
  268   2HZ   LYS  33          2HZ       LYS  33  -8.913  13.377   0.604
  269   3HZ   LYS  33          3HZ       LYS  33 -10.116  12.820  -0.459
  270    H    TRP  34           H        TRP  34  -6.734  10.377  -3.707
  271    HA   TRP  34           HA       TRP  34  -4.066   9.315  -3.120
  272   1HB   TRP  34          2HB       TRP  34  -5.708   7.968  -4.475
  273   2HB   TRP  34          1HB       TRP  34  -5.633   9.216  -5.711
  274    HD1  TRP  34           HD1      TRP  34  -3.803   8.953  -7.500
  275    HE1  TRP  34           HE1      TRP  34  -1.806   7.363  -7.847
  276    HE3  TRP  34           HE3      TRP  34  -3.811   6.643  -2.937
  277    HZ2  TRP  34           HZ2      TRP  34  -0.418   5.399  -6.375
  278    HZ3  TRP  34           HZ3      TRP  34  -2.112   4.921  -2.489
  279    HH2  TRP  34           HH2      TRP  34  -0.451   4.314  -4.174
  280    H    ASN  35           H        ASN  35  -2.490  10.787  -3.215
  281    HA   ASN  35           HA       ASN  35  -2.789  13.030  -5.113
  282   1HB   ASN  35          2HB       ASN  35  -2.743  13.305  -2.461
  283   2HB   ASN  35          1HB       ASN  35  -1.005  13.248  -2.732
  284   1HD2  ASN  35          1HD2      ASN  35  -2.737  15.401  -1.789
  285   2HD2  ASN  35          2HD2      ASN  35  -2.475  16.731  -2.865
  286    H    LEU  36           H        LEU  36  -1.377  10.241  -5.026
  287    HA   LEU  36           HA       LEU  36   1.349  11.046  -5.625
  288   1HB   LEU  36          2HB       LEU  36  -0.012   8.362  -5.494
  289   2HB   LEU  36          1HB       LEU  36   1.648   8.566  -6.011
  290    HG   LEU  36           HG       LEU  36   0.592   9.342  -3.298
  291   1HD1  LEU  36          1HD1      LEU  36   1.827   7.411  -2.475
  292   2HD1  LEU  36          2HD1      LEU  36   2.268   6.978  -4.126
  293   3HD1  LEU  36          3HD1      LEU  36   0.579   6.918  -3.620
  294   1HD2  LEU  36          1HD2      LEU  36   3.403   9.220  -4.380
  295   2HD2  LEU  36          2HD2      LEU  36   2.946   9.613  -2.722
  296   3HD2  LEU  36          3HD2      LEU  36   2.491  10.691  -4.041
  297    H    ARG  37           H        ARG  37   2.260  11.036  -7.622
  298    HA   ARG  37           HA       ARG  37   0.459  11.078  -9.887
  299   1HB   ARG  37          2HB       ARG  37   3.425  11.583  -9.619
  300   2HB   ARG  37          1HB       ARG  37   2.552  11.707 -11.140
  301   1HG   ARG  37          2HG       ARG  37   1.248  13.520 -10.345
  302   2HG   ARG  37          1HG       ARG  37   1.828  13.295  -8.694
  303   1HD   ARG  37          2HD       ARG  37   3.531  14.092 -11.054
  304   2HD   ARG  37          1HD       ARG  37   2.909  15.199  -9.830
  305    HE   ARG  37           HE       ARG  37   4.733  12.970  -9.161
  306   1HH1  ARG  37          1HH1      ARG  37   3.852  16.366  -9.012
  307   2HH1  ARG  37          2HH1      ARG  37   5.115  16.770  -7.884
  308   1HH2  ARG  37          1HH2      ARG  37   6.381  13.508  -7.689
  309   2HH2  ARG  37          2HH2      ARG  37   6.531  15.141  -7.111
  310    H    ALA  38           H        ALA  38   0.458   8.613  -8.813
  311    HA   ALA  38           HA       ALA  38   1.766   6.970 -10.869
  312   1HB   ALA  38          1HB       ALA  38   1.552   6.315  -7.930
  313   2HB   ALA  38          2HB       ALA  38   3.034   6.705  -8.802
  314   3HB   ALA  38          3HB       ALA  38   2.152   5.224  -9.178
  315    HA   PRO  39           HA       PRO  39  -2.274   5.395 -11.704
  316   1HB   PRO  39          2HB       PRO  39  -0.981   2.720 -11.822
  317   2HB   PRO  39          1HB       PRO  39  -1.954   3.556 -13.036
  318   1HG   PRO  39          2HG       PRO  39   0.697   3.348 -13.294
  319   2HG   PRO  39          1HG       PRO  39  -0.173   4.805 -13.805
  320   1HD   PRO  39          2HD       PRO  39   1.511   4.357 -11.388
  321   2HD   PRO  39          1HD       PRO  39   1.308   5.821 -12.370
  322    H    LEU  40           H        LEU  40  -3.969   4.487 -10.637
  323    HA   LEU  40           HA       LEU  40  -3.751   3.849  -7.907
  324   1HB   LEU  40          2HB       LEU  40  -5.892   3.713  -9.966
  325   2HB   LEU  40          1HB       LEU  40  -6.130   2.809  -8.489
  326    HG   LEU  40           HG       LEU  40  -7.223   4.969  -8.335
  327   1HD1  LEU  40          1HD1      LEU  40  -6.218   5.787  -6.272
  328   2HD1  LEU  40          2HD1      LEU  40  -4.756   4.859  -6.604
  329   3HD1  LEU  40          3HD1      LEU  40  -6.278   4.025  -6.294
  330   1HD2  LEU  40          1HD2      LEU  40  -4.488   6.154  -8.795
  331   2HD2  LEU  40          2HD2      LEU  40  -5.945   7.052  -8.364
  332   3HD2  LEU  40          3HD2      LEU  40  -5.851   6.213  -9.913
  333    HA   PRO  41           HA       PRO  41  -2.163  -0.278  -8.224
  334   1HB   PRO  41          2HB       PRO  41  -2.921  -1.037  -5.669
  335   2HB   PRO  41          1HB       PRO  41  -1.421  -0.216  -6.092
  336   1HG   PRO  41          2HG       PRO  41  -3.944   0.903  -4.979
  337   2HG   PRO  41          1HG       PRO  41  -2.266   1.369  -4.647
  338   1HD   PRO  41          2HD       PRO  41  -3.874   2.831  -6.241
  339   2HD   PRO  41          1HD       PRO  41  -2.129   2.692  -6.533
  340    H    THR  42           H        THR  42  -2.888  -2.322  -8.538
  341    HA   THR  42           HA       THR  42  -5.733  -2.587  -9.020
  342    HB   THR  42           HB       THR  42  -5.082  -4.835  -9.941
  343    HG1  THR  42           HG1      THR  42  -2.417  -4.258 -10.099
  344   1HG2  THR  42          1HG2      THR  42  -3.927  -3.939 -11.913
  345   2HG2  THR  42          2HG2      THR  42  -3.559  -2.461 -11.022
  346   3HG2  THR  42          3HG2      THR  42  -5.233  -2.874 -11.392
  347    H    GLN  43           H        GLN  43  -6.954  -4.452  -8.245
  348    HA   GLN  43           HA       GLN  43  -6.871  -4.744  -5.468
  349   1HB   GLN  43          2HB       GLN  43  -8.809  -5.204  -7.047
  350   2HB   GLN  43          1HB       GLN  43  -8.062  -6.754  -7.375
  351   1HG   GLN  43          2HG       GLN  43  -9.880  -6.841  -5.696
  352   2HG   GLN  43          1HG       GLN  43  -8.331  -7.455  -5.118
  353   1HE2  GLN  43          1HE2      GLN  43  -7.226  -6.347  -3.544
  354   2HE2  GLN  43          2HE2      GLN  43  -7.952  -5.087  -2.606
  355    H    ALA  44           H        ALA  44  -5.711  -6.843  -8.036
  356    HA   ALA  44           HA       ALA  44  -4.739  -8.961  -6.524
  357   1HB   ALA  44          1HB       ALA  44  -3.533  -7.830  -9.044
  358   2HB   ALA  44          2HB       ALA  44  -4.881  -8.964  -8.969
  359   3HB   ALA  44          3HB       ALA  44  -3.284  -9.455  -8.405
  360    H    GLU  45           H        GLU  45  -2.965  -6.030  -7.562
  361    HA   GLU  45           HA       GLU  45  -0.571  -6.710  -6.267
  362   1HB   GLU  45          2HB       GLU  45  -1.473  -4.635  -7.917
  363   2HB   GLU  45          1HB       GLU  45  -0.948  -3.848  -6.432
  364   1HG   GLU  45          2HG       GLU  45   1.195  -5.039  -6.604
  365   2HG   GLU  45          1HG       GLU  45   0.673  -5.724  -8.136
  366    H    LEU  46           H        LEU  46  -3.331  -4.744  -5.242
  367    HA   LEU  46           HA       LEU  46  -2.412  -3.852  -2.794
  368   1HB   LEU  46          2HB       LEU  46  -5.173  -4.715  -3.642
  369   2HB   LEU  46          1HB       LEU  46  -4.837  -3.932  -2.119
  370    HG   LEU  46           HG       LEU  46  -4.301  -2.703  -4.819
  371   1HD1  LEU  46          1HD1      LEU  46  -6.554  -2.241  -2.866
  372   2HD1  LEU  46          2HD1      LEU  46  -6.684  -2.931  -4.484
  373   3HD1  LEU  46          3HD1      LEU  46  -6.215  -1.244  -4.280
  374   1HD2  LEU  46          1HD2      LEU  46  -2.820  -1.888  -3.063
  375   2HD2  LEU  46          2HD2      LEU  46  -4.216  -1.526  -2.047
  376   3HD2  LEU  46          3HD2      LEU  46  -3.968  -0.646  -3.557
  377    H    GLU  47           H        GLU  47  -4.201  -6.865  -3.466
  378    HA   GLU  47           HA       GLU  47  -4.026  -7.752  -0.776
  379   1HB   GLU  47          2HB       GLU  47  -4.778  -9.196  -3.311
  380   2HB   GLU  47          1HB       GLU  47  -4.868  -9.922  -1.709
  381   1HG   GLU  47          2HG       GLU  47  -6.411  -8.127  -1.019
  382   2HG   GLU  47          1HG       GLU  47  -6.368  -7.493  -2.660
  383    H    THR  48           H        THR  48  -1.867  -7.941  -3.446
  384    HA   THR  48           HA       THR  48  -0.328 -10.165  -2.528
  385    HB   THR  48           HB       THR  48   0.500  -7.845  -4.301
  386    HG1  THR  48           HG1      THR  48  -1.219  -9.223  -5.113
  387   1HG2  THR  48          1HG2      THR  48   2.323  -9.312  -5.037
  388   2HG2  THR  48          2HG2      THR  48   1.823 -10.524  -3.857
  389   3HG2  THR  48          3HG2      THR  48   2.440  -8.966  -3.311
  390    H    TRP  49           H        TRP  49   0.006  -6.628  -2.187
  391    HA   TRP  49           HA       TRP  49   2.302  -6.658  -0.568
  392   1HB   TRP  49          2HB       TRP  49   0.045  -4.648  -0.438
  393   2HB   TRP  49          1HB       TRP  49   1.705  -4.398   0.083
  394    HD1  TRP  49           HD1      TRP  49   2.892  -5.793  -2.705
  395    HE1  TRP  49           HE1      TRP  49   2.902  -4.318  -4.813
  396    HE3  TRP  49           HE3      TRP  49  -0.546  -2.298  -1.268
  397    HZ2  TRP  49           HZ2      TRP  49   1.629  -1.980  -5.732
  398    HZ3  TRP  49           HZ3      TRP  49  -1.086  -0.471  -2.820
  399    HH2  TRP  49           HH2      TRP  49  -0.016  -0.318  -5.004
  400    H    TRP  50           H        TRP  50  -1.137  -6.793   0.207
  401    HA   TRP  50           HA       TRP  50  -0.941  -6.807   2.998
  402   1HB   TRP  50          2HB       TRP  50  -3.072  -6.538   1.814
  403   2HB   TRP  50          1HB       TRP  50  -2.963  -8.191   1.221
  404    HD1  TRP  50           HD1      TRP  50  -4.204  -9.933   2.610
  405    HE1  TRP  50           HE1      TRP  50  -5.179 -10.047   4.992
  406    HE3  TRP  50           HE3      TRP  50  -2.508  -5.447   4.379
  407    HZ2  TRP  50           HZ2      TRP  50  -5.204  -8.437   7.319
  408    HZ3  TRP  50           HZ3      TRP  50  -3.049  -4.812   6.694
  409    HH2  TRP  50           HH2      TRP  50  -4.370  -6.277   8.130
  410    H    GLU  51           H        GLU  51  -0.863  -9.472   0.660
  411    HA   GLU  51           HA       GLU  51  -0.653 -11.585   2.473
  412   1HB   GLU  51          2HB       GLU  51  -0.135 -11.155  -0.393
  413   2HB   GLU  51          1HB       GLU  51   0.735 -12.490   0.330
  414   1HG   GLU  51          2HG       GLU  51  -1.491 -13.270   1.227
  415   2HG   GLU  51          1HG       GLU  51  -2.223 -12.078   0.153
  416    H    GLU  52           H        GLU  52   1.899  -9.756   0.799
  417    HA   GLU  52           HA       GLU  52   4.045 -11.167   1.959
  418   1HB   GLU  52          2HB       GLU  52   3.936  -8.373   0.822
  419   2HB   GLU  52          1HB       GLU  52   5.421  -9.219   1.245
  420   1HG   GLU  52          2HG       GLU  52   4.908 -10.955  -0.374
  421   2HG   GLU  52          1HG       GLU  52   3.402 -10.138  -0.783
  422    H    LEU  53           H        LEU  53   2.249  -8.324   2.984
  423    HA   LEU  53           HA       LEU  53   3.827  -7.640   5.215
  424   1HB   LEU  53          2HB       LEU  53   2.098  -6.173   4.288
  425   2HB   LEU  53          1HB       LEU  53   0.855  -7.312   4.771
  426    HG   LEU  53           HG       LEU  53   1.612  -6.936   7.158
  427   1HD1  LEU  53          1HD1      LEU  53   3.037  -4.604   5.882
  428   2HD1  LEU  53          2HD1      LEU  53   3.796  -5.979   6.686
  429   3HD1  LEU  53          3HD1      LEU  53   2.806  -4.851   7.613
  430   1HD2  LEU  53          1HD2      LEU  53   0.472  -4.611   5.615
  431   2HD2  LEU  53          2HD2      LEU  53   0.352  -4.847   7.359
  432   3HD2  LEU  53          3HD2      LEU  53  -0.431  -5.981   6.260
  433    H    GLN  54           H        GLN  54   1.003  -9.785   4.895
  434    HA   GLN  54           HA       GLN  54   0.920 -10.515   7.633
  435   1HB   GLN  54          2HB       GLN  54  -0.233 -11.742   5.137
  436   2HB   GLN  54          1HB       GLN  54  -0.527 -12.387   6.738
  437   1HG   GLN  54          2HG       GLN  54  -1.231  -9.608   5.830
  438   2HG   GLN  54          1HG       GLN  54  -2.355 -10.961   5.958
  439   1HE2  GLN  54          1HE2      GLN  54  -0.454  -8.637   7.704
  440   2HE2  GLN  54          2HE2      GLN  54  -1.177  -8.903   9.252
  441    H    LYS  55           H        LYS  55   2.653 -11.702   4.865
  442    HA   LYS  55           HA       LYS  55   3.596 -14.084   6.204
  443   1HB   LYS  55          2HB       LYS  55   3.192 -13.669   3.658
  444   2HB   LYS  55          1HB       LYS  55   4.800 -12.956   3.706
  445   1HG   LYS  55          2HG       LYS  55   5.736 -15.031   4.496
  446   2HG   LYS  55          1HG       LYS  55   4.131 -15.754   4.587
  447   1HD   LYS  55          2HD       LYS  55   3.862 -15.483   2.176
  448   2HD   LYS  55          1HD       LYS  55   5.460 -14.747   2.079
  449   1HE   LYS  55          2HE       LYS  55   4.910 -17.552   3.036
  450   2HE   LYS  55          1HE       LYS  55   5.431 -17.128   1.406
  451   1HZ   LYS  55          1HZ       LYS  55   7.338 -17.775   2.617
  452   2HZ   LYS  55          2HZ       LYS  55   6.946 -16.785   3.933
  453   3HZ   LYS  55          3HZ       LYS  55   7.423 -16.090   2.462
  454    H    ASN  56           H        ASN  56   4.185 -10.965   6.614
  455    HA   ASN  56           HA       ASN  56   5.746  -9.685   7.606
  456   1HB   ASN  56          2HB       ASN  56   5.854 -11.702   9.156
  457   2HB   ASN  56          1HB       ASN  56   7.286 -12.188   8.267
  458   1HD2  ASN  56          1HD2      ASN  56   9.172 -11.099   8.575
  459   2HD2  ASN  56          2HD2      ASN  56   9.372  -9.891   9.792
  460    HA   PRO  57           HA       PRO  57   8.473  -9.647   4.010
  461   1HB   PRO  57          2HB       PRO  57   8.469  -6.981   3.671
  462   2HB   PRO  57          1HB       PRO  57   7.097  -7.980   3.184
  463   1HG   PRO  57          2HG       PRO  57   7.434  -6.274   5.611
  464   2HG   PRO  57          1HG       PRO  57   5.999  -6.512   4.597
  465   1HD   PRO  57          2HD       PRO  57   6.440  -7.772   7.012
  466   2HD   PRO  57          1HD       PRO  57   5.367  -8.382   5.738
  467    HA   PRO  58           HA       PRO  58  12.235  -8.746   6.199
  468   1HB   PRO  58          2HB       PRO  58  13.948  -8.626   4.105
  469   2HB   PRO  58          1HB       PRO  58  13.288 -10.143   4.721
  470   1HG   PRO  58          2HG       PRO  58  12.463  -8.544   2.337
  471   2HG   PRO  58          1HG       PRO  58  12.587 -10.302   2.518
  472   1HD   PRO  58          2HD       PRO  58  10.227  -8.927   2.640
  473   2HD   PRO  58          1HD       PRO  58  10.508 -10.474   3.466
  474    H    TYR  59           H        TYR  59  13.688  -7.084   6.583
  475    HA   TYR  59           HA       TYR  59  12.750  -4.463   5.963
  476   1HB   TYR  59          2HB       TYR  59  13.851  -5.083   8.117
  477   2HB   TYR  59          1HB       TYR  59  15.363  -5.308   7.249
  478    HD1  TYR  59           HD1      TYR  59  12.861  -2.798   8.298
  479    HD2  TYR  59           HD2      TYR  59  16.757  -3.452   6.713
  480    HE1  TYR  59           HE1      TYR  59  13.399  -0.425   8.655
  481    HE2  TYR  59           HE2      TYR  59  17.305  -1.081   7.069
  482    HH   TYR  59           HH       TYR  59  15.383   0.996   8.949
  483    H    GLU  60           H        GLU  60  13.423  -3.078   4.397
  484    HA   GLU  60           HA       GLU  60  14.942  -4.080   2.219
  485   1HB   GLU  60          2HB       GLU  60  13.175  -2.380   1.944
  486   2HB   GLU  60          1HB       GLU  60  14.151  -1.225   2.841
  487   1HG   GLU  60          2HG       GLU  60  15.902  -1.434   1.096
  488   2HG   GLU  60          1HG       GLU  60  14.804  -2.460   0.175
  Start of MODEL   16
    1   1H    MET   1          1H        MET   1  -9.993  -4.019   5.324
    2   2H    MET   1          2H        MET   1  -9.238  -4.564   6.736
    3   3H    MET   1          3H        MET   1  -9.727  -5.676   5.556
    4    HA   MET   1           HA       MET   1  -7.356  -5.356   5.470
    5   1HB   MET   1          2HB       MET   1  -8.604  -5.796   3.379
    6   2HB   MET   1          1HB       MET   1  -8.781  -4.065   3.131
    7   1HG   MET   1          2HG       MET   1  -6.357  -3.841   2.952
    8   2HG   MET   1          1HG       MET   1  -6.178  -5.576   3.195
    9   1HE   MET   1          1HE       MET   1  -4.905  -4.014   0.716
   10   2HE   MET   1          2HE       MET   1  -5.259  -5.156  -0.582
   11   3HE   MET   1          3HE       MET   1  -4.737  -5.747   0.995
   12    H    ILE   2           H        ILE   2  -5.761  -4.053   6.092
   13    HA   ILE   2           HA       ILE   2  -6.269  -1.201   6.381
   14    HB   ILE   2           HB       ILE   2  -3.745  -2.685   7.099
   15   1HG1  ILE   2          2HG1      ILE   2  -5.658  -3.690   8.288
   16   2HG1  ILE   2          1HG1      ILE   2  -4.605  -2.821   9.398
   17   1HG2  ILE   2          1HG2      ILE   2  -3.496  -0.283   6.922
   18   2HG2  ILE   2          2HG2      ILE   2  -3.387  -0.777   8.612
   19   3HG2  ILE   2          3HG2      ILE   2  -4.868  -0.040   8.004
   20   1HD1  ILE   2          1HD1      ILE   2  -7.198  -1.790   8.272
   21   2HD1  ILE   2          2HD1      ILE   2  -6.158  -0.956   9.426
   22   3HD1  ILE   2          3HD1      ILE   2  -6.963  -2.454   9.890
   23    H    LEU   3           H        LEU   3  -5.990  -0.051   4.561
   24    HA   LEU   3           HA       LEU   3  -4.219  -0.787   2.475
   25   1HB   LEU   3          2HB       LEU   3  -6.207   1.244   3.009
   26   2HB   LEU   3          1HB       LEU   3  -4.816   1.917   2.196
   27    HG   LEU   3           HG       LEU   3  -6.502   1.285   0.578
   28   1HD1  LEU   3          1HD1      LEU   3  -4.143  -0.590   0.525
   29   2HD1  LEU   3          2HD1      LEU   3  -4.182   1.059  -0.099
   30   3HD1  LEU   3          3HD1      LEU   3  -5.172  -0.191  -0.851
   31   1HD2  LEU   3          1HD2      LEU   3  -6.228  -1.516   1.669
   32   2HD2  LEU   3          2HD2      LEU   3  -7.207  -1.022   0.287
   33   3HD2  LEU   3          3HD2      LEU   3  -7.614  -0.451   1.904
   34    H    TYR   4           H        TYR   4  -4.062   1.394   5.193
   35    HA   TYR   4           HA       TYR   4  -1.905   2.984   4.573
   36   1HB   TYR   4          2HB       TYR   4  -3.233   3.366   6.557
   37   2HB   TYR   4          1HB       TYR   4  -2.716   1.835   7.248
   38    HD1  TYR   4           HD1      TYR   4  -0.997   1.847   8.791
   39    HD2  TYR   4           HD2      TYR   4  -1.258   5.054   6.005
   40    HE1  TYR   4           HE1      TYR   4   0.868   2.977   9.926
   41    HE2  TYR   4           HE2      TYR   4   0.608   6.193   7.133
   42    HH   TYR   4           HH       TYR   4   2.612   4.659   9.388
   43    H    ASP   5           H        ASP   5  -1.819  -0.193   6.168
   44    HA   ASP   5           HA       ASP   5   0.967  -0.181   6.612
   45   1HB   ASP   5          2HB       ASP   5  -1.116  -1.744   7.447
   46   2HB   ASP   5          1HB       ASP   5  -0.262  -2.816   6.342
   47    H    ALA   6           H        ALA   6  -1.038  -1.423   4.011
   48    HA   ALA   6           HA       ALA   6   1.012  -2.837   2.660
   49   1HB   ALA   6          1HB       ALA   6  -0.535  -2.872   0.765
   50   2HB   ALA   6          2HB       ALA   6  -1.565  -1.697   1.583
   51   3HB   ALA   6          3HB       ALA   6  -1.348  -3.309   2.268
   52    H    ILE   7           H        ILE   7  -0.318   0.431   2.275
   53    HA   ILE   7           HA       ILE   7   1.216   1.192   0.047
   54    HB   ILE   7           HB       ILE   7   0.145   2.938   2.273
   55   1HG1  ILE   7          2HG1      ILE   7  -1.014   2.358  -0.462
   56   2HG1  ILE   7          1HG1      ILE   7  -1.553   1.589   1.030
   57   1HG2  ILE   7          1HG2      ILE   7   1.124   3.673  -0.485
   58   2HG2  ILE   7          2HG2      ILE   7   1.893   4.082   1.048
   59   3HG2  ILE   7          3HG2      ILE   7   0.322   4.769   0.641
   60   1HD1  ILE   7          1HD1      ILE   7  -1.683   4.534   0.411
   61   2HD1  ILE   7          2HD1      ILE   7  -2.230   3.762   1.901
   62   3HD1  ILE   7          3HD1      ILE   7  -3.032   3.397   0.373
   63    H    MET   8           H        MET   8   1.778   1.641   3.528
   64    HA   MET   8           HA       MET   8   4.267   2.979   3.194
   65   1HB   MET   8          2HB       MET   8   2.775   3.121   5.213
   66   2HB   MET   8          1HB       MET   8   3.292   1.497   5.642
   67   1HG   MET   8          2HG       MET   8   4.526   3.144   6.904
   68   2HG   MET   8          1HG       MET   8   5.600   2.274   5.811
   69   1HE   MET   8          1HE       MET   8   7.464   4.145   6.163
   70   2HE   MET   8          2HE       MET   8   6.388   5.025   7.248
   71   3HE   MET   8          3HE       MET   8   7.177   5.866   5.912
   72    H    TYR   9           H        TYR   9   3.333  -0.339   3.230
   73    HA   TYR   9           HA       TYR   9   5.821  -1.497   3.931
   74   1HB   TYR   9          2HB       TYR   9   3.694  -2.742   3.987
   75   2HB   TYR   9          1HB       TYR   9   3.582  -2.628   2.236
   76    HD1  TYR   9           HD1      TYR   9   5.600  -4.062   4.994
   77    HD2  TYR   9           HD2      TYR   9   4.644  -4.216   0.850
   78    HE1  TYR   9           HE1      TYR   9   6.848  -6.170   4.792
   79    HE2  TYR   9           HE2      TYR   9   5.895  -6.322   0.636
   80    HH   TYR   9           HH       TYR   9   6.852  -8.173   3.246
   81    H    LYS  10           H        LYS  10   4.365  -0.571   0.842
   82    HA   LYS  10           HA       LYS  10   6.743  -1.483  -0.569
   83   1HB   LYS  10          2HB       LYS  10   4.471  -1.940  -1.489
   84   2HB   LYS  10          1HB       LYS  10   4.260  -0.209  -1.722
   85   1HG   LYS  10          2HG       LYS  10   6.160  -0.174  -3.253
   86   2HG   LYS  10          1HG       LYS  10   6.396  -1.903  -3.006
   87   1HD   LYS  10          2HD       LYS  10   4.098  -2.274  -3.885
   88   2HD   LYS  10          1HD       LYS  10   4.016  -0.553  -4.262
   89   1HE   LYS  10          2HE       LYS  10   6.044  -2.500  -5.360
   90   2HE   LYS  10          1HE       LYS  10   4.632  -1.895  -6.224
   91   1HZ   LYS  10          1HZ       LYS  10   6.889  -0.235  -5.226
   92   2HZ   LYS  10          2HZ       LYS  10   5.533   0.336  -6.077
   93   3HZ   LYS  10          3HZ       LYS  10   6.639  -0.696  -6.839
   94    H    TYR  11           H        TYR  11   5.068   1.521   0.207
   95    HA   TYR  11           HA       TYR  11   7.325   2.998  -0.978
   96   1HB   TYR  11          2HB       TYR  11   4.452   3.933  -0.743
   97   2HB   TYR  11          1HB       TYR  11   5.786   4.846  -1.436
   98    HD1  TYR  11           HD1      TYR  11   6.972   3.784  -3.486
   99    HD2  TYR  11           HD2      TYR  11   3.119   2.617  -2.109
  100    HE1  TYR  11           HE1      TYR  11   6.476   2.833  -5.699
  101    HE2  TYR  11           HE2      TYR  11   2.612   1.666  -4.318
  102    HH   TYR  11           HH       TYR  11   3.358   1.948  -6.671
  103    HA   PRO  12           HA       PRO  12   7.506   4.238   3.421
  104   1HB   PRO  12          2HB       PRO  12  10.166   4.722   3.413
  105   2HB   PRO  12          1HB       PRO  12   9.501   3.100   3.621
  106   1HG   PRO  12          2HG       PRO  12  10.649   4.375   1.176
  107   2HG   PRO  12          1HG       PRO  12  10.869   2.724   1.784
  108   1HD   PRO  12          2HD       PRO  12   9.152   3.367  -0.233
  109   2HD   PRO  12          1HD       PRO  12   8.901   1.993   0.861
  110    H    ASN  13           H        ASN  13   8.240   5.651   0.434
  111    HA   ASN  13           HA       ASN  13   8.864   8.287   1.444
  112   1HB   ASN  13          2HB       ASN  13   8.497   7.188  -1.345
  113   2HB   ASN  13          1HB       ASN  13   8.868   8.867  -1.011
  114   1HD2  ASN  13          1HD2      ASN  13  10.728   8.581  -2.272
  115   2HD2  ASN  13          2HD2      ASN  13  12.126   7.798  -1.629
  116    H    ALA  14           H        ALA  14   6.092   6.632   1.318
  117    HA   ALA  14           HA       ALA  14   4.439   8.643   0.032
  118   1HB   ALA  14          1HB       ALA  14   3.922   6.282  -0.338
  119   2HB   ALA  14          2HB       ALA  14   2.587   7.104   0.472
  120   3HB   ALA  14          3HB       ALA  14   3.671   6.064   1.394
  121    H    VAL  15           H        VAL  15   4.165  10.437   1.204
  122    HA   VAL  15           HA       VAL  15   3.979  10.352   4.081
  123    HB   VAL  15           HB       VAL  15   3.517  12.713   2.249
  124   1HG1  VAL  15          1HG1      VAL  15   4.078  14.044   4.236
  125   2HG1  VAL  15          2HG1      VAL  15   4.192  12.563   5.186
  126   3HG1  VAL  15          3HG1      VAL  15   2.645  13.048   4.491
  127   1HG2  VAL  15          1HG2      VAL  15   5.736  11.782   1.855
  128   2HG2  VAL  15          2HG2      VAL  15   6.069  11.806   3.586
  129   3HG2  VAL  15          3HG2      VAL  15   5.854  13.322   2.710
  130    H    SER  16           H        SER  16   2.181   9.905   5.128
  131    HA   SER  16           HA       SER  16  -0.361   9.750   3.870
  132   1HB   SER  16          2HB       SER  16   0.217   9.779   6.838
  133   2HB   SER  16          1HB       SER  16  -1.191   9.090   6.031
  134    HG   SER  16           HG       SER  16   1.027   8.033   4.978
  135    H    ARG  17           H        ARG  17  -2.209  11.001   4.226
  136    HA   ARG  17           HA       ARG  17  -3.448  12.876   4.503
  137   1HB   ARG  17          2HB       ARG  17  -1.410  13.672   6.593
  138   2HB   ARG  17          1HB       ARG  17  -3.042  14.305   6.422
  139   1HG   ARG  17          2HG       ARG  17  -3.975  12.141   6.984
  140   2HG   ARG  17          1HG       ARG  17  -2.358  11.445   7.075
  141   1HD   ARG  17          2HD       ARG  17  -2.962  11.857   9.301
  142   2HD   ARG  17          1HD       ARG  17  -1.885  13.185   8.873
  143    HE   ARG  17           HE       ARG  17  -4.491  14.024   8.358
  144   1HH1  ARG  17          1HH1      ARG  17  -2.513  13.101  11.103
  145   2HH1  ARG  17          2HH1      ARG  17  -3.431  14.044  12.240
  146   1HH2  ARG  17          1HH2      ARG  17  -5.677  15.274   9.853
  147   2HH2  ARG  17          2HH2      ARG  17  -5.209  15.296  11.524
  148    H    LYS  18           H        LYS  18  -1.046  12.717   2.750
  149    HA   LYS  18           HA       LYS  18  -1.013  15.520   1.961
  150   1HB   LYS  18          2HB       LYS  18   0.984  15.367   3.310
  151   2HB   LYS  18          1HB       LYS  18   1.474  13.886   2.500
  152   1HG   LYS  18          2HG       LYS  18   1.662  15.213   0.382
  153   2HG   LYS  18          1HG       LYS  18   1.398  16.664   1.351
  154   1HD   LYS  18          2HD       LYS  18   3.375  16.273   2.616
  155   2HD   LYS  18          1HD       LYS  18   3.583  14.670   1.910
  156   1HE   LYS  18          2HE       LYS  18   3.778  17.306   0.459
  157   2HE   LYS  18          1HE       LYS  18   5.125  16.265   0.910
  158   1HZ   LYS  18          1HZ       LYS  18   4.000  14.508  -0.509
  159   2HZ   LYS  18          2HZ       LYS  18   4.701  15.817  -1.334
  160   3HZ   LYS  18          3HZ       LYS  18   3.021  15.757  -1.116
  161    H    ASP  19           H        ASP  19   0.865  12.632   1.048
  162    HA   ASP  19           HA       ASP  19   0.260  13.050  -1.743
  163   1HB   ASP  19          2HB       ASP  19   1.917  11.036  -0.243
  164   2HB   ASP  19          1HB       ASP  19   1.568  10.828  -1.954
  165    H    PHE  20           H        PHE  20  -1.055  11.289   0.848
  166    HA   PHE  20           HA       PHE  20  -3.264  10.504  -0.788
  167   1HB   PHE  20          2HB       PHE  20  -3.210   8.122  -0.319
  168   2HB   PHE  20          1HB       PHE  20  -1.727   8.582  -1.143
  169    HD1  PHE  20           HD1      PHE  20  -3.177   7.142   1.819
  170    HD2  PHE  20           HD2      PHE  20   0.385   8.786   0.177
  171    HE1  PHE  20           HE1      PHE  20  -1.870   6.099   3.622
  172    HE2  PHE  20           HE2      PHE  20   1.697   7.739   1.974
  173    HZ   PHE  20           HZ       PHE  20   0.573   6.398   3.700
  174    H    GLU  21           H        GLU  21  -5.117  10.166   0.450
  175    HA   GLU  21           HA       GLU  21  -4.743  10.603   3.341
  176   1HB   GLU  21          2HB       GLU  21  -5.737  12.572   2.178
  177   2HB   GLU  21          1HB       GLU  21  -7.079  11.553   1.673
  178   1HG   GLU  21          2HG       GLU  21  -7.657  11.158   4.012
  179   2HG   GLU  21          1HG       GLU  21  -6.322  12.194   4.513
  180    H    LEU  22           H        LEU  22  -5.644   9.183   4.668
  181    HA   LEU  22           HA       LEU  22  -7.281   7.061   3.474
  182   1HB   LEU  22          2HB       LEU  22  -5.955   7.066   6.176
  183   2HB   LEU  22          1HB       LEU  22  -6.627   5.693   5.323
  184    HG   LEU  22           HG       LEU  22  -4.209   7.241   4.395
  185   1HD1  LEU  22          1HD1      LEU  22  -2.932   5.309   5.179
  186   2HD1  LEU  22          2HD1      LEU  22  -4.406   4.617   5.861
  187   3HD1  LEU  22          3HD1      LEU  22  -3.758   6.127   6.503
  188   1HD2  LEU  22          1HD2      LEU  22  -5.350   4.592   3.517
  189   2HD2  LEU  22          2HD2      LEU  22  -3.879   5.350   2.904
  190   3HD2  LEU  22          3HD2      LEU  22  -5.447   6.104   2.613
  191    H    ARG  23           H        ARG  23  -9.159   6.350   4.530
  192    HA   ARG  23           HA       ARG  23 -10.122   7.976   6.762
  193   1HB   ARG  23          2HB       ARG  23 -11.412   7.716   4.108
  194   2HB   ARG  23          1HB       ARG  23 -12.468   7.627   5.518
  195   1HG   ARG  23          2HG       ARG  23 -12.125   9.778   6.089
  196   2HG   ARG  23          1HG       ARG  23 -10.466   9.782   5.499
  197   1HD   ARG  23          2HD       ARG  23 -11.540   9.634   3.158
  198   2HD   ARG  23          1HD       ARG  23 -13.025  10.126   3.970
  199    HE   ARG  23           HE       ARG  23 -10.560  11.748   4.086
  200   1HH1  ARG  23          1HH1      ARG  23 -14.004  11.449   3.536
  201   2HH1  ARG  23          2HH1      ARG  23 -14.236  13.154   3.267
  202   1HH2  ARG  23          1HH2      ARG  23 -10.840  13.954   3.716
  203   2HH2  ARG  23          2HH2      ARG  23 -12.428  14.593   3.380
  204    H    ASN  24           H        ASN  24 -11.617   6.989   8.091
  205    HA   ASN  24           HA       ASN  24 -11.153   4.114   8.193
  206   1HB   ASN  24          2HB       ASN  24 -10.705   5.430  10.205
  207   2HB   ASN  24          1HB       ASN  24 -12.375   5.988  10.232
  208   1HD2  ASN  24          1HD2      ASN  24 -12.742   5.139  12.260
  209   2HD2  ASN  24          2HD2      ASN  24 -12.895   3.440  12.547
  210    H    ASP  25           H        ASP  25 -12.589   2.640   7.701
  211    HA   ASP  25           HA       ASP  25 -15.370   3.459   7.185
  212   1HB   ASP  25          2HB       ASP  25 -14.197   2.499   5.275
  213   2HB   ASP  25          1HB       ASP  25 -13.761   1.083   6.220
  214    H    GLY  26           H        GLY  26 -13.480   1.859   9.446
  215   1HA   GLY  26          2HA       GLY  26 -14.341   0.796  11.402
  216   2HA   GLY  26          1HA       GLY  26 -15.786   0.358  10.494
  217    H    ASN  27           H        ASN  27 -14.448  -0.579   8.194
  218    HA   ASN  27           HA       ASN  27 -13.449  -3.163   9.069
  219   1HB   ASN  27          2HB       ASN  27 -15.046  -2.963   7.173
  220   2HB   ASN  27          1HB       ASN  27 -13.858  -2.011   6.293
  221   1HD2  ASN  27          1HD2      ASN  27 -13.686  -3.389   4.589
  222   2HD2  ASN  27          2HD2      ASN  27 -12.966  -4.963   4.709
  223    H    GLY  28           H        GLY  28 -12.172  -0.231   8.860
  224   1HA   GLY  28          2HA       GLY  28  -9.679  -0.288   9.290
  225   2HA   GLY  28          1HA       GLY  28  -9.596  -1.091   7.727
  226    H    SER  29           H        SER  29  -8.122   1.067   7.885
  227    HA   SER  29           HA       SER  29  -9.690   3.241   6.701
  228   1HB   SER  29          2HB       SER  29  -6.831   3.286   7.701
  229   2HB   SER  29          1HB       SER  29  -7.788   4.678   7.191
  230    HG   SER  29           HG       SER  29  -8.375   2.963   9.391
  231    H    TYR  30           H        TYR  30  -9.658   3.484   4.572
  232    HA   TYR  30           HA       TYR  30  -7.380   2.370   3.081
  233   1HB   TYR  30          2HB       TYR  30  -9.060   2.046   1.179
  234   2HB   TYR  30          1HB       TYR  30  -9.136   0.923   2.527
  235    HD1  TYR  30           HD1      TYR  30 -11.213   0.394   3.336
  236    HD2  TYR  30           HD2      TYR  30 -10.670   4.185   1.484
  237    HE1  TYR  30           HE1      TYR  30 -13.611   0.859   3.597
  238    HE2  TYR  30           HE2      TYR  30 -13.067   4.661   1.745
  239    HH   TYR  30           HH       TYR  30 -15.120   2.805   3.720
  240    H    ILE  31           H        ILE  31  -7.684   3.288   0.636
  241    HA   ILE  31           HA       ILE  31  -6.805   5.996   1.001
  242    HB   ILE  31           HB       ILE  31  -7.169   4.556  -1.629
  243   1HG1  ILE  31          2HG1      ILE  31  -4.714   4.576   0.133
  244   2HG1  ILE  31          1HG1      ILE  31  -5.811   3.213  -0.032
  245   1HG2  ILE  31          1HG2      ILE  31  -5.344   6.806  -0.794
  246   2HG2  ILE  31          2HG2      ILE  31  -6.789   6.955  -1.794
  247   3HG2  ILE  31          3HG2      ILE  31  -5.392   6.056  -2.388
  248   1HD1  ILE  31          1HD1      ILE  31  -5.280   3.049  -2.396
  249   2HD1  ILE  31          2HD1      ILE  31  -3.826   2.928  -1.402
  250   3HD1  ILE  31          3HD1      ILE  31  -4.194   4.429  -2.250
  251    H    GLU  32           H        GLU  32  -8.104   7.693   0.993
  252    HA   GLU  32           HA       GLU  32 -10.610   7.629  -0.515
  253   1HB   GLU  32          2HB       GLU  32 -10.705   8.562   1.741
  254   2HB   GLU  32          1HB       GLU  32  -9.445   9.721   1.344
  255   1HG   GLU  32          2HG       GLU  32 -11.535  10.856   1.312
  256   2HG   GLU  32          1HG       GLU  32 -10.983  10.707  -0.355
  257    H    LYS  33           H        LYS  33  -7.795   9.785  -0.168
  258    HA   LYS  33           HA       LYS  33  -8.228  10.631  -2.954
  259   1HB   LYS  33          2HB       LYS  33  -7.165  12.200  -0.609
  260   2HB   LYS  33          1HB       LYS  33  -7.033  12.749  -2.274
  261   1HG   LYS  33          2HG       LYS  33  -9.518  12.608  -2.439
  262   2HG   LYS  33          1HG       LYS  33  -9.550  12.264  -0.712
  263   1HD   LYS  33          2HD       LYS  33  -8.242  14.702  -1.850
  264   2HD   LYS  33          1HD       LYS  33  -9.937  14.666  -1.390
  265   1HE   LYS  33          2HE       LYS  33  -9.291  14.059   0.896
  266   2HE   LYS  33          1HE       LYS  33  -7.593  14.108   0.423
  267   1HZ   LYS  33          1HZ       LYS  33  -8.349  16.154   1.541
  268   2HZ   LYS  33          2HZ       LYS  33  -9.448  16.424   0.275
  269   3HZ   LYS  33          3HZ       LYS  33  -7.783  16.442  -0.032
  270    H    TRP  34           H        TRP  34  -6.458  10.918  -4.279
  271    HA   TRP  34           HA       TRP  34  -3.962   9.651  -3.346
  272   1HB   TRP  34          2HB       TRP  34  -5.352   8.056  -4.635
  273   2HB   TRP  34          1HB       TRP  34  -5.377   9.178  -5.984
  274    HD1  TRP  34           HD1      TRP  34  -3.202   9.303  -7.519
  275    HE1  TRP  34           HE1      TRP  34  -1.190   7.721  -7.793
  276    HE3  TRP  34           HE3      TRP  34  -3.792   6.500  -3.286
  277    HZ2  TRP  34           HZ2      TRP  34  -0.010   5.579  -6.397
  278    HZ3  TRP  34           HZ3      TRP  34  -2.182   4.701  -2.834
  279    HH2  TRP  34           HH2      TRP  34  -0.327   4.249  -4.360
  280    H    ASN  35           H        ASN  35  -2.441  11.167  -3.450
  281    HA   ASN  35           HA       ASN  35  -2.488  13.072  -5.696
  282   1HB   ASN  35          2HB       ASN  35  -1.406  13.398  -2.891
  283   2HB   ASN  35          1HB       ASN  35  -1.086  14.540  -4.189
  284   1HD2  ASN  35          1HD2      ASN  35  -2.464  14.908  -1.635
  285   2HD2  ASN  35          2HD2      ASN  35  -4.041  15.500  -2.038
  286    H    LEU  36           H        LEU  36  -1.001  10.386  -4.595
  287    HA   LEU  36           HA       LEU  36   1.732  10.914  -5.070
  288   1HB   LEU  36          2HB       LEU  36   0.084   8.406  -5.030
  289   2HB   LEU  36          1HB       LEU  36   1.771   8.361  -5.485
  290    HG   LEU  36           HG       LEU  36   0.841   9.479  -2.857
  291   1HD1  LEU  36          1HD1      LEU  36   0.126   7.153  -3.012
  292   2HD1  LEU  36          2HD1      LEU  36   1.456   7.336  -1.868
  293   3HD1  LEU  36          3HD1      LEU  36   1.761   6.677  -3.475
  294   1HD2  LEU  36          1HD2      LEU  36   3.058  10.173  -3.580
  295   2HD2  LEU  36          2HD2      LEU  36   3.512   8.488  -3.843
  296   3HD2  LEU  36          3HD2      LEU  36   3.168   9.064  -2.212
  297    H    ARG  37           H        ARG  37   2.960  10.744  -6.870
  298    HA   ARG  37           HA       ARG  37   1.563  10.825  -9.409
  299   1HB   ARG  37          2HB       ARG  37   4.500  11.126  -8.760
  300   2HB   ARG  37          1HB       ARG  37   3.793  11.356 -10.354
  301   1HG   ARG  37          2HG       ARG  37   2.377  13.166  -9.379
  302   2HG   ARG  37          1HG       ARG  37   3.296  12.999  -7.884
  303   1HD   ARG  37          2HD       ARG  37   4.389  13.740 -10.593
  304   2HD   ARG  37          1HD       ARG  37   4.172  14.825  -9.220
  305    HE   ARG  37           HE       ARG  37   5.825  12.656  -8.491
  306   1HH1  ARG  37          1HH1      ARG  37   5.837  15.553 -10.442
  307   2HH1  ARG  37          2HH1      ARG  37   7.542  15.843 -10.239
  308   1HH2  ARG  37          1HH2      ARG  37   8.056  12.959  -8.269
  309   2HH2  ARG  37          2HH2      ARG  37   8.822  14.342  -9.001
  310    H    ALA  38           H        ALA  38   1.360   8.423  -8.119
  311    HA   ALA  38           HA       ALA  38   2.842   6.626  -9.916
  312   1HB   ALA  38          1HB       ALA  38   3.626   6.347  -7.606
  313   2HB   ALA  38          2HB       ALA  38   2.744   4.914  -8.140
  314   3HB   ALA  38          3HB       ALA  38   1.969   6.081  -7.070
  315    HA   PRO  39           HA       PRO  39  -1.137   5.330 -11.290
  316   1HB   PRO  39          2HB       PRO  39  -0.751   2.693 -11.815
  317   2HB   PRO  39          1HB       PRO  39  -0.096   3.981 -12.831
  318   1HG   PRO  39          2HG       PRO  39   1.261   2.372 -10.703
  319   2HG   PRO  39          1HG       PRO  39   1.866   2.848 -12.301
  320   1HD   PRO  39          2HD       PRO  39   2.578   4.143 -10.034
  321   2HD   PRO  39          1HD       PRO  39   2.425   4.970 -11.597
  322    H    LEU  40           H        LEU  40  -3.040   4.371 -10.614
  323    HA   LEU  40           HA       LEU  40  -3.207   3.510  -7.908
  324   1HB   LEU  40          2HB       LEU  40  -5.103   3.858 -10.168
  325   2HB   LEU  40          1HB       LEU  40  -5.589   2.793  -8.870
  326    HG   LEU  40           HG       LEU  40  -6.501   5.000  -8.501
  327   1HD1  LEU  40          1HD1      LEU  40  -5.825   3.698  -6.538
  328   2HD1  LEU  40          2HD1      LEU  40  -5.673   5.433  -6.261
  329   3HD1  LEU  40          3HD1      LEU  40  -4.237   4.461  -6.584
  330   1HD2  LEU  40          1HD2      LEU  40  -3.646   5.963  -8.566
  331   2HD2  LEU  40          2HD2      LEU  40  -5.048   6.934  -8.114
  332   3HD2  LEU  40          3HD2      LEU  40  -4.896   6.314  -9.758
  333    HA   PRO  41           HA       PRO  41  -2.091  -0.731  -8.807
  334   1HB   PRO  41          2HB       PRO  41  -2.458  -1.611  -6.243
  335   2HB   PRO  41          1HB       PRO  41  -0.993  -0.804  -6.806
  336   1HG   PRO  41          2HG       PRO  41  -3.317   0.323  -5.298
  337   2HG   PRO  41          1HG       PRO  41  -1.583   0.622  -5.075
  338   1HD   PRO  41          2HD       PRO  41  -3.175   2.369  -6.368
  339   2HD   PRO  41          1HD       PRO  41  -1.481   2.109  -6.836
  340    H    THR  42           H        THR  42  -3.148  -2.783  -8.727
  341    HA   THR  42           HA       THR  42  -6.050  -2.473  -8.823
  342    HB   THR  42           HB       THR  42  -5.994  -4.792  -9.815
  343    HG1  THR  42           HG1      THR  42  -3.185  -4.306  -9.991
  344   1HG2  THR  42          1HG2      THR  42  -6.110  -2.796 -11.224
  345   2HG2  THR  42          2HG2      THR  42  -5.141  -4.057 -11.985
  346   3HG2  THR  42          3HG2      THR  42  -4.349  -2.682 -11.216
  347    H    GLN  43           H        GLN  43  -7.355  -4.366  -8.009
  348    HA   GLN  43           HA       GLN  43  -7.126  -4.601  -5.250
  349   1HB   GLN  43          2HB       GLN  43  -9.094  -5.100  -6.904
  350   2HB   GLN  43          1HB       GLN  43  -8.456  -6.735  -6.889
  351   1HG   GLN  43          2HG       GLN  43  -9.162  -5.275  -4.367
  352   2HG   GLN  43          1HG       GLN  43 -10.349  -6.190  -5.290
  353   1HE2  GLN  43          1HE2      GLN  43  -9.297  -6.578  -2.582
  354   2HE2  GLN  43          2HE2      GLN  43  -8.681  -8.198  -2.544
  355    H    ALA  44           H        ALA  44  -6.196  -6.888  -7.784
  356    HA   ALA  44           HA       ALA  44  -5.175  -8.924  -6.165
  357   1HB   ALA  44          1HB       ALA  44  -5.610  -9.162  -8.571
  358   2HB   ALA  44          2HB       ALA  44  -3.987  -9.691  -8.134
  359   3HB   ALA  44          3HB       ALA  44  -4.222  -8.126  -8.912
  360    H    GLU  45           H        GLU  45  -3.549  -6.114  -7.602
  361    HA   GLU  45           HA       GLU  45  -0.956  -6.675  -6.697
  362   1HB   GLU  45          2HB       GLU  45  -2.364  -4.135  -7.469
  363   2HB   GLU  45          1HB       GLU  45  -0.703  -4.104  -6.905
  364   1HG   GLU  45          2HG       GLU  45  -0.032  -5.568  -8.702
  365   2HG   GLU  45          1HG       GLU  45  -1.706  -5.705  -9.238
  366    H    LEU  46           H        LEU  46  -3.569  -4.812  -5.200
  367    HA   LEU  46           HA       LEU  46  -2.171  -3.933  -2.951
  368   1HB   LEU  46          2HB       LEU  46  -5.094  -4.543  -3.366
  369   2HB   LEU  46          1HB       LEU  46  -4.462  -3.807  -1.911
  370    HG   LEU  46           HG       LEU  46  -4.242  -2.621  -4.674
  371   1HD1  LEU  46          1HD1      LEU  46  -6.541  -2.621  -3.873
  372   2HD1  LEU  46          2HD1      LEU  46  -5.874  -0.988  -3.873
  373   3HD1  LEU  46          3HD1      LEU  46  -6.023  -1.880  -2.359
  374   1HD2  LEU  46          1HD2      LEU  46  -3.542  -1.484  -1.968
  375   2HD2  LEU  46          2HD2      LEU  46  -3.459  -0.626  -3.507
  376   3HD2  LEU  46          3HD2      LEU  46  -2.391  -1.996  -3.202
  377    H    GLU  47           H        GLU  47  -4.134  -6.881  -3.414
  378    HA   GLU  47           HA       GLU  47  -3.680  -7.841  -0.791
  379   1HB   GLU  47          2HB       GLU  47  -4.576  -9.261  -3.287
  380   2HB   GLU  47          1HB       GLU  47  -4.447 -10.051  -1.722
  381   1HG   GLU  47          2HG       GLU  47  -6.001  -8.324  -0.818
  382   2HG   GLU  47          1HG       GLU  47  -6.236  -7.766  -2.471
  383    H    THR  48           H        THR  48  -1.817  -7.975  -3.700
  384    HA   THR  48           HA       THR  48  -0.168 -10.175  -3.084
  385    HB   THR  48           HB       THR  48   0.497  -7.696  -4.691
  386    HG1  THR  48           HG1      THR  48  -1.277  -8.920  -5.504
  387   1HG2  THR  48          1HG2      THR  48   2.518  -8.917  -3.994
  388   2HG2  THR  48          2HG2      THR  48   2.243  -9.052  -5.730
  389   3HG2  THR  48          3HG2      THR  48   1.846 -10.402  -4.666
  390    H    TRP  49           H        TRP  49   0.298  -6.689  -2.508
  391    HA   TRP  49           HA       TRP  49   2.744  -7.052  -1.103
  392   1HB   TRP  49          2HB       TRP  49   0.881  -4.670  -0.984
  393   2HB   TRP  49          1HB       TRP  49   2.597  -4.692  -0.582
  394    HD1  TRP  49           HD1      TRP  49   3.705  -6.230  -3.122
  395    HE1  TRP  49           HE1      TRP  49   3.687  -5.093  -5.434
  396    HE3  TRP  49           HE3      TRP  49   0.127  -2.695  -2.245
  397    HZ2  TRP  49           HZ2      TRP  49   2.344  -2.970  -6.705
  398    HZ3  TRP  49           HZ3      TRP  49  -0.463  -1.146  -4.063
  399    HH2  TRP  49           HH2      TRP  49   0.624  -1.281  -6.245
  400    H    TRP  50           H        TRP  50  -0.625  -6.866  -0.178
  401    HA   TRP  50           HA       TRP  50  -0.272  -6.766   2.621
  402   1HB   TRP  50          2HB       TRP  50  -2.424  -6.345   1.433
  403   2HB   TRP  50          1HB       TRP  50  -2.522  -8.061   1.056
  404    HD1  TRP  50           HD1      TRP  50  -3.734  -9.547   2.792
  405    HE1  TRP  50           HE1      TRP  50  -4.668  -9.192   5.171
  406    HE3  TRP  50           HE3      TRP  50  -1.820  -4.894   3.725
  407    HZ2  TRP  50           HZ2      TRP  50  -4.592  -7.202   7.167
  408    HZ3  TRP  50           HZ3      TRP  50  -2.299  -3.838   5.894
  409    HH2  TRP  50           HH2      TRP  50  -3.662  -4.965   7.581
  410    H    GLU  51           H        GLU  51  -0.559  -9.458   0.332
  411    HA   GLU  51           HA       GLU  51  -0.354 -11.575   2.121
  412   1HB   GLU  51          2HB       GLU  51  -0.376 -11.189  -0.665
  413   2HB   GLU  51          1HB       GLU  51   1.024 -12.177  -0.285
  414   1HG   GLU  51          2HG       GLU  51  -1.692 -12.754   0.743
  415   2HG   GLU  51          1HG       GLU  51  -1.076 -13.401  -0.753
  416    H    GLU  52           H        GLU  52   2.220  -9.897   0.311
  417    HA   GLU  52           HA       GLU  52   4.329 -11.426   1.380
  418   1HB   GLU  52          2HB       GLU  52   4.357  -8.640   0.222
  419   2HB   GLU  52          1HB       GLU  52   5.791  -9.607   0.553
  420   1HG   GLU  52          2HG       GLU  52   5.033 -11.298  -1.021
  421   2HG   GLU  52          1HG       GLU  52   3.578 -10.359  -1.338
  422    H    LEU  53           H        LEU  53   2.679  -8.580   2.520
  423    HA   LEU  53           HA       LEU  53   4.487  -7.810   4.547
  424   1HB   LEU  53          2HB       LEU  53   2.520  -6.526   3.555
  425   2HB   LEU  53          1HB       LEU  53   1.493  -7.480   4.603
  426    HG   LEU  53           HG       LEU  53   3.724  -5.790   5.720
  427   1HD1  LEU  53          1HD1      LEU  53   2.080  -4.014   6.058
  428   2HD1  LEU  53          2HD1      LEU  53   0.878  -4.952   5.172
  429   3HD1  LEU  53          3HD1      LEU  53   2.312  -4.348   4.341
  430   1HD2  LEU  53          1HD2      LEU  53   2.309  -5.802   7.716
  431   2HD2  LEU  53          2HD2      LEU  53   2.717  -7.444   7.216
  432   3HD2  LEU  53          3HD2      LEU  53   1.117  -6.790   6.871
  433    H    GLN  54           H        GLN  54   1.823 -10.114   4.435
  434    HA   GLN  54           HA       GLN  54   2.030 -10.667   7.273
  435   1HB   GLN  54          2HB       GLN  54   0.078 -11.121   5.183
  436   2HB   GLN  54          1HB       GLN  54   0.358 -12.586   6.116
  437   1HG   GLN  54          2HG       GLN  54  -1.473 -11.345   7.057
  438   2HG   GLN  54          1HG       GLN  54  -0.113 -11.348   8.175
  439   1HE2  GLN  54          1HE2      GLN  54  -0.326  -9.322   5.313
  440   2HE2  GLN  54          2HE2      GLN  54  -0.457  -7.826   6.166
  441    H    LYS  55           H        LYS  55   2.985 -12.132   4.237
  442    HA   LYS  55           HA       LYS  55   3.720 -14.645   5.432
  443   1HB   LYS  55          2HB       LYS  55   2.964 -14.252   3.022
  444   2HB   LYS  55          1HB       LYS  55   4.614 -13.700   2.739
  445   1HG   LYS  55          2HG       LYS  55   5.512 -15.796   3.320
  446   2HG   LYS  55          1HG       LYS  55   3.975 -16.358   3.964
  447   1HD   LYS  55          2HD       LYS  55   3.937 -15.513   1.144
  448   2HD   LYS  55          1HD       LYS  55   4.883 -16.952   1.509
  449   1HE   LYS  55          2HE       LYS  55   2.547 -17.472   0.896
  450   2HE   LYS  55          1HE       LYS  55   2.976 -18.024   2.513
  451   1HZ   LYS  55          1HZ       LYS  55   1.886 -16.009   3.396
  452   2HZ   LYS  55          2HZ       LYS  55   0.822 -17.030   2.573
  453   3HZ   LYS  55          3HZ       LYS  55   1.379 -15.612   1.823
  454    H    ASN  56           H        ASN  56   5.135 -11.625   5.065
  455    HA   ASN  56           HA       ASN  56   7.481 -12.630   6.479
  456   1HB   ASN  56          2HB       ASN  56   8.141 -12.261   4.079
  457   2HB   ASN  56          1HB       ASN  56   7.721 -10.568   4.273
  458   1HD2  ASN  56          1HD2      ASN  56   9.078  -9.243   5.362
  459   2HD2  ASN  56          2HD2      ASN  56  10.649  -9.726   5.898
  460    HA   PRO  57           HA       PRO  57   5.180  -9.429   8.761
  461   1HB   PRO  57          2HB       PRO  57   6.315 -10.109  11.177
  462   2HB   PRO  57          1HB       PRO  57   4.862 -10.856  10.506
  463   1HG   PRO  57          2HG       PRO  57   7.691 -11.823  10.459
  464   2HG   PRO  57          1HG       PRO  57   6.195 -12.740  10.723
  465   1HD   PRO  57          2HD       PRO  57   7.471 -12.778   8.363
  466   2HD   PRO  57          1HD       PRO  57   5.699 -12.819   8.461
  467    HA   PRO  58           HA       PRO  58   8.301  -6.257   8.947
  468   1HB   PRO  58          2HB       PRO  58   6.495  -4.978  10.904
  469   2HB   PRO  58          1HB       PRO  58   7.069  -4.376   9.345
  470   1HG   PRO  58          2HG       PRO  58   4.537  -5.176   9.683
  471   2HG   PRO  58          1HG       PRO  58   5.406  -5.468   8.164
  472   1HD   PRO  58          2HD       PRO  58   4.836  -7.356  10.419
  473   2HD   PRO  58          1HD       PRO  58   4.764  -7.641   8.666
  474    H    TYR  59           H        TYR  59   9.539  -5.050  10.639
  475    HA   TYR  59           HA       TYR  59   9.968  -6.829  12.947
  476   1HB   TYR  59          2HB       TYR  59  11.819  -6.638  11.253
  477   2HB   TYR  59          1HB       TYR  59  11.963  -4.940  11.685
  478    HD1  TYR  59           HD1      TYR  59  12.404  -8.388  12.888
  479    HD2  TYR  59           HD2      TYR  59  13.079  -4.265  13.699
  480    HE1  TYR  59           HE1      TYR  59  13.966  -9.004  14.681
  481    HE2  TYR  59           HE2      TYR  59  14.640  -4.871  15.501
  482    HH   TYR  59           HH       TYR  59  15.924  -7.941  15.838
  483    H    GLU  60           H        GLU  60   9.395  -6.025  14.844
  484    HA   GLU  60           HA       GLU  60   8.976  -3.171  15.194
  485   1HB   GLU  60          2HB       GLU  60   7.325  -4.775  16.081
  486   2HB   GLU  60          1HB       GLU  60   8.562  -5.491  17.103
  487   1HG   GLU  60          2HG       GLU  60   7.252  -4.085  18.475
  488   2HG   GLU  60          1HG       GLU  60   8.793  -3.269  18.228
  Start of MODEL   17
    1   1H    MET   1          1H        MET   1  -9.471  -4.366   3.074
    2   2H    MET   1          2H        MET   1  -8.767  -5.720   2.335
    3   3H    MET   1          3H        MET   1  -8.141  -4.172   2.043
    4    HA   MET   1           HA       MET   1  -8.161  -5.525   4.681
    5   1HB   MET   1          2HB       MET   1  -5.906  -6.082   4.390
    6   2HB   MET   1          1HB       MET   1  -6.604  -6.443   2.819
    7   1HG   MET   1          2HG       MET   1  -5.055  -3.960   3.542
    8   2HG   MET   1          1HG       MET   1  -4.441  -5.333   2.622
    9   1HE   MET   1          1HE       MET   1  -6.725  -6.109   0.674
   10   2HE   MET   1          2HE       MET   1  -5.060  -5.857   0.147
   11   3HE   MET   1          3HE       MET   1  -6.387  -5.085  -0.721
   12    H    ILE   2           H        ILE   2  -6.177  -4.340   5.929
   13    HA   ILE   2           HA       ILE   2  -6.873  -1.569   6.087
   14    HB   ILE   2           HB       ILE   2  -4.497  -2.960   7.326
   15   1HG1  ILE   2          2HG1      ILE   2  -5.984  -2.694   9.440
   16   2HG1  ILE   2          1HG1      ILE   2  -7.314  -2.530   8.302
   17   1HG2  ILE   2          1HG2      ILE   2  -4.457  -1.048   8.864
   18   2HG2  ILE   2          2HG2      ILE   2  -5.766  -0.302   7.947
   19   3HG2  ILE   2          3HG2      ILE   2  -4.197  -0.559   7.188
   20   1HD1  ILE   2          1HD1      ILE   2  -7.122  -4.800   9.145
   21   2HD1  ILE   2          2HD1      ILE   2  -5.473  -4.900   8.526
   22   3HD1  ILE   2          3HD1      ILE   2  -6.829  -4.741   7.407
   23    H    LEU   3           H        LEU   3  -6.324  -0.244   4.510
   24    HA   LEU   3           HA       LEU   3  -4.428  -0.840   2.537
   25   1HB   LEU   3          2HB       LEU   3  -6.265   1.344   3.227
   26   2HB   LEU   3          1HB       LEU   3  -4.878   1.823   2.292
   27    HG   LEU   3           HG       LEU   3  -6.683   1.406   0.789
   28   1HD1  LEU   3          1HD1      LEU   3  -4.504   0.691   0.000
   29   2HD1  LEU   3          2HD1      LEU   3  -5.768  -0.376  -0.615
   30   3HD1  LEU   3          3HD1      LEU   3  -4.747  -0.898   0.725
   31   1HD2  LEU   3          1HD2      LEU   3  -7.812  -0.766   0.666
   32   2HD2  LEU   3          2HD2      LEU   3  -8.061   0.019   2.224
   33   3HD2  LEU   3          3HD2      LEU   3  -6.908  -1.307   2.081
   34    H    TYR   4           H        TYR   4  -4.314   1.105   5.435
   35    HA   TYR   4           HA       TYR   4  -2.201   2.799   4.966
   36   1HB   TYR   4          2HB       TYR   4  -3.595   2.939   6.959
   37   2HB   TYR   4          1HB       TYR   4  -2.956   1.409   7.545
   38    HD1  TYR   4           HD1      TYR   4  -0.892   1.312   8.727
   39    HD2  TYR   4           HD2      TYR   4  -2.127   4.952   6.901
   40    HE1  TYR   4           HE1      TYR   4   0.871   2.513   9.944
   41    HE2  TYR   4           HE2      TYR   4  -0.358   6.162   8.108
   42    HH   TYR   4           HH       TYR   4   2.188   4.598   9.704
   43    H    ASP   5           H        ASP   5  -2.051  -0.521   6.214
   44    HA   ASP   5           HA       ASP   5   0.765  -0.530   6.566
   45   1HB   ASP   5          2HB       ASP   5  -1.251  -2.769   6.320
   46   2HB   ASP   5          1HB       ASP   5   0.444  -3.028   6.694
   47    H    ALA   6           H        ALA   6  -1.343  -1.918   4.104
   48    HA   ALA   6           HA       ALA   6   0.607  -3.083   2.511
   49   1HB   ALA   6          1HB       ALA   6  -1.051  -3.172   0.771
   50   2HB   ALA   6          2HB       ALA   6  -2.002  -1.914   1.559
   51   3HB   ALA   6          3HB       ALA   6  -1.820  -3.493   2.324
   52    H    ILE   7           H        ILE   7  -0.740   0.210   2.318
   53    HA   ILE   7           HA       ILE   7   0.609   0.904  -0.068
   54    HB   ILE   7           HB       ILE   7  -0.398   2.739   2.113
   55   1HG1  ILE   7          2HG1      ILE   7  -1.732   1.837  -0.449
   56   2HG1  ILE   7          1HG1      ILE   7  -2.129   1.253   1.160
   57   1HG2  ILE   7          1HG2      ILE   7   0.293   3.309  -0.766
   58   2HG2  ILE   7          2HG2      ILE   7   1.203   3.842   0.649
   59   3HG2  ILE   7          3HG2      ILE   7  -0.428   4.454   0.365
   60   1HD1  ILE   7          1HD1      ILE   7  -2.813   3.503   1.811
   61   2HD1  ILE   7          2HD1      ILE   7  -3.730   2.915   0.421
   62   3HD1  ILE   7          3HD1      ILE   7  -2.424   4.078   0.192
   63    H    MET   8           H        MET   8   1.478   1.318   3.369
   64    HA   MET   8           HA       MET   8   3.781   2.898   2.725
   65   1HB   MET   8          2HB       MET   8   3.021   1.490   5.285
   66   2HB   MET   8          1HB       MET   8   4.425   2.532   5.109
   67   1HG   MET   8          2HG       MET   8   2.765   4.317   4.327
   68   2HG   MET   8          1HG       MET   8   1.526   3.266   5.007
   69   1HE   MET   8          1HE       MET   8   4.547   5.599   5.663
   70   2HE   MET   8          2HE       MET   8   5.216   4.070   6.227
   71   3HE   MET   8          3HE       MET   8   4.876   5.362   7.378
   72    H    TYR   9           H        TYR   9   3.150  -0.477   2.819
   73    HA   TYR   9           HA       TYR   9   5.886  -1.308   2.959
   74   1HB   TYR   9          2HB       TYR   9   4.104  -2.863   3.539
   75   2HB   TYR   9          1HB       TYR   9   3.407  -2.717   1.930
   76    HD1  TYR   9           HD1      TYR   9   3.833  -4.425   0.448
   77    HD2  TYR   9           HD2      TYR   9   6.683  -3.622   3.506
   78    HE1  TYR   9           HE1      TYR   9   5.178  -6.334  -0.315
   79    HE2  TYR   9           HE2      TYR   9   8.040  -5.528   2.747
   80    HH   TYR   9           HH       TYR   9   7.288  -7.266  -0.204
   81    H    LYS  10           H        LYS  10   3.639  -0.376   0.455
   82    HA   LYS  10           HA       LYS  10   5.326  -1.105  -1.744
   83   1HB   LYS  10          2HB       LYS  10   2.892  -0.970  -1.986
   84   2HB   LYS  10          1HB       LYS  10   2.937   0.742  -1.610
   85   1HG   LYS  10          2HG       LYS  10   2.692   0.561  -3.946
   86   2HG   LYS  10          1HG       LYS  10   4.360   1.054  -3.654
   87   1HD   LYS  10          2HD       LYS  10   5.112  -1.225  -3.964
   88   2HD   LYS  10          1HD       LYS  10   3.447  -1.771  -4.171
   89   1HE   LYS  10          2HE       LYS  10   3.282  -0.206  -6.129
   90   2HE   LYS  10          1HE       LYS  10   5.017   0.061  -5.976
   91   1HZ   LYS  10          1HZ       LYS  10   3.684  -2.541  -6.507
   92   2HZ   LYS  10          2HZ       LYS  10   5.358  -2.321  -6.307
   93   3HZ   LYS  10          3HZ       LYS  10   4.560  -1.617  -7.627
   94    H    TYR  11           H        TYR  11   4.367   2.016  -0.313
   95    HA   TYR  11           HA       TYR  11   6.838   3.168  -1.438
   96   1HB   TYR  11          2HB       TYR  11   4.195   4.579  -1.003
   97   2HB   TYR  11          1HB       TYR  11   5.671   5.330  -1.594
   98    HD1  TYR  11           HD1      TYR  11   6.680   4.141  -3.764
   99    HD2  TYR  11           HD2      TYR  11   2.616   3.952  -2.542
  100    HE1  TYR  11           HE1      TYR  11   6.017   3.625  -6.073
  101    HE2  TYR  11           HE2      TYR  11   1.940   3.432  -4.847
  102    HH   TYR  11           HH       TYR  11   2.799   3.726  -7.137
  103    HA   PRO  12           HA       PRO  12   7.340   3.504   3.114
  104   1HB   PRO  12          2HB       PRO  12  10.141   3.843   2.231
  105   2HB   PRO  12          1HB       PRO  12   9.467   2.752   3.443
  106   1HG   PRO  12          2HG       PRO  12  10.311   1.831   1.085
  107   2HG   PRO  12          1HG       PRO  12   8.867   1.159   1.867
  108   1HD   PRO  12          2HD       PRO  12   9.068   3.121  -0.387
  109   2HD   PRO  12          1HD       PRO  12   7.962   1.745  -0.188
  110    H    ASN  13           H        ASN  13   8.394   5.534   0.464
  111    HA   ASN  13           HA       ASN  13   8.993   7.740   2.267
  112   1HB   ASN  13          2HB       ASN  13   9.290   7.406  -0.712
  113   2HB   ASN  13          1HB       ASN  13   9.612   8.915   0.127
  114   1HD2  ASN  13          1HD2      ASN  13  11.433   7.293  -1.393
  115   2HD2  ASN  13          2HD2      ASN  13  12.705   6.826  -0.321
  116    H    ALA  14           H        ALA  14   6.219   6.549   1.330
  117    HA   ALA  14           HA       ALA  14   4.986   9.033   0.420
  118   1HB   ALA  14          1HB       ALA  14   3.756   6.311   0.884
  119   2HB   ALA  14          2HB       ALA  14   4.306   6.942  -0.669
  120   3HB   ALA  14          3HB       ALA  14   2.950   7.704   0.162
  121    H    VAL  15           H        VAL  15   3.947  10.388   1.754
  122    HA   VAL  15           HA       VAL  15   3.856   9.660   4.582
  123    HB   VAL  15           HB       VAL  15   3.439  12.392   3.367
  124   1HG1  VAL  15          1HG1      VAL  15   3.993  11.491   6.195
  125   2HG1  VAL  15          2HG1      VAL  15   2.493  12.195   5.587
  126   3HG1  VAL  15          3HG1      VAL  15   3.963  13.169   5.660
  127   1HG2  VAL  15          1HG2      VAL  15   5.675  11.593   2.826
  128   2HG2  VAL  15          2HG2      VAL  15   5.950  11.168   4.515
  129   3HG2  VAL  15          3HG2      VAL  15   5.759  12.860   4.052
  130    H    SER  16           H        SER  16   2.036   8.942   5.380
  131    HA   SER  16           HA       SER  16  -0.491   9.141   4.134
  132   1HB   SER  16          2HB       SER  16   0.031   8.528   7.049
  133   2HB   SER  16          1HB       SER  16  -1.346   8.020   6.075
  134    HG   SER  16           HG       SER  16   0.833   6.667   6.465
  135    H    ARG  17           H        ARG  17  -2.226  10.436   4.526
  136    HA   ARG  17           HA       ARG  17  -3.452  12.237   5.178
  137   1HB   ARG  17          2HB       ARG  17  -1.566  12.327   7.543
  138   2HB   ARG  17          1HB       ARG  17  -3.023  13.294   7.380
  139   1HG   ARG  17          2HG       ARG  17  -4.365  11.241   7.351
  140   2HG   ARG  17          1HG       ARG  17  -2.890  10.293   7.558
  141   1HD   ARG  17          2HD       ARG  17  -4.019  12.325   9.480
  142   2HD   ARG  17          1HD       ARG  17  -3.977  10.575   9.697
  143    HE   ARG  17           HE       ARG  17  -1.364  11.276   9.344
  144   1HH1  ARG  17          1HH1      ARG  17  -3.880  12.267  11.568
  145   2HH1  ARG  17          2HH1      ARG  17  -2.767  12.646  12.849
  146   1HH2  ARG  17          1HH2      ARG  17   0.086  11.770  11.006
  147   2HH2  ARG  17          2HH2      ARG  17  -0.509  12.338  12.538
  148    H    LYS  18           H        LYS  18  -0.905  12.384   3.602
  149    HA   LYS  18           HA       LYS  18  -0.680  15.299   3.660
  150   1HB   LYS  18          2HB       LYS  18   1.241  14.340   4.939
  151   2HB   LYS  18          1HB       LYS  18   1.723  13.468   3.490
  152   1HG   LYS  18          2HG       LYS  18   3.082  15.411   3.665
  153   2HG   LYS  18          1HG       LYS  18   1.949  15.667   2.336
  154   1HD   LYS  18          2HD       LYS  18   0.530  17.009   3.795
  155   2HD   LYS  18          1HD       LYS  18   1.640  16.736   5.139
  156   1HE   LYS  18          2HE       LYS  18   3.432  17.824   3.796
  157   2HE   LYS  18          1HE       LYS  18   2.220  18.208   2.577
  158   1HZ   LYS  18          1HZ       LYS  18   2.587  20.079   4.036
  159   2HZ   LYS  18          2HZ       LYS  18   2.210  19.136   5.395
  160   3HZ   LYS  18          3HZ       LYS  18   1.013  19.485   4.246
  161    H    ASP  19           H        ASP  19   0.896  12.605   1.932
  162    HA   ASP  19           HA       ASP  19   0.288  13.961  -0.583
  163   1HB   ASP  19          2HB       ASP  19   2.588  12.882   0.115
  164   2HB   ASP  19          1HB       ASP  19   1.823  11.395  -0.438
  165    H    PHE  20           H        PHE  20  -0.331  10.949   1.127
  166    HA   PHE  20           HA       PHE  20  -2.718  10.698  -0.553
  167   1HB   PHE  20          2HB       PHE  20  -2.596   8.301  -0.572
  168   2HB   PHE  20          1HB       PHE  20  -1.042   8.906  -1.127
  169    HD1  PHE  20           HD1      PHE  20  -2.767   6.881   1.267
  170    HD2  PHE  20           HD2      PHE  20   0.905   8.895   0.490
  171    HE1  PHE  20           HE1      PHE  20  -1.650   5.492   2.959
  172    HE2  PHE  20           HE2      PHE  20   2.025   7.503   2.180
  173    HZ   PHE  20           HZ       PHE  20   0.748   5.801   3.416
  174    H    GLU  21           H        GLU  21  -4.584  10.481   0.583
  175    HA   GLU  21           HA       GLU  21  -4.265  10.454   3.496
  176   1HB   GLU  21          2HB       GLU  21  -6.369  11.851   1.841
  177   2HB   GLU  21          1HB       GLU  21  -6.263  11.869   3.590
  178   1HG   GLU  21          2HG       GLU  21  -4.092  12.995   3.450
  179   2HG   GLU  21          1HG       GLU  21  -4.218  12.988   1.693
  180    H    LEU  22           H        LEU  22  -5.233   8.927   4.586
  181    HA   LEU  22           HA       LEU  22  -7.252   7.277   3.231
  182   1HB   LEU  22          2HB       LEU  22  -5.661   6.513   5.672
  183   2HB   LEU  22          1HB       LEU  22  -6.595   5.464   4.629
  184    HG   LEU  22           HG       LEU  22  -4.007   6.835   3.891
  185   1HD1  LEU  22          1HD1      LEU  22  -4.658   3.946   4.435
  186   2HD1  LEU  22          2HD1      LEU  22  -3.691   5.011   5.456
  187   3HD1  LEU  22          3HD1      LEU  22  -3.110   4.557   3.853
  188   1HD2  LEU  22          1HD2      LEU  22  -5.712   4.912   2.316
  189   2HD2  LEU  22          2HD2      LEU  22  -4.126   5.516   1.839
  190   3HD2  LEU  22          3HD2      LEU  22  -5.490   6.626   1.967
  191    H    ARG  23           H        ARG  23  -9.108   6.672   4.400
  192    HA   ARG  23           HA       ARG  23  -9.580   8.165   6.885
  193   1HB   ARG  23          2HB       ARG  23 -10.976   8.504   4.364
  194   2HB   ARG  23          1HB       ARG  23 -12.078   8.036   5.654
  195   1HG   ARG  23          2HG       ARG  23 -12.028  10.397   5.617
  196   2HG   ARG  23          1HG       ARG  23 -11.111   9.891   7.029
  197   1HD   ARG  23          2HD       ARG  23  -9.023  10.211   5.808
  198   2HD   ARG  23          1HD       ARG  23  -9.927  10.698   4.376
  199    HE   ARG  23           HE       ARG  23 -10.801  12.489   6.123
  200   1HH1  ARG  23          1HH1      ARG  23  -7.541  11.348   5.583
  201   2HH1  ARG  23          2HH1      ARG  23  -6.798  12.869   5.988
  202   1HH2  ARG  23          1HH2      ARG  23  -9.846  14.476   6.665
  203   2HH2  ARG  23          2HH2      ARG  23  -8.119  14.651   6.609
  204    H    ASN  24           H        ASN  24 -11.540   7.370   8.033
  205    HA   ASN  24           HA       ASN  24 -11.170   4.518   8.356
  206   1HB   ASN  24          2HB       ASN  24 -11.267   6.107  10.289
  207   2HB   ASN  24          1HB       ASN  24 -12.970   6.370   9.927
  208   1HD2  ASN  24          1HD2      ASN  24 -14.458   4.772  10.395
  209   2HD2  ASN  24          2HD2      ASN  24 -14.065   3.385  11.364
  210    H    ASP  25           H        ASP  25 -12.411   3.007   7.520
  211    HA   ASP  25           HA       ASP  25 -14.958   3.720   6.288
  212   1HB   ASP  25          2HB       ASP  25 -13.483   2.316   4.971
  213   2HB   ASP  25          1HB       ASP  25 -13.345   1.156   6.289
  214    H    GLY  26           H        GLY  26 -13.704   1.390   8.643
  215   1HA   GLY  26          2HA       GLY  26 -15.481   1.462  10.632
  216   2HA   GLY  26          1HA       GLY  26 -16.397   0.595   9.403
  217    H    ASN  27           H        ASN  27 -14.199  -0.762   8.249
  218    HA   ASN  27           HA       ASN  27 -13.309  -2.515  10.452
  219   1HB   ASN  27          2HB       ASN  27 -15.038  -3.428   8.736
  220   2HB   ASN  27          1HB       ASN  27 -13.684  -3.455   7.612
  221   1HD2  ASN  27          1HD2      ASN  27 -15.264  -5.660   8.647
  222   2HD2  ASN  27          2HD2      ASN  27 -14.154  -6.740   9.425
  223    H    GLY  28           H        GLY  28 -12.007  -0.178   9.531
  224   1HA   GLY  28          2HA       GLY  28  -9.458  -0.413   9.395
  225   2HA   GLY  28          1HA       GLY  28  -9.806  -1.186   7.854
  226    H    SER  29           H        SER  29  -8.230   0.809   7.523
  227    HA   SER  29           HA       SER  29  -9.893   3.119   6.780
  228   1HB   SER  29          2HB       SER  29  -6.894   3.076   7.221
  229   2HB   SER  29          1HB       SER  29  -7.915   4.496   6.983
  230    HG   SER  29           HG       SER  29  -7.336   3.983   9.223
  231    H    TYR  30           H        TYR  30  -9.861   3.838   4.688
  232    HA   TYR  30           HA       TYR  30  -8.315   2.197   2.785
  233   1HB   TYR  30          2HB       TYR  30 -10.177   2.254   1.240
  234   2HB   TYR  30          1HB       TYR  30 -10.732   1.622   2.784
  235    HD1  TYR  30           HD1      TYR  30 -11.287   4.031   0.226
  236    HD2  TYR  30           HD2      TYR  30 -11.916   3.289   4.369
  237    HE1  TYR  30           HE1      TYR  30 -13.071   5.720   0.251
  238    HE2  TYR  30           HE2      TYR  30 -13.704   4.977   4.407
  239    HH   TYR  30           HH       TYR  30 -15.085   6.249   1.590
  240    H    ILE  31           H        ILE  31  -8.450   3.327   0.504
  241    HA   ILE  31           HA       ILE  31  -7.095   5.855   0.861
  242    HB   ILE  31           HB       ILE  31  -7.753   4.458  -1.735
  243   1HG1  ILE  31          2HG1      ILE  31  -5.247   4.204  -0.060
  244   2HG1  ILE  31          1HG1      ILE  31  -6.495   2.972  -0.200
  245   1HG2  ILE  31          1HG2      ILE  31  -5.658   6.512  -1.032
  246   2HG2  ILE  31          2HG2      ILE  31  -7.102   6.777  -2.010
  247   3HG2  ILE  31          3HG2      ILE  31  -5.822   5.715  -2.596
  248   1HD1  ILE  31          1HD1      ILE  31  -4.597   2.454  -1.612
  249   2HD1  ILE  31          2HD1      ILE  31  -4.769   4.001  -2.440
  250   3HD1  ILE  31          3HD1      ILE  31  -6.028   2.776  -2.591
  251    H    GLU  32           H        GLU  32  -8.117   7.781   0.813
  252    HA   GLU  32           HA       GLU  32 -10.525   7.965  -0.867
  253   1HB   GLU  32          2HB       GLU  32 -11.446   9.614   0.585
  254   2HB   GLU  32          1HB       GLU  32 -10.918   8.276   1.593
  255   1HG   GLU  32          2HG       GLU  32  -9.827   9.733   2.842
  256   2HG   GLU  32          1HG       GLU  32  -8.742  10.024   1.483
  257    H    LYS  33           H        LYS  33  -7.466   9.438   0.007
  258    HA   LYS  33           HA       LYS  33  -7.809  11.287  -2.261
  259   1HB   LYS  33          2HB       LYS  33  -7.783  12.320   0.097
  260   2HB   LYS  33          1HB       LYS  33  -6.079  11.883   0.130
  261   1HG   LYS  33          2HG       LYS  33  -6.102  14.104  -0.572
  262   2HG   LYS  33          1HG       LYS  33  -5.884  13.182  -2.057
  263   1HD   LYS  33          2HD       LYS  33  -7.541  14.546  -2.767
  264   2HD   LYS  33          1HD       LYS  33  -8.539  13.297  -2.026
  265   1HE   LYS  33          2HE       LYS  33  -7.732  15.945  -0.850
  266   2HE   LYS  33          1HE       LYS  33  -9.346  15.415  -1.299
  267   1HZ   LYS  33          1HZ       LYS  33  -7.686  14.447   0.959
  268   2HZ   LYS  33          2HZ       LYS  33  -9.104  13.657   0.456
  269   3HZ   LYS  33          3HZ       LYS  33  -9.177  15.251   1.037
  270    H    TRP  34           H        TRP  34  -6.247  11.255  -3.754
  271    HA   TRP  34           HA       TRP  34  -3.700   9.914  -3.143
  272   1HB   TRP  34          2HB       TRP  34  -5.334   8.380  -4.293
  273   2HB   TRP  34          1HB       TRP  34  -5.357   9.495  -5.649
  274    HD1  TRP  34           HD1      TRP  34  -3.396   9.332  -7.388
  275    HE1  TRP  34           HE1      TRP  34  -1.483   7.643  -7.732
  276    HE3  TRP  34           HE3      TRP  34  -3.633   6.910  -2.885
  277    HZ2  TRP  34           HZ2      TRP  34  -0.240   5.573  -6.280
  278    HZ3  TRP  34           HZ3      TRP  34  -2.042   5.087  -2.446
  279    HH2  TRP  34           HH2      TRP  34  -0.380   4.435  -4.110
  280    H    ASN  35           H        ASN  35  -2.237  11.533  -3.379
  281    HA   ASN  35           HA       ASN  35  -2.697  13.494  -5.518
  282   1HB   ASN  35          2HB       ASN  35  -1.013  13.759  -3.019
  283   2HB   ASN  35          1HB       ASN  35  -1.223  15.006  -4.240
  284   1HD2  ASN  35          1HD2      ASN  35  -1.847  15.022  -1.393
  285   2HD2  ASN  35          2HD2      ASN  35  -3.537  15.389  -1.262
  286    H    LEU  36           H        LEU  36  -0.968  10.811  -4.893
  287    HA   LEU  36           HA       LEU  36   1.590  11.429  -5.929
  288   1HB   LEU  36          2HB       LEU  36   0.004   8.869  -5.767
  289   2HB   LEU  36          1HB       LEU  36   1.605   8.925  -6.475
  290    HG   LEU  36           HG       LEU  36   1.037   9.789  -3.651
  291   1HD1  LEU  36          1HD1      LEU  36   2.025   7.121  -4.645
  292   2HD1  LEU  36          2HD1      LEU  36   0.459   7.431  -3.894
  293   3HD1  LEU  36          3HD1      LEU  36   1.942   7.628  -2.959
  294   1HD2  LEU  36          1HD2      LEU  36   3.075  10.684  -4.655
  295   2HD2  LEU  36          2HD2      LEU  36   3.583   9.048  -5.080
  296   3HD2  LEU  36          3HD2      LEU  36   3.442   9.514  -3.386
  297    H    ARG  37           H        ARG  37   2.392  11.269  -8.020
  298    HA   ARG  37           HA       ARG  37   0.381  11.604 -10.108
  299   1HB   ARG  37          2HB       ARG  37   3.391  11.911 -10.232
  300   2HB   ARG  37          1HB       ARG  37   2.266  12.345 -11.512
  301   1HG   ARG  37          2HG       ARG  37   1.256  14.014  -9.988
  302   2HG   ARG  37          1HG       ARG  37   2.496  13.623  -8.795
  303   1HD   ARG  37          2HD       ARG  37   3.192  15.582  -9.977
  304   2HD   ARG  37          1HD       ARG  37   4.219  14.243 -10.485
  305    HE   ARG  37           HE       ARG  37   1.964  14.616 -12.206
  306   1HH1  ARG  37          1HH1      ARG  37   5.234  15.688 -11.516
  307   2HH1  ARG  37          2HH1      ARG  37   5.475  16.359 -13.106
  308   1HH2  ARG  37          1HH2      ARG  37   2.275  15.449 -14.273
  309   2HH2  ARG  37          2HH2      ARG  37   3.780  16.215 -14.692
  310    H    ALA  38           H        ALA  38   0.678   9.074  -8.976
  311    HA   ALA  38           HA       ALA  38   1.710   7.520 -11.252
  312   1HB   ALA  38          1HB       ALA  38   2.321   5.739  -9.641
  313   2HB   ALA  38          2HB       ALA  38   1.860   6.809  -8.316
  314   3HB   ALA  38          3HB       ALA  38   3.218   7.230  -9.358
  315    HA   PRO  39           HA       PRO  39  -2.388   5.919 -11.574
  316   1HB   PRO  39          2HB       PRO  39  -1.805   3.373 -12.441
  317   2HB   PRO  39          1HB       PRO  39  -1.830   4.798 -13.483
  318   1HG   PRO  39          2HG       PRO  39   0.491   3.423 -12.196
  319   2HG   PRO  39          1HG       PRO  39   0.358   4.108 -13.828
  320   1HD   PRO  39          2HD       PRO  39   1.649   5.395 -11.857
  321   2HD   PRO  39          1HD       PRO  39   0.711   6.275 -13.079
  322    H    LEU  40           H        LEU  40  -3.855   4.606 -10.523
  323    HA   LEU  40           HA       LEU  40  -3.194   3.809  -7.896
  324   1HB   LEU  40          2HB       LEU  40  -5.620   3.580  -9.636
  325   2HB   LEU  40          1HB       LEU  40  -5.563   2.712  -8.123
  326    HG   LEU  40           HG       LEU  40  -6.766   4.790  -7.833
  327   1HD1  LEU  40          1HD1      LEU  40  -5.517   5.739  -5.976
  328   2HD1  LEU  40          2HD1      LEU  40  -4.055   4.921  -6.528
  329   3HD1  LEU  40          3HD1      LEU  40  -5.435   3.977  -5.963
  330   1HD2  LEU  40          1HD2      LEU  40  -4.246   6.160  -8.765
  331   2HD2  LEU  40          2HD2      LEU  40  -5.679   6.961  -8.119
  332   3HD2  LEU  40          3HD2      LEU  40  -5.774   6.079  -9.643
  333    HA   PRO  41           HA       PRO  41  -1.703  -0.294  -8.579
  334   1HB   PRO  41          2HB       PRO  41  -2.336  -1.367  -6.146
  335   2HB   PRO  41          1HB       PRO  41  -0.949  -0.306  -6.418
  336   1HG   PRO  41          2HG       PRO  41  -3.659   0.364  -5.335
  337   2HG   PRO  41          1HG       PRO  41  -2.063   0.891  -4.764
  338   1HD   PRO  41          2HD       PRO  41  -3.612   2.487  -6.265
  339   2HD   PRO  41          1HD       PRO  41  -1.846   2.472  -6.444
  340    H    THR  42           H        THR  42  -2.433  -2.563  -8.509
  341    HA   THR  42           HA       THR  42  -5.207  -2.713  -9.372
  342    HB   THR  42           HB       THR  42  -4.621  -5.001 -10.107
  343    HG1  THR  42           HG1      THR  42  -1.977  -4.954  -9.951
  344   1HG2  THR  42          1HG2      THR  42  -3.045  -4.363 -11.879
  345   2HG2  THR  42          2HG2      THR  42  -2.668  -2.879 -11.005
  346   3HG2  THR  42          3HG2      THR  42  -4.291  -3.136 -11.646
  347    H    GLN  43           H        GLN  43  -6.626  -4.402  -8.581
  348    HA   GLN  43           HA       GLN  43  -6.790  -4.644  -5.802
  349   1HB   GLN  43          2HB       GLN  43  -8.624  -5.048  -7.481
  350   2HB   GLN  43          1HB       GLN  43  -7.892  -6.601  -7.825
  351   1HG   GLN  43          2HG       GLN  43  -9.786  -6.780  -6.282
  352   2HG   GLN  43          1HG       GLN  43  -8.277  -7.344  -5.568
  353   1HE2  GLN  43          1HE2      GLN  43  -7.360  -6.203  -3.886
  354   2HE2  GLN  43          2HE2      GLN  43  -8.209  -4.961  -3.029
  355    H    ALA  44           H        ALA  44  -5.531  -6.823  -8.248
  356    HA   ALA  44           HA       ALA  44  -4.782  -8.974  -6.652
  357   1HB   ALA  44          1HB       ALA  44  -4.782  -9.012  -9.099
  358   2HB   ALA  44          2HB       ALA  44  -3.254  -9.586  -8.431
  359   3HB   ALA  44          3HB       ALA  44  -3.366  -7.961  -9.109
  360    H    GLU  45           H        GLU  45  -2.811  -6.107  -7.555
  361    HA   GLU  45           HA       GLU  45  -0.530  -6.976  -6.167
  362   1HB   GLU  45          2HB       GLU  45  -1.046  -4.911  -7.883
  363   2HB   GLU  45          1HB       GLU  45  -0.855  -4.060  -6.350
  364   1HG   GLU  45          2HG       GLU  45   1.265  -5.349  -6.030
  365   2HG   GLU  45          1HG       GLU  45   1.104  -5.898  -7.690
  366    H    LEU  46           H        LEU  46  -3.226  -4.880  -5.202
  367    HA   LEU  46           HA       LEU  46  -2.400  -4.066  -2.705
  368   1HB   LEU  46          2HB       LEU  46  -5.144  -4.943  -3.610
  369   2HB   LEU  46          1HB       LEU  46  -4.828  -4.127  -2.097
  370    HG   LEU  46           HG       LEU  46  -4.280  -2.960  -4.821
  371   1HD1  LEU  46          1HD1      LEU  46  -6.516  -2.420  -2.873
  372   2HD1  LEU  46          2HD1      LEU  46  -6.665  -3.228  -4.434
  373   3HD1  LEU  46          3HD1      LEU  46  -6.209  -1.525  -4.360
  374   1HD2  LEU  46          1HD2      LEU  46  -4.203  -1.713  -2.075
  375   2HD2  LEU  46          2HD2      LEU  46  -3.961  -0.868  -3.603
  376   3HD2  LEU  46          3HD2      LEU  46  -2.802  -2.090  -3.080
  377    H    GLU  47           H        GLU  47  -4.107  -7.074  -3.520
  378    HA   GLU  47           HA       GLU  47  -4.114  -8.189  -0.942
  379   1HB   GLU  47          2HB       GLU  47  -4.153  -9.499  -3.660
  380   2HB   GLU  47          1HB       GLU  47  -4.426 -10.360  -2.150
  381   1HG   GLU  47          2HG       GLU  47  -6.394  -9.029  -1.712
  382   2HG   GLU  47          1HG       GLU  47  -6.100  -8.077  -3.166
  383    H    THR  48           H        THR  48  -1.803  -8.392  -3.591
  384    HA   THR  48           HA       THR  48  -0.151 -10.369  -2.448
  385    HB   THR  48           HB       THR  48   0.681  -8.244  -4.433
  386    HG1  THR  48           HG1      THR  48  -1.061  -9.241  -5.358
  387   1HG2  THR  48          1HG2      THR  48   1.707 -11.043  -3.927
  388   2HG2  THR  48          2HG2      THR  48   2.532  -9.547  -3.488
  389   3HG2  THR  48          3HG2      THR  48   2.276  -9.946  -5.187
  390    H    TRP  49           H        TRP  49  -0.146  -6.826  -2.195
  391    HA   TRP  49           HA       TRP  49   2.292  -6.511  -0.837
  392   1HB   TRP  49          2HB       TRP  49  -0.273  -4.944  -0.469
  393   2HB   TRP  49          1HB       TRP  49   1.305  -4.447   0.123
  394    HD1  TRP  49           HD1      TRP  49   2.326  -5.670  -3.019
  395    HE1  TRP  49           HE1      TRP  49   2.243  -3.889  -4.884
  396    HE3  TRP  49           HE3      TRP  49  -0.657  -2.222  -0.715
  397    HZ2  TRP  49           HZ2      TRP  49   1.082  -1.359  -5.305
  398    HZ3  TRP  49           HZ3      TRP  49  -1.201  -0.146  -1.913
  399    HH2  TRP  49           HH2      TRP  49  -0.348   0.279  -4.160
  400    H    TRP  50           H        TRP  50  -0.977  -7.127   0.362
  401    HA   TRP  50           HA       TRP  50  -0.352  -7.181   3.102
  402   1HB   TRP  50          2HB       TRP  50  -2.655  -7.035   2.096
  403   2HB   TRP  50          1HB       TRP  50  -2.539  -8.746   1.708
  404    HD1  TRP  50           HD1      TRP  50  -3.232 -10.419   3.566
  405    HE1  TRP  50           HE1      TRP  50  -3.951 -10.186   6.026
  406    HE3  TRP  50           HE3      TRP  50  -2.164  -5.467   4.269
  407    HZ2  TRP  50           HZ2      TRP  50  -4.046  -8.181   8.000
  408    HZ3  TRP  50           HZ3      TRP  50  -2.599  -4.469   6.477
  409    HH2  TRP  50           HH2      TRP  50  -3.522  -5.801   8.302
  410    H    GLU  51           H        GLU  51  -0.393  -9.718   0.635
  411    HA   GLU  51           HA       GLU  51   0.198 -11.900   2.273
  412   1HB   GLU  51          2HB       GLU  51   0.710 -11.303  -0.634
  413   2HB   GLU  51          1HB       GLU  51   1.129 -12.838   0.091
  414   1HG   GLU  51          2HG       GLU  51  -1.175 -13.253   0.663
  415   2HG   GLU  51          1HG       GLU  51  -1.631 -11.664   0.048
  416    H    GLU  52           H        GLU  52   2.372  -9.794   0.397
  417    HA   GLU  52           HA       GLU  52   4.768 -11.010   1.200
  418   1HB   GLU  52          2HB       GLU  52   4.158  -8.208   0.274
  419   2HB   GLU  52          1HB       GLU  52   5.791  -8.752   0.627
  420   1HG   GLU  52          2HG       GLU  52   5.537 -10.519  -1.068
  421   2HG   GLU  52          1HG       GLU  52   3.939  -9.883  -1.450
  422    H    LEU  53           H        LEU  53   2.944  -8.330   2.623
  423    HA   LEU  53           HA       LEU  53   4.853  -7.606   4.558
  424   1HB   LEU  53          2HB       LEU  53   2.989  -6.172   3.877
  425   2HB   LEU  53          1HB       LEU  53   1.851  -7.292   4.598
  426    HG   LEU  53           HG       LEU  53   2.874  -6.830   6.816
  427   1HD1  LEU  53          1HD1      LEU  53   4.314  -4.884   7.076
  428   2HD1  LEU  53          2HD1      LEU  53   4.342  -4.661   5.327
  429   3HD1  LEU  53          3HD1      LEU  53   5.073  -6.097   6.045
  430   1HD2  LEU  53          1HD2      LEU  53   1.863  -4.611   7.077
  431   2HD2  LEU  53          2HD2      LEU  53   0.841  -5.698   6.137
  432   3HD2  LEU  53          3HD2      LEU  53   1.786  -4.451   5.323
  433    H    GLN  54           H        GLN  54   2.283 -10.004   4.582
  434    HA   GLN  54           HA       GLN  54   2.549 -10.527   7.403
  435   1HB   GLN  54          2HB       GLN  54   0.699 -11.229   5.301
  436   2HB   GLN  54          1HB       GLN  54   1.162 -12.659   6.210
  437   1HG   GLN  54          2HG       GLN  54  -0.831 -11.687   7.155
  438   2HG   GLN  54          1HG       GLN  54   0.508 -11.537   8.290
  439   1HE2  GLN  54          1HE2      GLN  54   0.096  -9.499   5.466
  440   2HE2  GLN  54          2HE2      GLN  54  -0.252  -8.048   6.342
  441    H    LYS  55           H        LYS  55   3.700 -11.953   4.404
  442    HA   LYS  55           HA       LYS  55   4.783 -14.257   5.780
  443   1HB   LYS  55          2HB       LYS  55   4.839 -13.375   2.920
  444   2HB   LYS  55          1HB       LYS  55   5.692 -14.795   3.488
  445   1HG   LYS  55          2HG       LYS  55   3.571 -15.762   4.243
  446   2HG   LYS  55          1HG       LYS  55   2.724 -14.327   3.663
  447   1HD   LYS  55          2HD       LYS  55   3.579 -14.809   1.387
  448   2HD   LYS  55          1HD       LYS  55   4.265 -16.314   2.005
  449   1HE   LYS  55          2HE       LYS  55   2.017 -17.033   2.694
  450   2HE   LYS  55          1HE       LYS  55   1.347 -15.546   2.023
  451   1HZ   LYS  55          1HZ       LYS  55   2.256 -16.240  -0.155
  452   2HZ   LYS  55          2HZ       LYS  55   1.069 -17.291   0.443
  453   3HZ   LYS  55          3HZ       LYS  55   2.707 -17.726   0.533
  454    H    ASN  56           H        ASN  56   5.770 -11.169   5.146
  455    HA   ASN  56           HA       ASN  56   8.503 -11.345   4.641
  456   1HB   ASN  56          2HB       ASN  56   7.038  -9.255   4.686
  457   2HB   ASN  56          1HB       ASN  56   7.217  -9.271   6.434
  458   1HD2  ASN  56          1HD2      ASN  56   8.034  -7.300   4.439
  459   2HD2  ASN  56          2HD2      ASN  56   9.734  -7.075   4.655
  460    HA   PRO  57           HA       PRO  57  10.091 -13.403   8.295
  461   1HB   PRO  57          2HB       PRO  57  12.514 -11.864   7.482
  462   2HB   PRO  57          1HB       PRO  57  12.352 -13.581   7.871
  463   1HG   PRO  57          2HG       PRO  57  12.591 -12.785   5.347
  464   2HG   PRO  57          1HG       PRO  57  11.486 -14.102   5.781
  465   1HD   PRO  57          2HD       PRO  57  10.876 -11.264   5.092
  466   2HD   PRO  57          1HD       PRO  57   9.962 -12.738   4.715
  467    HA   PRO  58           HA       PRO  58   9.732 -10.729  11.754
  468   1HB   PRO  58          2HB       PRO  58  12.319 -11.243  12.859
  469   2HB   PRO  58          1HB       PRO  58  10.770 -11.934  13.343
  470   1HG   PRO  58          2HG       PRO  58  12.869 -13.049  11.584
  471   2HG   PRO  58          1HG       PRO  58  11.656 -13.892  12.562
  472   1HD   PRO  58          2HD       PRO  58  11.484 -13.776   9.886
  473   2HD   PRO  58          1HD       PRO  58  10.032 -13.725  10.911
  474    H    TYR  59           H        TYR  59  10.060  -8.649  12.154
  475    HA   TYR  59           HA       TYR  59  11.734  -7.141  10.413
  476   1HB   TYR  59          2HB       TYR  59   9.548  -6.311  11.221
  477   2HB   TYR  59          1HB       TYR  59  10.187  -6.250  12.860
  478    HD1  TYR  59           HD1      TYR  59  10.392  -4.738   9.501
  479    HD2  TYR  59           HD2      TYR  59  11.561  -4.428  13.580
  480    HE1  TYR  59           HE1      TYR  59  11.173  -2.441   9.099
  481    HE2  TYR  59           HE2      TYR  59  12.350  -2.133  13.187
  482    HH   TYR  59           HH       TYR  59  13.107  -0.736  11.317
  483    H    GLU  60           H        GLU  60  13.769  -6.503  10.693
  484    HA   GLU  60           HA       GLU  60  15.044  -6.989  13.272
  485   1HB   GLU  60          2HB       GLU  60  17.152  -6.483  11.919
  486   2HB   GLU  60          1HB       GLU  60  16.294  -7.969  11.546
  487   1HG   GLU  60          2HG       GLU  60  15.260  -6.881   9.621
  488   2HG   GLU  60          1HG       GLU  60  16.131  -5.396   9.997
  Start of MODEL   18
    1   1H    MET   1          1H        MET   1  -8.551  -5.761   6.901
    2   2H    MET   1          2H        MET   1  -7.277  -5.611   8.006
    3   3H    MET   1          3H        MET   1  -7.478  -7.056   7.138
    4    HA   MET   1           HA       MET   1  -5.670  -5.790   6.224
    5   1HB   MET   1          2HB       MET   1  -7.406  -7.102   4.817
    6   2HB   MET   1          1HB       MET   1  -7.986  -5.519   4.321
    7   1HG   MET   1          2HG       MET   1  -5.154  -6.479   3.974
    8   2HG   MET   1          1HG       MET   1  -6.404  -6.595   2.739
    9   1HE   MET   1          1HE       MET   1  -3.579  -5.198   2.233
   10   2HE   MET   1          2HE       MET   1  -4.088  -3.769   1.334
   11   3HE   MET   1          3HE       MET   1  -4.849  -5.328   1.017
   12    H    ILE   2           H        ILE   2  -4.788  -3.850   6.234
   13    HA   ILE   2           HA       ILE   2  -6.559  -1.502   6.055
   14    HB   ILE   2           HB       ILE   2  -3.891  -1.576   7.489
   15   1HG1  ILE   2          2HG1      ILE   2  -5.515  -1.303   9.544
   16   2HG1  ILE   2          1HG1      ILE   2  -6.646  -2.151   8.497
   17   1HG2  ILE   2          1HG2      ILE   2  -4.584   0.630   6.727
   18   2HG2  ILE   2          2HG2      ILE   2  -4.650   0.528   8.484
   19   3HG2  ILE   2          3HG2      ILE   2  -6.137   0.439   7.538
   20   1HD1  ILE   2          1HD1      ILE   2  -3.947  -3.155   9.353
   21   2HD1  ILE   2          2HD1      ILE   2  -5.081  -4.003   8.299
   22   3HD1  ILE   2          3HD1      ILE   2  -5.506  -3.685   9.981
   23    H    LEU   3           H        LEU   3  -6.088  -0.028   4.489
   24    HA   LEU   3           HA       LEU   3  -4.357  -0.657   2.400
   25   1HB   LEU   3          2HB       LEU   3  -6.108   1.528   3.188
   26   2HB   LEU   3          1HB       LEU   3  -4.733   2.065   2.262
   27    HG   LEU   3           HG       LEU   3  -6.629   1.674   0.811
   28   1HD1  LEU   3          1HD1      LEU   3  -5.602   0.120  -0.782
   29   2HD1  LEU   3          2HD1      LEU   3  -4.484  -0.418   0.472
   30   3HD1  LEU   3          3HD1      LEU   3  -4.423   1.247  -0.110
   31   1HD2  LEU   3          1HD2      LEU   3  -6.544  -1.171   1.813
   32   2HD2  LEU   3          2HD2      LEU   3  -7.572  -0.563   0.515
   33   3HD2  LEU   3          3HD2      LEU   3  -7.801   0.016   2.167
   34    H    TYR   4           H        TYR   4  -3.903   1.291   5.254
   35    HA   TYR   4           HA       TYR   4  -1.656   2.762   4.638
   36   1HB   TYR   4          2HB       TYR   4  -3.009   2.924   6.736
   37   2HB   TYR   4          1HB       TYR   4  -2.226   1.456   7.304
   38    HD1  TYR   4           HD1      TYR   4  -1.626   4.981   6.362
   39    HD2  TYR   4           HD2      TYR   4  -0.074   1.534   8.316
   40    HE1  TYR   4           HE1      TYR   4   0.192   6.339   7.310
   41    HE2  TYR   4           HE2      TYR   4   1.749   2.886   9.270
   42    HH   TYR   4           HH       TYR   4   1.729   6.282   9.225
   43    H    ASP   5           H        ASP   5  -1.744  -0.464   6.129
   44    HA   ASP   5           HA       ASP   5   1.028  -0.827   6.293
   45   1HB   ASP   5          2HB       ASP   5  -1.286  -2.749   6.191
   46   2HB   ASP   5          1HB       ASP   5   0.373  -3.321   6.288
   47    H    ALA   6           H        ALA   6  -1.287  -1.871   3.836
   48    HA   ALA   6           HA       ALA   6   0.468  -3.286   2.194
   49   1HB   ALA   6          1HB       ALA   6  -1.214  -3.037   0.452
   50   2HB   ALA   6          2HB       ALA   6  -1.986  -1.740   1.365
   51   3HB   ALA   6          3HB       ALA   6  -1.973  -3.384   2.003
   52    H    ILE   7           H        ILE   7  -0.561   0.123   1.946
   53    HA   ILE   7           HA       ILE   7   0.973   0.735  -0.339
   54    HB   ILE   7           HB       ILE   7   0.074   2.614   1.858
   55   1HG1  ILE   7          2HG1      ILE   7  -1.221   1.973  -0.798
   56   2HG1  ILE   7          1HG1      ILE   7  -1.762   1.348   0.756
   57   1HG2  ILE   7          1HG2      ILE   7   0.304   4.372   0.163
   58   2HG2  ILE   7          2HG2      ILE   7   0.946   3.185  -0.971
   59   3HG2  ILE   7          3HG2      ILE   7   1.846   3.583   0.492
   60   1HD1  ILE   7          1HD1      ILE   7  -1.679   4.255  -0.021
   61   2HD1  ILE   7          2HD1      ILE   7  -2.283   3.597   1.499
   62   3HD1  ILE   7          3HD1      ILE   7  -3.116   3.235  -0.014
   63    H    MET   8           H        MET   8   1.678   0.969   3.115
   64    HA   MET   8           HA       MET   8   4.121   2.381   2.818
   65   1HB   MET   8          2HB       MET   8   2.721   2.221   4.904
   66   2HB   MET   8          1HB       MET   8   3.329   0.584   5.106
   67   1HG   MET   8          2HG       MET   8   4.575   2.106   6.499
   68   2HG   MET   8          1HG       MET   8   5.618   1.467   5.231
   69   1HE   MET   8          1HE       MET   8   7.010   5.096   5.747
   70   2HE   MET   8          2HE       MET   8   7.398   3.377   5.734
   71   3HE   MET   8          3HE       MET   8   6.360   4.036   6.997
   72    H    TYR   9           H        TYR   9   3.262  -0.973   2.601
   73    HA   TYR   9           HA       TYR   9   5.901  -1.997   2.921
   74   1HB   TYR   9          2HB       TYR   9   4.029  -3.494   3.268
   75   2HB   TYR   9          1HB       TYR   9   3.459  -3.230   1.621
   76    HD1  TYR   9           HD1      TYR   9   4.118  -4.687  -0.068
   77    HD2  TYR   9           HD2      TYR   9   6.419  -4.504   3.505
   78    HE1  TYR   9           HE1      TYR   9   5.501  -6.557  -0.864
   79    HE2  TYR   9           HE2      TYR   9   7.805  -6.374   2.718
   80    HH   TYR   9           HH       TYR   9   7.702  -7.488  -0.516
   81    H    LYS  10           H        LYS  10   3.915  -1.177   0.086
   82    HA   LYS  10           HA       LYS  10   5.948  -1.963  -1.761
   83   1HB   LYS  10          2HB       LYS  10   3.520  -1.855  -2.352
   84   2HB   LYS  10          1HB       LYS  10   3.634  -0.099  -2.301
   85   1HG   LYS  10          2HG       LYS  10   5.461  -0.286  -4.029
   86   2HG   LYS  10          1HG       LYS  10   5.020  -1.985  -4.186
   87   1HD   LYS  10          2HD       LYS  10   2.708  -1.272  -4.739
   88   2HD   LYS  10          1HD       LYS  10   3.260   0.405  -4.709
   89   1HE   LYS  10          2HE       LYS  10   3.264  -0.295  -6.978
   90   2HE   LYS  10          1HE       LYS  10   4.943  -0.219  -6.456
   91   1HZ   LYS  10          1HZ       LYS  10   4.783  -2.667  -6.049
   92   2HZ   LYS  10          2HZ       LYS  10   4.684  -2.204  -7.672
   93   3HZ   LYS  10          3HZ       LYS  10   3.274  -2.643  -6.834
   94    H    TYR  11           H        TYR  11   4.803   1.184  -0.580
   95    HA   TYR  11           HA       TYR  11   7.309   2.336  -1.619
   96   1HB   TYR  11          2HB       TYR  11   4.600   3.635  -1.284
   97   2HB   TYR  11          1HB       TYR  11   6.076   4.530  -1.618
   98    HD1  TYR  11           HD1      TYR  11   7.372   3.862  -3.766
   99    HD2  TYR  11           HD2      TYR  11   3.308   2.833  -3.055
  100    HE1  TYR  11           HE1      TYR  11   7.039   3.538  -6.180
  101    HE2  TYR  11           HE2      TYR  11   2.963   2.511  -5.469
  102    HH   TYR  11           HH       TYR  11   3.963   3.253  -7.595
  103    HA   PRO  12           HA       PRO  12   7.799   2.755   2.929
  104   1HB   PRO  12          2HB       PRO  12  10.615   3.030   2.113
  105   2HB   PRO  12          1HB       PRO  12   9.887   1.916   3.266
  106   1HG   PRO  12          2HG       PRO  12  10.799   1.061   0.902
  107   2HG   PRO  12          1HG       PRO  12   9.344   0.363   1.640
  108   1HD   PRO  12          2HD       PRO  12   9.563   2.394  -0.557
  109   2HD   PRO  12          1HD       PRO  12   8.479   0.992  -0.423
  110    H    ASN  13           H        ASN  13   8.667   4.624   0.208
  111    HA   ASN  13           HA       ASN  13   9.470   6.950   1.766
  112   1HB   ASN  13          2HB       ASN  13   9.366   6.512  -1.225
  113   2HB   ASN  13          1HB       ASN  13  10.035   7.917  -0.415
  114   1HD2  ASN  13          1HD2      ASN  13  11.279   5.966  -2.212
  115   2HD2  ASN  13          2HD2      ASN  13  12.627   5.313  -1.343
  116    H    ALA  14           H        ALA  14   6.625   5.693   1.190
  117    HA   ALA  14           HA       ALA  14   5.267   7.880  -0.123
  118   1HB   ALA  14          1HB       ALA  14   3.246   6.562   0.249
  119   2HB   ALA  14          2HB       ALA  14   4.163   5.436   1.250
  120   3HB   ALA  14          3HB       ALA  14   4.524   5.579  -0.471
  121    H    VAL  15           H        VAL  15   3.965   9.403   0.814
  122    HA   VAL  15           HA       VAL  15   4.166   9.615   3.738
  123    HB   VAL  15           HB       VAL  15   3.562  11.807   1.735
  124   1HG1  VAL  15          1HG1      VAL  15   4.228  11.964   4.670
  125   2HG1  VAL  15          2HG1      VAL  15   2.648  12.258   3.942
  126   3HG1  VAL  15          3HG1      VAL  15   3.996  13.337   3.589
  127   1HG2  VAL  15          1HG2      VAL  15   5.843  12.595   2.151
  128   2HG2  VAL  15          2HG2      VAL  15   5.829  10.988   1.428
  129   3HG2  VAL  15          3HG2      VAL  15   6.149  11.176   3.153
  130    H    SER  16           H        SER  16   2.313   8.240   4.130
  131    HA   SER  16           HA       SER  16  -0.241   9.034   3.026
  132   1HB   SER  16          2HB       SER  16   0.156   7.119   5.324
  133   2HB   SER  16          1HB       SER  16  -1.109   7.103   4.097
  134    HG   SER  16           HG       SER  16   0.968   5.645   4.036
  135    H    ARG  17           H        ARG  17   1.090  10.990   4.362
  136    HA   ARG  17           HA       ARG  17  -0.337  11.443   6.827
  137   1HB   ARG  17          2HB       ARG  17   1.959  12.929   5.572
  138   2HB   ARG  17          1HB       ARG  17   1.115  13.495   7.004
  139   1HG   ARG  17          2HG       ARG  17   1.761  11.399   8.159
  140   2HG   ARG  17          1HG       ARG  17   2.700  10.951   6.732
  141   1HD   ARG  17          2HD       ARG  17   4.100  12.888   6.980
  142   2HD   ARG  17          1HD       ARG  17   3.098  13.493   8.296
  143    HE   ARG  17           HE       ARG  17   4.728  11.040   8.483
  144   1HH1  ARG  17          1HH1      ARG  17   3.403  13.978   9.868
  145   2HH1  ARG  17          2HH1      ARG  17   4.226  13.773  11.386
  146   1HH2  ARG  17          1HH2      ARG  17   5.803  10.775  10.496
  147   2HH2  ARG  17          2HH2      ARG  17   5.570  11.968  11.745
  148    H    LYS  18           H        LYS  18   0.257  12.926   3.707
  149    HA   LYS  18           HA       LYS  18  -2.022  14.705   4.066
  150   1HB   LYS  18          2HB       LYS  18  -0.045  15.736   5.155
  151   2HB   LYS  18          1HB       LYS  18   0.806  15.666   3.621
  152   1HG   LYS  18          2HG       LYS  18  -0.884  17.166   2.650
  153   2HG   LYS  18          1HG       LYS  18  -1.648  17.289   4.242
  154   1HD   LYS  18          2HD       LYS  18   0.505  18.100   5.158
  155   2HD   LYS  18          1HD       LYS  18   1.173  18.079   3.528
  156   1HE   LYS  18          2HE       LYS  18  -0.501  19.706   2.813
  157   2HE   LYS  18          1HE       LYS  18  -1.176  19.729   4.444
  158   1HZ   LYS  18          1HZ       LYS  18   1.609  20.491   3.752
  159   2HZ   LYS  18          2HZ       LYS  18   0.885  20.603   5.282
  160   3HZ   LYS  18          3HZ       LYS  18   0.341  21.588   4.013
  161    H    ASP  19           H        ASP  19   0.785  13.851   2.010
  162    HA   ASP  19           HA       ASP  19  -0.259  14.875  -0.397
  163   1HB   ASP  19          2HB       ASP  19   1.711  12.629   0.086
  164   2HB   ASP  19          1HB       ASP  19   1.335  13.272  -1.509
  165    H    PHE  20           H        PHE  20  -0.720  11.895   1.311
  166    HA   PHE  20           HA       PHE  20  -3.264  11.695   0.028
  167   1HB   PHE  20          2HB       PHE  20  -3.063   9.304  -0.579
  168   2HB   PHE  20          1HB       PHE  20  -2.040  10.343  -1.554
  169    HD1  PHE  20           HD1      PHE  20   0.424  10.396  -1.091
  170    HD2  PHE  20           HD2      PHE  20  -2.192   7.541   0.663
  171    HE1  PHE  20           HE1      PHE  20   2.345   8.935  -0.609
  172    HE2  PHE  20           HE2      PHE  20  -0.281   6.080   1.155
  173    HZ   PHE  20           HZ       PHE  20   1.989   6.777   0.518
  174    H    GLU  21           H        GLU  21  -4.708  10.347   1.207
  175    HA   GLU  21           HA       GLU  21  -3.842   9.716   3.920
  176   1HB   GLU  21          2HB       GLU  21  -4.370  12.145   3.894
  177   2HB   GLU  21          1HB       GLU  21  -5.989  11.766   3.323
  178   1HG   GLU  21          2HG       GLU  21  -6.315  10.435   5.419
  179   2HG   GLU  21          1HG       GLU  21  -4.775  11.081   5.984
  180    H    LEU  22           H        LEU  22  -5.256   8.353   5.010
  181    HA   LEU  22           HA       LEU  22  -7.201   7.027   3.268
  182   1HB   LEU  22          2HB       LEU  22  -6.209   6.118   5.959
  183   2HB   LEU  22          1HB       LEU  22  -7.059   5.164   4.761
  184    HG   LEU  22           HG       LEU  22  -4.251   6.240   4.485
  185   1HD1  LEU  22          1HD1      LEU  22  -5.282   3.441   4.908
  186   2HD1  LEU  22          2HD1      LEU  22  -4.431   4.427   6.097
  187   3HD1  LEU  22          3HD1      LEU  22  -3.600   3.892   4.638
  188   1HD2  LEU  22          1HD2      LEU  22  -4.150   4.897   2.449
  189   2HD2  LEU  22          2HD2      LEU  22  -5.408   6.131   2.331
  190   3HD2  LEU  22          3HD2      LEU  22  -5.845   4.451   2.650
  191    H    ARG  23           H        ARG  23  -9.284   6.549   3.985
  192    HA   ARG  23           HA       ARG  23 -10.189   7.842   6.451
  193   1HB   ARG  23          2HB       ARG  23 -11.206   8.377   3.705
  194   2HB   ARG  23          1HB       ARG  23 -12.379   8.277   5.009
  195   1HG   ARG  23          2HG       ARG  23 -11.959  10.483   5.116
  196   2HG   ARG  23          1HG       ARG  23 -10.654   9.931   6.165
  197   1HD   ARG  23          2HD       ARG  23  -9.121   9.956   4.239
  198   2HD   ARG  23          1HD       ARG  23 -10.428  10.566   3.223
  199    HE   ARG  23           HE       ARG  23  -8.989  12.032   5.317
  200   1HH1  ARG  23          1HH1      ARG  23 -11.546  11.993   2.894
  201   2HH1  ARG  23          2HH1      ARG  23 -11.637  13.733   2.805
  202   1HH2  ARG  23          1HH2      ARG  23  -9.150  14.305   5.206
  203   2HH2  ARG  23          2HH2      ARG  23 -10.295  15.034   4.117
  204    H    ASN  24           H        ASN  24 -12.453   7.132   6.968
  205    HA   ASN  24           HA       ASN  24 -12.474   4.225   6.798
  206   1HB   ASN  24          2HB       ASN  24 -12.801   5.264   8.979
  207   2HB   ASN  24          1HB       ASN  24 -14.191   6.158   8.372
  208   1HD2  ASN  24          1HD2      ASN  24 -15.603   5.297   9.836
  209   2HD2  ASN  24          2HD2      ASN  24 -16.141   3.651   9.769
  210    H    ASP  25           H        ASP  25 -13.710   3.110   5.438
  211    HA   ASP  25           HA       ASP  25 -15.905   4.505   4.057
  212   1HB   ASP  25          2HB       ASP  25 -14.120   3.375   2.686
  213   2HB   ASP  25          1HB       ASP  25 -14.652   1.837   3.356
  214    H    GLY  26           H        GLY  26 -15.270   2.279   6.504
  215   1HA   GLY  26          2HA       GLY  26 -17.329   1.702   7.816
  216   2HA   GLY  26          1HA       GLY  26 -17.967   1.091   6.296
  217    H    ASN  27           H        ASN  27 -16.049  -0.344   5.208
  218    HA   ASN  27           HA       ASN  27 -15.729  -2.582   7.041
  219   1HB   ASN  27          2HB       ASN  27 -16.474  -2.609   4.516
  220   2HB   ASN  27          1HB       ASN  27 -14.747  -2.545   4.200
  221   1HD2  ASN  27          1HD2      ASN  27 -16.650  -4.620   3.568
  222   2HD2  ASN  27          2HD2      ASN  27 -16.094  -6.061   4.353
  223    H    GLY  28           H        GLY  28 -14.069   0.103   6.782
  224   1HA   GLY  28          2HA       GLY  28 -11.879  -0.330   8.136
  225   2HA   GLY  28          1HA       GLY  28 -11.395  -1.077   6.620
  226    H    SER  29           H        SER  29  -9.693   0.643   6.965
  227    HA   SER  29           HA       SER  29 -10.582   3.268   6.015
  228   1HB   SER  29          2HB       SER  29  -7.918   2.440   7.192
  229   2HB   SER  29          1HB       SER  29  -8.392   4.083   6.765
  230    HG   SER  29           HG       SER  29 -10.192   2.842   8.413
  231    H    TYR  30           H        TYR  30 -10.248   3.845   3.981
  232    HA   TYR  30           HA       TYR  30  -8.308   2.303   2.377
  233   1HB   TYR  30          2HB       TYR  30  -9.807   2.279   0.523
  234   2HB   TYR  30          1HB       TYR  30 -10.751   1.779   1.915
  235    HD1  TYR  30           HD1      TYR  30 -11.711   4.087   3.207
  236    HD2  TYR  30           HD2      TYR  30 -11.019   3.548  -0.958
  237    HE1  TYR  30           HE1      TYR  30 -13.344   5.853   2.714
  238    HE2  TYR  30           HE2      TYR  30 -12.649   5.320  -1.460
  239    HH   TYR  30           HH       TYR  30 -13.859   7.436   0.913
  240    H    ILE  31           H        ILE  31  -8.040   3.571   0.161
  241    HA   ILE  31           HA       ILE  31  -6.826   6.083   0.848
  242    HB   ILE  31           HB       ILE  31  -7.229   4.918  -1.915
  243   1HG1  ILE  31          2HG1      ILE  31  -4.843   4.595  -0.082
  244   2HG1  ILE  31          1HG1      ILE  31  -6.051   3.347  -0.366
  245   1HG2  ILE  31          1HG2      ILE  31  -5.312   6.311  -2.517
  246   2HG2  ILE  31          2HG2      ILE  31  -5.228   6.923  -0.866
  247   3HG2  ILE  31          3HG2      ILE  31  -6.631   7.290  -1.872
  248   1HD1  ILE  31          1HD1      ILE  31  -5.453   3.352  -2.752
  249   2HD1  ILE  31          2HD1      ILE  31  -4.101   2.925  -1.703
  250   3HD1  ILE  31          3HD1      ILE  31  -4.192   4.537  -2.409
  251    H    GLU  32           H        GLU  32  -7.890   8.003   0.892
  252    HA   GLU  32           HA       GLU  32 -10.141   8.303  -0.981
  253   1HB   GLU  32          2HB       GLU  32 -10.954   8.157   1.331
  254   2HB   GLU  32          1HB       GLU  32  -9.947   9.536   1.766
  255   1HG   GLU  32          2HG       GLU  32 -11.228  11.019   0.495
  256   2HG   GLU  32          1HG       GLU  32 -11.995   9.715  -0.410
  257    H    LYS  33           H        LYS  33  -7.673  10.107   0.862
  258    HA   LYS  33           HA       LYS  33  -7.742  12.185  -1.178
  259   1HB   LYS  33          2HB       LYS  33  -6.208  11.916   1.403
  260   2HB   LYS  33          1HB       LYS  33  -5.791  13.135   0.208
  261   1HG   LYS  33          2HG       LYS  33  -8.403  13.638   0.417
  262   2HG   LYS  33          1HG       LYS  33  -8.113  12.976   2.022
  263   1HD   LYS  33          2HD       LYS  33  -6.569  15.227   0.772
  264   2HD   LYS  33          1HD       LYS  33  -7.853  15.419   1.955
  265   1HE   LYS  33          2HE       LYS  33  -6.544  14.189   3.595
  266   2HE   LYS  33          1HE       LYS  33  -5.274  13.925   2.402
  267   1HZ   LYS  33          1HZ       LYS  33  -4.801  16.245   2.349
  268   2HZ   LYS  33          2HZ       LYS  33  -4.831  15.772   3.978
  269   3HZ   LYS  33          3HZ       LYS  33  -6.144  16.613   3.314
  270    H    TRP  34           H        TRP  34  -6.316  12.372  -2.781
  271    HA   TRP  34           HA       TRP  34  -3.903  10.764  -2.840
  272   1HB   TRP  34          2HB       TRP  34  -5.770   9.270  -3.598
  273   2HB   TRP  34          1HB       TRP  34  -6.096  10.399  -4.901
  274    HD1  TRP  34           HD1      TRP  34  -5.019   9.787  -7.120
  275    HE1  TRP  34           HE1      TRP  34  -3.091   8.267  -7.888
  276    HE3  TRP  34           HE3      TRP  34  -3.222   8.387  -2.540
  277    HZ2  TRP  34           HZ2      TRP  34  -1.066   6.709  -6.710
  278    HZ3  TRP  34           HZ3      TRP  34  -1.281   6.877  -2.453
  279    HH2  TRP  34           HH2      TRP  34  -0.227   6.056  -4.494
  280    H    ASN  35           H        ASN  35  -2.473  12.268  -3.423
  281    HA   ASN  35           HA       ASN  35  -3.314  14.363  -5.309
  282   1HB   ASN  35          2HB       ASN  35  -1.196  14.306  -3.166
  283   2HB   ASN  35          1HB       ASN  35  -1.259  15.571  -4.386
  284   1HD2  ASN  35          1HD2      ASN  35  -1.529  17.046  -2.642
  285   2HD2  ASN  35          2HD2      ASN  35  -3.092  17.271  -1.923
  286    H    LEU  36           H        LEU  36  -1.805  11.533  -5.458
  287    HA   LEU  36           HA       LEU  36   0.494  12.377  -7.041
  288   1HB   LEU  36          2HB       LEU  36  -0.414   9.628  -6.180
  289   2HB   LEU  36          1HB       LEU  36   1.055   9.966  -7.071
  290    HG   LEU  36           HG       LEU  36   0.438  10.916  -4.283
  291   1HD1  LEU  36          1HD1      LEU  36   2.368   8.831  -5.277
  292   2HD1  LEU  36          2HD1      LEU  36   0.884   8.529  -4.371
  293   3HD1  LEU  36          3HD1      LEU  36   2.222   9.389  -3.611
  294   1HD2  LEU  36          1HD2      LEU  36   2.774  11.670  -4.260
  295   2HD2  LEU  36          2HD2      LEU  36   1.813  12.528  -5.464
  296   3HD2  LEU  36          3HD2      LEU  36   2.915  11.248  -5.966
  297    H    ARG  37           H        ARG  37   0.780  11.841  -9.191
  298    HA   ARG  37           HA       ARG  37  -1.662  11.593 -10.721
  299   1HB   ARG  37          2HB       ARG  37   1.219  11.887 -11.575
  300   2HB   ARG  37          1HB       ARG  37  -0.146  11.862 -12.677
  301   1HG   ARG  37          2HG       ARG  37  -1.015  13.901 -11.640
  302   2HG   ARG  37          1HG       ARG  37   0.377  13.930 -10.552
  303   1HD   ARG  37          2HD       ARG  37   1.879  14.103 -12.452
  304   2HD   ARG  37          1HD       ARG  37   0.515  14.004 -13.561
  305    HE   ARG  37           HE       ARG  37   0.710  16.224 -11.644
  306   1HH1  ARG  37          1HH1      ARG  37   0.548  15.020 -14.916
  307   2HH1  ARG  37          2HH1      ARG  37   0.380  16.595 -15.631
  308   1HH2  ARG  37          1HH2      ARG  37   0.516  18.291 -12.559
  309   2HH2  ARG  37          2HH2      ARG  37   0.395  18.466 -14.286
  310    H    ALA  38           H        ALA  38  -1.392   9.301  -9.343
  311    HA   ALA  38           HA       ALA  38  -0.537   7.367 -11.393
  312   1HB   ALA  38          1HB       ALA  38   0.179   5.846  -9.614
  313   2HB   ALA  38          2HB       ALA  38  -0.218   7.068  -8.406
  314   3HB   ALA  38          3HB       ALA  38   1.079   7.363  -9.565
  315    HA   PRO  39           HA       PRO  39  -4.654   5.716 -10.899
  316   1HB   PRO  39          2HB       PRO  39  -4.193   3.183 -11.787
  317   2HB   PRO  39          1HB       PRO  39  -4.352   4.571 -12.867
  318   1HG   PRO  39          2HG       PRO  39  -1.878   3.215 -11.880
  319   2HG   PRO  39          1HG       PRO  39  -2.249   3.827 -13.502
  320   1HD   PRO  39          2HD       PRO  39  -0.685   5.180 -11.752
  321   2HD   PRO  39          1HD       PRO  39  -1.718   5.995 -12.942
  322    H    LEU  40           H        LEU  40  -5.756   4.566  -9.354
  323    HA   LEU  40           HA       LEU  40  -4.400   3.784  -7.016
  324   1HB   LEU  40          2HB       LEU  40  -7.201   3.694  -7.990
  325   2HB   LEU  40          1HB       LEU  40  -6.787   2.636  -6.660
  326    HG   LEU  40           HG       LEU  40  -6.007   4.605  -5.367
  327   1HD1  LEU  40          1HD1      LEU  40  -5.417   6.069  -7.213
  328   2HD1  LEU  40          2HD1      LEU  40  -6.584   6.848  -6.146
  329   3HD1  LEU  40          3HD1      LEU  40  -7.114   6.176  -7.688
  330   1HD2  LEU  40          1HD2      LEU  40  -8.259   3.779  -5.043
  331   2HD2  LEU  40          2HD2      LEU  40  -8.838   4.759  -6.391
  332   3HD2  LEU  40          3HD2      LEU  40  -8.234   5.538  -4.929
  333    HA   PRO  41           HA       PRO  41  -2.974  -0.256  -8.055
  334   1HB   PRO  41          2HB       PRO  41  -2.975  -1.278  -5.487
  335   2HB   PRO  41          1HB       PRO  41  -1.686  -0.289  -6.180
  336   1HG   PRO  41          2HG       PRO  41  -3.953   0.513  -4.404
  337   2HG   PRO  41          1HG       PRO  41  -2.260   1.042  -4.367
  338   1HD   PRO  41          2HD       PRO  41  -4.181   2.586  -5.404
  339   2HD   PRO  41          1HD       PRO  41  -2.559   2.529  -6.125
  340    H    THR  42           H        THR  42  -3.588  -2.488  -7.974
  341    HA   THR  42           HA       THR  42  -6.484  -2.706  -8.075
  342    HB   THR  42           HB       THR  42  -6.038  -4.902  -9.153
  343    HG1  THR  42           HG1      THR  42  -3.947  -5.544  -9.538
  344   1HG2  THR  42          1HG2      THR  42  -4.546  -2.555 -10.345
  345   2HG2  THR  42          2HG2      THR  42  -6.267  -2.892 -10.530
  346   3HG2  THR  42          3HG2      THR  42  -5.077  -3.987 -11.229
  347    H    GLN  43           H        GLN  43  -7.598  -4.536  -7.195
  348    HA   GLN  43           HA       GLN  43  -7.218  -4.985  -4.488
  349   1HB   GLN  43          2HB       GLN  43  -9.269  -5.471  -5.900
  350   2HB   GLN  43          1HB       GLN  43  -8.488  -6.962  -6.382
  351   1HG   GLN  43          2HG       GLN  43 -10.106  -7.298  -4.580
  352   2HG   GLN  43          1HG       GLN  43  -8.470  -7.754  -4.108
  353   1HE2  GLN  43          1HE2      GLN  43  -7.391  -6.542  -2.569
  354   2HE2  GLN  43          2HE2      GLN  43  -8.198  -5.384  -1.571
  355    H    ALA  44           H        ALA  44  -6.244  -6.959  -7.235
  356    HA   ALA  44           HA       ALA  44  -5.108  -9.110  -5.896
  357   1HB   ALA  44          1HB       ALA  44  -5.531  -9.053  -8.311
  358   2HB   ALA  44          2HB       ALA  44  -3.884  -9.564  -7.941
  359   3HB   ALA  44          3HB       ALA  44  -4.194  -7.923  -8.509
  360    H    GLU  45           H        GLU  45  -3.473  -6.136  -7.058
  361    HA   GLU  45           HA       GLU  45  -0.953  -6.855  -6.050
  362   1HB   GLU  45          2HB       GLU  45  -1.966  -4.740  -7.561
  363   2HB   GLU  45          1HB       GLU  45  -1.357  -3.980  -6.097
  364   1HG   GLU  45          2HG       GLU  45   0.761  -5.308  -6.459
  365   2HG   GLU  45          1HG       GLU  45   0.138  -5.691  -8.056
  366    H    LEU  46           H        LEU  46  -3.581  -4.907  -4.675
  367    HA   LEU  46           HA       LEU  46  -2.368  -4.047  -2.344
  368   1HB   LEU  46          2HB       LEU  46  -5.215  -4.887  -2.858
  369   2HB   LEU  46          1HB       LEU  46  -4.688  -4.103  -1.386
  370    HG   LEU  46           HG       LEU  46  -4.510  -2.902  -4.147
  371   1HD1  LEU  46          1HD1      LEU  46  -6.307  -1.427  -3.394
  372   2HD1  LEU  46          2HD1      LEU  46  -6.408  -2.320  -1.876
  373   3HD1  LEU  46          3HD1      LEU  46  -6.816  -3.115  -3.396
  374   1HD2  LEU  46          1HD2      LEU  46  -2.757  -2.109  -2.651
  375   2HD2  LEU  46          2HD2      LEU  46  -3.969  -1.706  -1.432
  376   3HD2  LEU  46          3HD2      LEU  46  -3.941  -0.842  -2.970
  377    H    GLU  47           H        GLU  47  -4.088  -7.102  -2.931
  378    HA   GLU  47           HA       GLU  47  -3.698  -8.037  -0.275
  379   1HB   GLU  47          2HB       GLU  47  -4.533  -9.475  -2.786
  380   2HB   GLU  47          1HB       GLU  47  -4.471 -10.231  -1.198
  381   1HG   GLU  47          2HG       GLU  47  -6.055  -8.504  -0.379
  382   2HG   GLU  47          1HG       GLU  47  -6.193  -7.914  -2.031
  383    H    THR  48           H        THR  48  -1.885  -8.314  -3.249
  384    HA   THR  48           HA       THR  48  -0.125 -10.360  -2.370
  385    HB   THR  48           HB       THR  48   0.221  -8.235  -4.492
  386    HG1  THR  48           HG1      THR  48  -0.709 -10.917  -4.444
  387   1HG2  THR  48          1HG2      THR  48   2.049  -9.634  -5.360
  388   2HG2  THR  48          2HG2      THR  48   1.903 -10.688  -3.952
  389   3HG2  THR  48          3HG2      THR  48   2.415  -9.011  -3.751
  390    H    TRP  49           H        TRP  49   0.061  -6.788  -2.257
  391    HA   TRP  49           HA       TRP  49   2.591  -6.614  -1.037
  392   1HB   TRP  49          2HB       TRP  49   0.225  -4.818  -0.441
  393   2HB   TRP  49          1HB       TRP  49   1.922  -4.436  -0.194
  394    HD1  TRP  49           HD1      TRP  49   2.384  -5.795  -3.354
  395    HE1  TRP  49           HE1      TRP  49   2.003  -4.123  -5.284
  396    HE3  TRP  49           HE3      TRP  49  -0.224  -2.214  -0.816
  397    HZ2  TRP  49           HZ2      TRP  49   0.769  -1.603  -5.657
  398    HZ3  TRP  49           HZ3      TRP  49  -0.959  -0.201  -2.020
  399    HH2  TRP  49           HH2      TRP  49  -0.471   0.097  -4.392
  400    H    TRP  50           H        TRP  50  -0.651  -6.904   0.327
  401    HA   TRP  50           HA       TRP  50  -0.007  -6.885   3.032
  402   1HB   TRP  50          2HB       TRP  50  -2.298  -6.715   2.126
  403   2HB   TRP  50          1HB       TRP  50  -2.229  -8.407   1.649
  404    HD1  TRP  50           HD1      TRP  50  -2.816 -10.187   3.450
  405    HE1  TRP  50           HE1      TRP  50  -3.591 -10.069   5.901
  406    HE3  TRP  50           HE3      TRP  50  -1.931  -5.228   4.328
  407    HZ2  TRP  50           HZ2      TRP  50  -3.788  -8.121   7.938
  408    HZ3  TRP  50           HZ3      TRP  50  -2.435  -4.321   6.558
  409    HH2  TRP  50           HH2      TRP  50  -3.344  -5.737   8.320
  410    H    GLU  51           H        GLU  51  -0.344  -9.652   0.819
  411    HA   GLU  51           HA       GLU  51   0.299 -11.697   2.579
  412   1HB   GLU  51          2HB       GLU  51   0.335 -11.294  -0.340
  413   2HB   GLU  51          1HB       GLU  51   1.350 -12.590   0.255
  414   1HG   GLU  51          2HG       GLU  51  -0.623 -13.527   1.420
  415   2HG   GLU  51          1HG       GLU  51  -1.606 -12.279   0.657
  416    H    GLU  52           H        GLU  52   2.472  -9.909   0.392
  417    HA   GLU  52           HA       GLU  52   4.793 -11.274   1.240
  418   1HB   GLU  52          2HB       GLU  52   4.356  -8.703  -0.248
  419   2HB   GLU  52          1HB       GLU  52   5.971  -9.277   0.147
  420   1HG   GLU  52          2HG       GLU  52   5.423 -11.405  -1.019
  421   2HG   GLU  52          1HG       GLU  52   3.906 -10.674  -1.532
  422    H    LEU  53           H        LEU  53   3.180  -8.400   2.425
  423    HA   LEU  53           HA       LEU  53   5.224  -7.518   4.164
  424   1HB   LEU  53          2HB       LEU  53   3.320  -6.114   3.591
  425   2HB   LEU  53          1HB       LEU  53   2.222  -7.248   4.357
  426    HG   LEU  53           HG       LEU  53   3.315  -6.754   6.539
  427   1HD1  LEU  53          1HD1      LEU  53   5.471  -5.989   5.715
  428   2HD1  LEU  53          2HD1      LEU  53   4.710  -4.758   6.721
  429   3HD1  LEU  53          3HD1      LEU  53   4.703  -4.589   4.965
  430   1HD2  LEU  53          1HD2      LEU  53   2.160  -4.375   5.088
  431   2HD2  LEU  53          2HD2      LEU  53   2.239  -4.587   6.838
  432   3HD2  LEU  53          3HD2      LEU  53   1.235  -5.660   5.864
  433    H    GLN  54           H        GLN  54   2.615  -9.857   4.507
  434    HA   GLN  54           HA       GLN  54   3.168 -10.387   7.270
  435   1HB   GLN  54          2HB       GLN  54   1.433 -11.749   5.220
  436   2HB   GLN  54          1HB       GLN  54   1.512 -12.230   6.897
  437   1HG   GLN  54          2HG       GLN  54   0.632  -9.543   5.886
  438   2HG   GLN  54          1HG       GLN  54  -0.432 -10.835   6.436
  439   1HE2  GLN  54          1HE2      GLN  54   1.809  -8.369   7.389
  440   2HE2  GLN  54          2HE2      GLN  54   1.473  -8.424   9.086
  441    H    LYS  55           H        LYS  55   4.043 -11.722   4.178
  442    HA   LYS  55           HA       LYS  55   5.108 -14.164   5.229
  443   1HB   LYS  55          2HB       LYS  55   4.176 -13.533   2.832
  444   2HB   LYS  55          1HB       LYS  55   5.869 -13.142   2.546
  445   1HG   LYS  55          2HG       LYS  55   6.542 -15.369   3.026
  446   2HG   LYS  55          1HG       LYS  55   4.925 -15.797   3.591
  447   1HD   LYS  55          2HD       LYS  55   4.075 -15.284   1.303
  448   2HD   LYS  55          1HD       LYS  55   5.750 -15.083   0.787
  449   1HE   LYS  55          2HE       LYS  55   6.249 -17.365   1.250
  450   2HE   LYS  55          1HE       LYS  55   4.710 -17.594   2.078
  451   1HZ   LYS  55          1HZ       LYS  55   5.082 -17.082  -0.823
  452   2HZ   LYS  55          2HZ       LYS  55   3.581 -17.209  -0.045
  453   3HZ   LYS  55          3HZ       LYS  55   4.615 -18.549  -0.109
  454    H    ASN  56           H        ASN  56   6.206 -11.011   4.881
  455    HA   ASN  56           HA       ASN  56   8.971 -11.834   5.455
  456   1HB   ASN  56          2HB       ASN  56   8.795 -10.305   3.535
  457   2HB   ASN  56          1HB       ASN  56   7.904  -9.153   4.514
  458   1HD2  ASN  56          1HD2      ASN  56   8.978  -7.795   5.812
  459   2HD2  ASN  56          2HD2      ASN  56  10.699  -7.696   5.884
  460    HA   PRO  57           HA       PRO  57   7.089 -11.004   9.493
  461   1HB   PRO  57          2HB       PRO  57   9.686 -12.098  10.413
  462   2HB   PRO  57          1HB       PRO  57   8.042 -12.582  10.842
  463   1HG   PRO  57          2HG       PRO  57   9.531 -14.096   9.230
  464   2HG   PRO  57          1HG       PRO  57   7.790 -13.898   8.947
  465   1HD   PRO  57          2HD       PRO  57  10.102 -12.601   7.556
  466   2HD   PRO  57          1HD       PRO  57   8.586 -13.231   6.877
  467    HA   PRO  58           HA       PRO  58   9.244  -7.112  10.237
  468   1HB   PRO  58          2HB       PRO  58   7.223  -6.919  12.376
  469   2HB   PRO  58          1HB       PRO  58   7.559  -5.805  11.048
  470   1HG   PRO  58          2HG       PRO  58   5.346  -7.323  11.080
  471   2HG   PRO  58          1HG       PRO  58   6.196  -6.939   9.571
  472   1HD   PRO  58          2HD       PRO  58   6.240  -9.465  11.183
  473   2HD   PRO  58          1HD       PRO  58   6.203  -9.248   9.419
  474    H    TYR  59           H        TYR  59  10.696  -6.502  11.830
  475    HA   TYR  59           HA       TYR  59  11.280  -8.645  13.747
  476   1HB   TYR  59          2HB       TYR  59  12.967  -7.797  11.971
  477   2HB   TYR  59          1HB       TYR  59  13.153  -6.401  13.023
  478    HD1  TYR  59           HD1      TYR  59  14.235  -6.616  15.196
  479    HD2  TYR  59           HD2      TYR  59  13.801  -9.968  12.616
  480    HE1  TYR  59           HE1      TYR  59  15.887  -7.852  16.533
  481    HE2  TYR  59           HE2      TYR  59  15.445 -11.219  13.948
  482    HH   TYR  59           HH       TYR  59  16.409 -10.327  16.997
  483    H    GLU  60           H        GLU  60  11.693  -8.201  15.913
  484    HA   GLU  60           HA       GLU  60  10.284  -6.016  17.054
  485   1HB   GLU  60          2HB       GLU  60  12.200  -8.007  18.284
  486   2HB   GLU  60          1HB       GLU  60  11.272  -6.835  19.201
  487   1HG   GLU  60          2HG       GLU  60  10.108  -8.865  19.379
  488   2HG   GLU  60          1HG       GLU  60   9.197  -7.889  18.229
  Start of MODEL   19
    1   1H    MET   1          1H        MET   1  -9.876  -4.549   5.907
    2   2H    MET   1          2H        MET   1  -8.890  -4.864   7.248
    3   3H    MET   1          3H        MET   1  -9.403  -6.140   6.252
    4    HA   MET   1           HA       MET   1  -7.123  -5.629   5.779
    5   1HB   MET   1          2HB       MET   1  -8.843  -6.212   3.946
    6   2HB   MET   1          1HB       MET   1  -8.798  -4.509   3.528
    7   1HG   MET   1          2HG       MET   1  -6.377  -6.291   3.548
    8   2HG   MET   1          1HG       MET   1  -7.369  -5.992   2.125
    9   1HE   MET   1          1HE       MET   1  -4.324  -5.543   1.974
   10   2HE   MET   1          2HE       MET   1  -4.191  -3.942   1.245
   11   3HE   MET   1          3HE       MET   1  -5.395  -5.084   0.650
   12    H    ILE   2           H        ILE   2  -5.641  -4.135   6.223
   13    HA   ILE   2           HA       ILE   2  -6.456  -1.325   6.225
   14    HB   ILE   2           HB       ILE   2  -3.946  -2.535   7.382
   15   1HG1  ILE   2          2HG1      ILE   2  -5.169  -1.827   9.589
   16   2HG1  ILE   2          1HG1      ILE   2  -6.625  -1.926   8.607
   17   1HG2  ILE   2          1HG2      ILE   2  -3.671  -0.206   6.769
   18   2HG2  ILE   2          2HG2      ILE   2  -3.693  -0.386   8.524
   19   3HG2  ILE   2          3HG2      ILE   2  -5.119   0.222   7.684
   20   1HD1  ILE   2          1HD1      ILE   2  -6.252  -3.971   9.856
   21   2HD1  ILE   2          2HD1      ILE   2  -4.674  -4.166   9.093
   22   3HD1  ILE   2          3HD1      ILE   2  -6.143  -4.263   8.122
   23    H    LEU   3           H        LEU   3  -6.070  -0.252   4.449
   24    HA   LEU   3           HA       LEU   3  -4.288  -1.027   2.423
   25   1HB   LEU   3          2HB       LEU   3  -6.106   1.189   3.012
   26   2HB   LEU   3          1HB       LEU   3  -4.748   1.631   2.017
   27    HG   LEU   3           HG       LEU   3  -6.614   1.082   0.606
   28   1HD1  LEU   3          1HD1      LEU   3  -5.642  -0.682  -0.769
   29   2HD1  LEU   3          2HD1      LEU   3  -4.576  -1.138   0.561
   30   3HD1  LEU   3          3HD1      LEU   3  -4.407   0.442  -0.205
   31   1HD2  LEU   3          1HD2      LEU   3  -7.616  -1.159   0.613
   32   2HD2  LEU   3          2HD2      LEU   3  -7.873  -0.315   2.140
   33   3HD2  LEU   3          3HD2      LEU   3  -6.648  -1.579   2.026
   34    H    TYR   4           H        TYR   4  -4.029   1.114   5.154
   35    HA   TYR   4           HA       TYR   4  -1.826   2.652   4.537
   36   1HB   TYR   4          2HB       TYR   4  -3.203   2.939   6.561
   37   2HB   TYR   4          1HB       TYR   4  -2.552   1.446   7.220
   38    HD1  TYR   4           HD1      TYR   4  -1.823   4.964   6.451
   39    HD2  TYR   4           HD2      TYR   4  -0.353   1.381   8.206
   40    HE1  TYR   4           HE1      TYR   4  -0.024   6.237   7.540
   41    HE2  TYR   4           HE2      TYR   4   1.451   2.644   9.294
   42    HH   TYR   4           HH       TYR   4   1.436   5.971   9.587
   43    H    ASP   5           H        ASP   5  -1.818  -0.494   6.204
   44    HA   ASP   5           HA       ASP   5   0.970  -0.729   6.409
   45   1HB   ASP   5          2HB       ASP   5  -1.307  -2.669   6.548
   46   2HB   ASP   5          1HB       ASP   5   0.348  -3.261   6.562
   47    H    ALA   6           H        ALA   6  -1.290  -1.959   3.988
   48    HA   ALA   6           HA       ALA   6   0.533  -3.401   2.437
   49   1HB   ALA   6          1HB       ALA   6  -1.957  -1.969   1.526
   50   2HB   ALA   6          2HB       ALA   6  -1.879  -3.604   2.182
   51   3HB   ALA   6          3HB       ALA   6  -1.106  -3.236   0.639
   52    H    ILE   7           H        ILE   7  -0.582  -0.026   2.036
   53    HA   ILE   7           HA       ILE   7   1.015   0.495  -0.240
   54    HB   ILE   7           HB       ILE   7  -0.042   2.489   1.777
   55   1HG1  ILE   7          2HG1      ILE   7  -1.267   1.623  -0.850
   56   2HG1  ILE   7          1HG1      ILE   7  -1.779   1.020   0.723
   57   1HG2  ILE   7          1HG2      ILE   7   1.712   3.439   0.388
   58   2HG2  ILE   7          2HG2      ILE   7   0.145   4.108  -0.069
   59   3HG2  ILE   7          3HG2      ILE   7   0.897   2.864  -1.066
   60   1HD1  ILE   7          1HD1      ILE   7  -1.901   3.873  -0.213
   61   2HD1  ILE   7          2HD1      ILE   7  -2.382   3.298   1.381
   62   3HD1  ILE   7          3HD1      ILE   7  -3.262   2.764  -0.051
   63    H    MET   8           H        MET   8   1.556   0.998   3.224
   64    HA   MET   8           HA       MET   8   4.032   2.361   2.930
   65   1HB   MET   8          2HB       MET   8   2.505   1.183   5.179
   66   2HB   MET   8          1HB       MET   8   4.229   1.398   5.429
   67   1HG   MET   8          2HG       MET   8   2.971   3.284   6.288
   68   2HG   MET   8          1HG       MET   8   4.017   3.771   4.964
   69   1HE   MET   8          1HE       MET   8   2.923   3.692   2.344
   70   2HE   MET   8          2HE       MET   8   3.216   5.266   3.085
   71   3HE   MET   8          3HE       MET   8   1.708   4.968   2.223
   72    H    TYR   9           H        TYR   9   3.185  -0.922   2.630
   73    HA   TYR   9           HA       TYR   9   5.822  -1.945   3.204
   74   1HB   TYR   9          2HB       TYR   9   3.761  -3.333   3.490
   75   2HB   TYR   9          1HB       TYR   9   3.533  -3.292   1.747
   76    HD1  TYR   9           HD1      TYR   9   5.751  -4.501   4.442
   77    HD2  TYR   9           HD2      TYR   9   4.737  -4.771   0.323
   78    HE1  TYR   9           HE1      TYR   9   7.168  -6.497   4.229
   79    HE2  TYR   9           HE2      TYR   9   6.154  -6.769   0.096
   80    HH   TYR   9           HH       TYR   9   7.293  -8.517   2.708
   81    H    LYS  10           H        LYS  10   3.914  -1.099   0.375
   82    HA   LYS  10           HA       LYS  10   5.905  -1.925  -1.519
   83   1HB   LYS  10          2HB       LYS  10   3.512  -1.910  -2.086
   84   2HB   LYS  10          1HB       LYS  10   3.466  -0.172  -1.853
   85   1HG   LYS  10          2HG       LYS  10   3.542  -0.503  -4.169
   86   2HG   LYS  10          1HG       LYS  10   5.166   0.004  -3.706
   87   1HD   LYS  10          2HD       LYS  10   5.908  -2.314  -3.745
   88   2HD   LYS  10          1HD       LYS  10   4.282  -2.842  -4.174
   89   1HE   LYS  10          2HE       LYS  10   6.089  -1.078  -5.826
   90   2HE   LYS  10          1HE       LYS  10   5.704  -2.767  -6.146
   91   1HZ   LYS  10          1HZ       LYS  10   4.371  -1.379  -7.551
   92   2HZ   LYS  10          2HZ       LYS  10   3.815  -0.474  -6.235
   93   3HZ   LYS  10          3HZ       LYS  10   3.351  -2.095  -6.405
   94    H    TYR  11           H        TYR  11   4.706   1.226  -0.372
   95    HA   TYR  11           HA       TYR  11   7.168   2.460  -1.423
   96   1HB   TYR  11          2HB       TYR  11   4.509   3.856  -1.060
   97   2HB   TYR  11          1HB       TYR  11   5.940   4.481  -1.870
   98    HD1  TYR  11           HD1      TYR  11   2.808   3.014  -2.356
   99    HD2  TYR  11           HD2      TYR  11   6.765   2.989  -3.912
  100    HE1  TYR  11           HE1      TYR  11   1.957   2.126  -4.483
  101    HE2  TYR  11           HE2      TYR  11   5.926   2.094  -6.043
  102    HH   TYR  11           HH       TYR  11   2.734   2.116  -6.923
  103    HA   PRO  12           HA       PRO  12   7.550   2.817   3.088
  104   1HB   PRO  12          2HB       PRO  12  10.286   3.646   2.357
  105   2HB   PRO  12          1HB       PRO  12   9.751   2.339   3.417
  106   1HG   PRO  12          2HG       PRO  12  10.802   1.831   1.014
  107   2HG   PRO  12          1HG       PRO  12   9.477   0.852   1.671
  108   1HD   PRO  12          2HD       PRO  12   9.380   3.042  -0.370
  109   2HD   PRO  12          1HD       PRO  12   8.527   1.483  -0.348
  110    H    ASN  13           H        ASN  13   8.526   5.182   0.663
  111    HA   ASN  13           HA       ASN  13   8.514   7.278   2.715
  112   1HB   ASN  13          2HB       ASN  13   9.872   6.974   0.096
  113   2HB   ASN  13          1HB       ASN  13   9.441   8.603   0.595
  114   1HD2  ASN  13          1HD2      ASN  13  10.364   5.945   2.689
  115   2HD2  ASN  13          2HD2      ASN  13  11.844   6.648   3.235
  116    H    ALA  14           H        ALA  14   6.155   5.995   1.274
  117    HA   ALA  14           HA       ALA  14   5.016   8.228  -0.164
  118   1HB   ALA  14          1HB       ALA  14   3.752   5.633   0.704
  119   2HB   ALA  14          2HB       ALA  14   4.495   5.948  -0.863
  120   3HB   ALA  14          3HB       ALA  14   3.037   6.819  -0.388
  121    H    VAL  15           H        VAL  15   4.051   9.887   0.795
  122    HA   VAL  15           HA       VAL  15   3.496   9.781   3.633
  123    HB   VAL  15           HB       VAL  15   3.154  12.086   1.698
  124   1HG1  VAL  15          1HG1      VAL  15   1.840  12.336   3.752
  125   2HG1  VAL  15          2HG1      VAL  15   3.160  13.502   3.685
  126   3HG1  VAL  15          3HG1      VAL  15   3.296  12.074   4.713
  127   1HG2  VAL  15          1HG2      VAL  15   5.466  11.438   3.526
  128   2HG2  VAL  15          2HG2      VAL  15   5.298  12.898   2.553
  129   3HG2  VAL  15          3HG2      VAL  15   5.474  11.331   1.767
  130    H    SER  16           H        SER  16   1.681   8.382   3.746
  131    HA   SER  16           HA       SER  16  -0.693   9.117   2.252
  132   1HB   SER  16          2HB       SER  16  -1.676   7.158   3.600
  133   2HB   SER  16          1HB       SER  16  -0.380   6.770   2.468
  134    HG   SER  16           HG       SER  16   0.364   5.827   4.236
  135    H    ARG  17           H        ARG  17   0.305  10.992   3.962
  136    HA   ARG  17           HA       ARG  17  -1.627  11.221   6.090
  137   1HB   ARG  17          2HB       ARG  17   0.774  12.931   5.466
  138   2HB   ARG  17          1HB       ARG  17  -0.302  13.160   6.841
  139   1HG   ARG  17          2HG       ARG  17   0.325  11.006   7.731
  140   2HG   ARG  17          1HG       ARG  17   1.338  10.692   6.324
  141   1HD   ARG  17          2HD       ARG  17   2.691  12.689   6.925
  142   2HD   ARG  17          1HD       ARG  17   1.731  12.836   8.400
  143    HE   ARG  17           HE       ARG  17   2.597  10.303   8.547
  144   1HH1  ARG  17          1HH1      ARG  17   4.295  13.306   7.918
  145   2HH1  ARG  17          2HH1      ARG  17   5.791  12.733   8.591
  146   1HH2  ARG  17          1HH2      ARG  17   4.570   9.542   9.365
  147   2HH2  ARG  17          2HH2      ARG  17   5.957  10.593   9.397
  148    H    LYS  18           H        LYS  18  -0.309  13.138   3.453
  149    HA   LYS  18           HA       LYS  18  -2.769  14.743   3.423
  150   1HB   LYS  18          2HB       LYS  18  -0.964  15.866   4.679
  151   2HB   LYS  18          1HB       LYS  18   0.072  15.758   3.267
  152   1HG   LYS  18          2HG       LYS  18  -1.557  17.164   2.033
  153   2HG   LYS  18          1HG       LYS  18  -2.462  17.351   3.538
  154   1HD   LYS  18          2HD       LYS  18  -0.414  18.285   4.592
  155   2HD   LYS  18          1HD       LYS  18   0.381  18.213   3.018
  156   1HE   LYS  18          2HE       LYS  18  -0.470  20.452   3.446
  157   2HE   LYS  18          1HE       LYS  18  -1.312  19.708   2.089
  158   1HZ   LYS  18          1HZ       LYS  18  -2.330  19.959   4.870
  159   2HZ   LYS  18          2HZ       LYS  18  -3.138  19.148   3.617
  160   3HZ   LYS  18          3HZ       LYS  18  -2.875  20.818   3.514
  161    H    ASP  19           H        ASP  19   0.178  13.811   1.642
  162    HA   ASP  19           HA       ASP  19  -0.634  14.951  -0.827
  163   1HB   ASP  19          2HB       ASP  19   1.724  14.107  -0.103
  164   2HB   ASP  19          1HB       ASP  19   1.156  12.538  -0.672
  165    H    PHE  20           H        PHE  20  -1.036  11.765   0.627
  166    HA   PHE  20           HA       PHE  20  -3.520  11.680  -0.848
  167   1HB   PHE  20          2HB       PHE  20  -3.340   9.324  -1.451
  168   2HB   PHE  20          1HB       PHE  20  -2.066  10.255  -2.213
  169    HD1  PHE  20           HD1      PHE  20   0.239  10.222  -0.961
  170    HD2  PHE  20           HD2      PHE  20  -2.863   7.362  -0.430
  171    HE1  PHE  20           HE1      PHE  20   1.889   8.582  -0.178
  172    HE2  PHE  20           HE2      PHE  20  -1.218   5.716   0.369
  173    HZ   PHE  20           HZ       PHE  20   1.164   6.327   0.489
  174    H    GLU  21           H        GLU  21  -5.176  10.956   0.358
  175    HA   GLU  21           HA       GLU  21  -4.487  10.704   3.193
  176   1HB   GLU  21          2HB       GLU  21  -6.948  11.781   1.822
  177   2HB   GLU  21          1HB       GLU  21  -6.782  11.609   3.560
  178   1HG   GLU  21          2HG       GLU  21  -4.932  13.169   3.567
  179   2HG   GLU  21          1HG       GLU  21  -5.023  13.301   1.810
  180    H    LEU  22           H        LEU  22  -5.363   9.171   4.462
  181    HA   LEU  22           HA       LEU  22  -7.031   7.130   3.139
  182   1HB   LEU  22          2HB       LEU  22  -5.296   6.760   5.576
  183   2HB   LEU  22          1HB       LEU  22  -6.123   5.511   4.670
  184    HG   LEU  22           HG       LEU  22  -3.791   7.156   3.676
  185   1HD1  LEU  22          1HD1      LEU  22  -3.990   4.267   4.506
  186   2HD1  LEU  22          2HD1      LEU  22  -3.134   5.547   5.365
  187   3HD1  LEU  22          3HD1      LEU  22  -2.578   5.027   3.773
  188   1HD2  LEU  22          1HD2      LEU  22  -3.805   5.652   1.757
  189   2HD2  LEU  22          2HD2      LEU  22  -5.317   6.552   1.868
  190   3HD2  LEU  22          3HD2      LEU  22  -5.256   4.864   2.375
  191    H    ARG  23           H        ARG  23  -8.730   6.218   4.368
  192    HA   ARG  23           HA       ARG  23  -9.376   7.459   6.925
  193   1HB   ARG  23          2HB       ARG  23 -11.498   8.247   6.345
  194   2HB   ARG  23          1HB       ARG  23 -10.495   8.748   4.991
  195   1HG   ARG  23          2HG       ARG  23 -11.273   6.774   3.741
  196   2HG   ARG  23          1HG       ARG  23 -12.339   6.373   5.078
  197   1HD   ARG  23          2HD       ARG  23 -12.423   8.977   3.559
  198   2HD   ARG  23          1HD       ARG  23 -13.470   7.597   3.226
  199    HE   ARG  23           HE       ARG  23 -14.324   7.871   5.531
  200   1HH1  ARG  23          1HH1      ARG  23 -12.744  10.594   3.981
  201   2HH1  ARG  23          2HH1      ARG  23 -13.580  11.772   4.941
  202   1HH2  ARG  23          1HH2      ARG  23 -15.411   9.422   6.781
  203   2HH2  ARG  23          2HH2      ARG  23 -15.090  11.116   6.530
  204    H    ASN  24           H        ASN  24 -11.507   6.422   7.697
  205    HA   ASN  24           HA       ASN  24 -11.422   3.541   7.129
  206   1HB   ASN  24          2HB       ASN  24 -10.122   4.080   9.148
  207   2HB   ASN  24          1HB       ASN  24 -11.527   4.869   9.845
  208   1HD2  ASN  24          1HD2      ASN  24 -13.039   3.677  10.867
  209   2HD2  ASN  24          2HD2      ASN  24 -12.961   1.961  11.054
  210    H    ASP  25           H        ASP  25 -13.391   2.914   6.446
  211    HA   ASP  25           HA       ASP  25 -15.748   4.445   7.029
  212   1HB   ASP  25          2HB       ASP  25 -16.951   2.723   5.774
  213   2HB   ASP  25          1HB       ASP  25 -15.526   3.245   4.890
  214    H    GLY  26           H        GLY  26 -14.119   1.723   8.373
  215   1HA   GLY  26          2HA       GLY  26 -14.916   1.571  10.841
  216   2HA   GLY  26          1HA       GLY  26 -16.415   1.066  10.072
  217    H    ASN  27           H        ASN  27 -15.341  -0.433   7.963
  218    HA   ASN  27           HA       ASN  27 -14.510  -2.785   9.504
  219   1HB   ASN  27          2HB       ASN  27 -16.599  -2.842   8.082
  220   2HB   ASN  27          1HB       ASN  27 -15.558  -2.705   6.673
  221   1HD2  ASN  27          1HD2      ASN  27 -14.751  -4.523   9.553
  222   2HD2  ASN  27          2HD2      ASN  27 -14.818  -6.089   8.813
  223    H    GLY  28           H        GLY  28 -13.097  -0.417   7.786
  224   1HA   GLY  28          2HA       GLY  28 -10.595  -1.651   7.658
  225   2HA   GLY  28          1HA       GLY  28 -11.324  -1.757   6.061
  226    H    SER  29           H        SER  29  -8.958  -0.337   6.756
  227    HA   SER  29           HA       SER  29  -9.799   2.457   6.413
  228   1HB   SER  29          2HB       SER  29  -7.051   1.393   7.112
  229   2HB   SER  29          1HB       SER  29  -7.573   3.077   7.150
  230    HG   SER  29           HG       SER  29  -9.266   1.663   8.635
  231    H    TYR  30           H        TYR  30  -9.615   3.358   4.473
  232    HA   TYR  30           HA       TYR  30  -7.923   2.061   2.447
  233   1HB   TYR  30          2HB       TYR  30  -9.762   2.337   0.802
  234   2HB   TYR  30          1HB       TYR  30 -10.181   1.229   2.101
  235    HD1  TYR  30           HD1      TYR  30 -11.101   4.211   0.340
  236    HD2  TYR  30           HD2      TYR  30 -11.647   2.104   3.996
  237    HE1  TYR  30           HE1      TYR  30 -13.129   5.530   0.792
  238    HE2  TYR  30           HE2      TYR  30 -13.671   3.415   4.456
  239    HH   TYR  30           HH       TYR  30 -15.202   5.347   2.118
  240    H    ILE  31           H        ILE  31  -8.195   3.549   0.326
  241    HA   ILE  31           HA       ILE  31  -7.049   6.096   1.126
  242    HB   ILE  31           HB       ILE  31  -7.439   5.118  -1.701
  243   1HG1  ILE  31          2HG1      ILE  31  -5.069   4.514   0.081
  244   2HG1  ILE  31          1HG1      ILE  31  -6.326   3.348  -0.324
  245   1HG2  ILE  31          1HG2      ILE  31  -6.750   7.433  -1.450
  246   2HG2  ILE  31          2HG2      ILE  31  -5.434   6.472  -2.125
  247   3HG2  ILE  31          3HG2      ILE  31  -5.400   6.938  -0.425
  248   1HD1  ILE  31          1HD1      ILE  31  -4.448   4.686  -2.258
  249   2HD1  ILE  31          2HD1      ILE  31  -5.724   3.546  -2.688
  250   3HD1  ILE  31          3HD1      ILE  31  -4.365   3.016  -1.698
  251    H    GLU  32           H        GLU  32  -8.092   8.051   0.967
  252    HA   GLU  32           HA       GLU  32 -10.649   8.044  -0.496
  253   1HB   GLU  32          2HB       GLU  32 -11.405   9.874   0.905
  254   2HB   GLU  32          1HB       GLU  32 -10.924   8.506   1.893
  255   1HG   GLU  32          2HG       GLU  32  -8.912   9.592   2.550
  256   2HG   GLU  32          1HG       GLU  32  -9.158  10.881   1.372
  257    H    LYS  33           H        LYS  33  -7.620   9.791  -0.046
  258    HA   LYS  33           HA       LYS  33  -8.222  11.213  -2.555
  259   1HB   LYS  33          2HB       LYS  33  -6.923  12.281  -0.070
  260   2HB   LYS  33          1HB       LYS  33  -6.507  12.953  -1.637
  261   1HG   LYS  33          2HG       LYS  33  -8.168  14.383  -1.089
  262   2HG   LYS  33          1HG       LYS  33  -9.155  13.128  -1.818
  263   1HD   LYS  33          2HD       LYS  33  -9.669  12.220   0.332
  264   2HD   LYS  33          1HD       LYS  33  -8.559  13.341   1.110
  265   1HE   LYS  33          2HE       LYS  33  -9.953  15.218   0.263
  266   2HE   LYS  33          1HE       LYS  33 -11.103  14.030  -0.351
  267   1HZ   LYS  33          1HZ       LYS  33 -11.335  13.211   1.956
  268   2HZ   LYS  33          2HZ       LYS  33 -11.853  14.815   1.759
  269   3HZ   LYS  33          3HZ       LYS  33 -10.358  14.494   2.485
  270    H    TRP  34           H        TRP  34  -6.504  11.483  -3.995
  271    HA   TRP  34           HA       TRP  34  -3.955  10.214  -3.344
  272   1HB   TRP  34          2HB       TRP  34  -5.394   8.453  -4.340
  273   2HB   TRP  34          1HB       TRP  34  -5.622   9.464  -5.758
  274    HD1  TRP  34           HD1      TRP  34  -3.464   9.764  -7.402
  275    HE1  TRP  34           HE1      TRP  34  -1.454   8.204  -7.813
  276    HE3  TRP  34           HE3      TRP  34  -3.834   6.843  -3.212
  277    HZ2  TRP  34           HZ2      TRP  34  -0.198   6.029  -6.527
  278    HZ3  TRP  34           HZ3      TRP  34  -2.190   5.041  -2.884
  279    HH2  TRP  34           HH2      TRP  34  -0.411   4.644  -4.507
  280    H    ASN  35           H        ASN  35  -2.555  11.826  -3.763
  281    HA   ASN  35           HA       ASN  35  -2.959  13.404  -6.218
  282   1HB   ASN  35          2HB       ASN  35  -1.892  14.307  -3.535
  283   2HB   ASN  35          1HB       ASN  35  -1.839  15.287  -4.990
  284   1HD2  ASN  35          1HD2      ASN  35  -3.198  15.665  -2.401
  285   2HD2  ASN  35          2HD2      ASN  35  -4.868  15.923  -2.785
  286    H    LEU  36           H        LEU  36  -1.266  10.968  -5.296
  287    HA   LEU  36           HA       LEU  36   1.441  11.763  -5.417
  288   1HB   LEU  36          2HB       LEU  36   0.082   9.119  -5.872
  289   2HB   LEU  36          1HB       LEU  36   1.810   9.311  -6.045
  290    HG   LEU  36           HG       LEU  36   0.242   9.790  -3.521
  291   1HD1  LEU  36          1HD1      LEU  36   2.150   7.584  -4.282
  292   2HD1  LEU  36          2HD1      LEU  36   0.403   7.428  -4.097
  293   3HD1  LEU  36          3HD1      LEU  36   1.412   7.805  -2.696
  294   1HD2  LEU  36          1HD2      LEU  36   2.184  11.271  -3.702
  295   2HD2  LEU  36          2HD2      LEU  36   3.218   9.872  -4.007
  296   3HD2  LEU  36          3HD2      LEU  36   2.411  10.051  -2.448
  297    H    ARG  37           H        ARG  37   2.955  11.462  -7.084
  298    HA   ARG  37           HA       ARG  37   1.942  12.118  -9.706
  299   1HB   ARG  37          2HB       ARG  37   4.757  11.729  -8.672
  300   2HB   ARG  37          1HB       ARG  37   4.359  12.288 -10.292
  301   1HG   ARG  37          2HG       ARG  37   3.361  14.283  -9.425
  302   2HG   ARG  37          1HG       ARG  37   3.536  13.703  -7.769
  303   1HD   ARG  37          2HD       ARG  37   5.944  13.780  -7.956
  304   2HD   ARG  37          1HD       ARG  37   5.822  14.254  -9.650
  305    HE   ARG  37           HE       ARG  37   4.684  16.317  -8.789
  306   1HH1  ARG  37          1HH1      ARG  37   6.911  14.520  -6.760
  307   2HH1  ARG  37          2HH1      ARG  37   7.378  15.913  -5.833
  308   1HH2  ARG  37          1HH2      ARG  37   5.330  18.156  -7.573
  309   2HH2  ARG  37          2HH2      ARG  37   6.493  17.964  -6.287
  310    H    ALA  38           H        ALA  38   1.061   9.663  -8.968
  311    HA   ALA  38           HA       ALA  38   2.229   7.916 -10.955
  312   1HB   ALA  38          1HB       ALA  38   2.123   7.061  -8.054
  313   2HB   ALA  38          2HB       ALA  38   3.589   7.397  -8.977
  314   3HB   ALA  38          3HB       ALA  38   2.560   6.035  -9.422
  315    HA   PRO  39           HA       PRO  39  -2.035   6.762 -11.257
  316   1HB   PRO  39          2HB       PRO  39  -1.880   4.251 -12.257
  317   2HB   PRO  39          1HB       PRO  39  -1.494   5.684 -13.216
  318   1HG   PRO  39          2HG       PRO  39   0.351   3.788 -11.822
  319   2HG   PRO  39          1HG       PRO  39   0.496   4.511 -13.434
  320   1HD   PRO  39          2HD       PRO  39   1.844   5.447 -11.268
  321   2HD   PRO  39          1HD       PRO  39   1.333   6.488 -12.610
  322    H    LEU  40           H        LEU  40  -3.625   5.053 -10.615
  323    HA   LEU  40           HA       LEU  40  -3.183   4.298  -7.873
  324   1HB   LEU  40          2HB       LEU  40  -5.476   4.238  -9.783
  325   2HB   LEU  40          1HB       LEU  40  -5.548   3.228  -8.359
  326    HG   LEU  40           HG       LEU  40  -6.731   5.321  -8.001
  327   1HD1  LEU  40          1HD1      LEU  40  -5.666   4.267  -6.085
  328   2HD1  LEU  40          2HD1      LEU  40  -5.612   6.025  -5.937
  329   3HD1  LEU  40          3HD1      LEU  40  -4.169   5.137  -6.423
  330   1HD2  LEU  40          1HD2      LEU  40  -5.560   7.453  -7.953
  331   2HD2  LEU  40          2HD2      LEU  40  -5.452   6.722  -9.555
  332   3HD2  LEU  40          3HD2      LEU  40  -4.070   6.659  -8.462
  333    HA   PRO  41           HA       PRO  41  -1.881   0.123  -8.778
  334   1HB   PRO  41          2HB       PRO  41  -2.143  -0.890  -6.278
  335   2HB   PRO  41          1HB       PRO  41  -0.811   0.180  -6.734
  336   1HG   PRO  41          2HG       PRO  41  -3.353   0.830  -5.292
  337   2HG   PRO  41          1HG       PRO  41  -1.701   1.372  -4.946
  338   1HD   PRO  41          2HD       PRO  41  -3.498   2.917  -6.255
  339   2HD   PRO  41          1HD       PRO  41  -1.755   2.993  -6.576
  340    H    THR  42           H        THR  42  -2.759  -2.143  -8.278
  341    HA   THR  42           HA       THR  42  -5.635  -2.048  -8.817
  342    HB   THR  42           HB       THR  42  -5.310  -4.417  -9.604
  343    HG1  THR  42           HG1      THR  42  -2.973  -4.823 -10.119
  344   1HG2  THR  42          1HG2      THR  42  -3.646  -2.299 -10.969
  345   2HG2  THR  42          2HG2      THR  42  -5.381  -2.540 -11.169
  346   3HG2  THR  42          3HG2      THR  42  -4.247  -3.777 -11.717
  347    H    GLN  43           H        GLN  43  -6.976  -3.791  -7.944
  348    HA   GLN  43           HA       GLN  43  -6.907  -3.945  -5.155
  349   1HB   GLN  43          2HB       GLN  43  -8.842  -4.336  -6.851
  350   2HB   GLN  43          1HB       GLN  43  -8.282  -5.997  -6.880
  351   1HG   GLN  43          2HG       GLN  43  -8.855  -4.721  -4.255
  352   2HG   GLN  43          1HG       GLN  43 -10.201  -5.239  -5.267
  353   1HE2  GLN  43          1HE2      GLN  43  -7.498  -6.256  -3.349
  354   2HE2  GLN  43          2HE2      GLN  43  -7.906  -7.941  -3.298
  355    H    ALA  44           H        ALA  44  -5.963  -6.267  -7.638
  356    HA   ALA  44           HA       ALA  44  -5.160  -8.360  -5.971
  357   1HB   ALA  44          1HB       ALA  44  -4.020  -7.588  -8.653
  358   2HB   ALA  44          2HB       ALA  44  -5.438  -8.600  -8.381
  359   3HB   ALA  44          3HB       ALA  44  -3.846  -9.157  -7.867
  360    H    GLU  45           H        GLU  45  -3.256  -5.601  -7.222
  361    HA   GLU  45           HA       GLU  45  -0.799  -6.422  -6.123
  362   1HB   GLU  45          2HB       GLU  45  -1.791  -4.121  -7.501
  363   2HB   GLU  45          1HB       GLU  45  -0.877  -3.587  -6.096
  364   1HG   GLU  45          2HG       GLU  45   0.931  -5.216  -6.898
  365   2HG   GLU  45          1HG       GLU  45   0.043  -5.233  -8.419
  366    H    LEU  46           H        LEU  46  -3.351  -4.322  -4.841
  367    HA   LEU  46           HA       LEU  46  -2.190  -3.465  -2.505
  368   1HB   LEU  46          2HB       LEU  46  -5.057  -4.320  -2.919
  369   2HB   LEU  46          1HB       LEU  46  -4.473  -3.324  -1.604
  370    HG   LEU  46           HG       LEU  46  -4.411  -2.553  -4.521
  371   1HD1  LEU  46          1HD1      LEU  46  -6.680  -2.633  -3.620
  372   2HD1  LEU  46          2HD1      LEU  46  -6.170  -0.975  -3.933
  373   3HD1  LEU  46          3HD1      LEU  46  -6.189  -1.595  -2.282
  374   1HD2  LEU  46          1HD2      LEU  46  -2.588  -1.544  -3.272
  375   2HD2  LEU  46          2HD2      LEU  46  -3.719  -0.988  -2.037
  376   3HD2  LEU  46          3HD2      LEU  46  -3.804  -0.332  -3.672
  377    H    GLU  47           H        GLU  47  -4.037  -6.486  -2.969
  378    HA   GLU  47           HA       GLU  47  -3.632  -7.337  -0.292
  379   1HB   GLU  47          2HB       GLU  47  -4.588  -8.755  -2.753
  380   2HB   GLU  47          1HB       GLU  47  -4.388  -9.589  -1.217
  381   1HG   GLU  47          2HG       GLU  47  -5.929  -7.886  -0.216
  382   2HG   GLU  47          1HG       GLU  47  -6.242  -7.321  -1.855
  383    H    THR  48           H        THR  48  -1.799  -7.729  -3.237
  384    HA   THR  48           HA       THR  48  -0.254  -9.959  -2.411
  385    HB   THR  48           HB       THR  48   0.542  -7.756  -4.334
  386    HG1  THR  48           HG1      THR  48  -1.375  -8.685  -5.054
  387   1HG2  THR  48          1HG2      THR  48   2.411  -9.183  -3.632
  388   2HG2  THR  48          2HG2      THR  48   1.994  -9.458  -5.324
  389   3HG2  THR  48          3HG2      THR  48   1.488 -10.614  -4.093
  390    H    TRP  49           H        TRP  49   0.160  -6.461  -2.083
  391    HA   TRP  49           HA       TRP  49   2.684  -6.515  -0.824
  392   1HB   TRP  49          2HB       TRP  49   0.466  -4.522  -0.297
  393   2HB   TRP  49          1HB       TRP  49   2.189  -4.282  -0.040
  394    HD1  TRP  49           HD1      TRP  49   2.787  -5.666  -3.075
  395    HE1  TRP  49           HE1      TRP  49   2.511  -4.087  -5.090
  396    HE3  TRP  49           HE3      TRP  49  -0.058  -2.043  -0.873
  397    HZ2  TRP  49           HZ2      TRP  49   1.260  -1.617  -5.659
  398    HZ3  TRP  49           HZ3      TRP  49  -0.747  -0.102  -2.213
  399    HH2  TRP  49           HH2      TRP  49  -0.100   0.107  -4.558
  400    H    TRP  50           H        TRP  50  -0.615  -6.648   0.436
  401    HA   TRP  50           HA       TRP  50  -0.003  -6.787   3.172
  402   1HB   TRP  50          2HB       TRP  50  -2.269  -6.370   2.241
  403   2HB   TRP  50          1HB       TRP  50  -2.336  -8.042   1.698
  404    HD1  TRP  50           HD1      TRP  50  -2.934  -9.889   3.485
  405    HE1  TRP  50           HE1      TRP  50  -3.764  -9.783   5.924
  406    HE3  TRP  50           HE3      TRP  50  -2.034  -4.941   4.433
  407    HZ2  TRP  50           HZ2      TRP  50  -4.006  -7.855   7.966
  408    HZ3  TRP  50           HZ3      TRP  50  -2.593  -4.047   6.657
  409    HH2  TRP  50           HH2      TRP  50  -3.558  -5.474   8.383
  410    H    GLU  51           H        GLU  51  -0.423  -9.331   0.736
  411    HA   GLU  51           HA       GLU  51  -0.125 -11.520   2.433
  412   1HB   GLU  51          2HB       GLU  51   0.212 -11.061  -0.503
  413   2HB   GLU  51          1HB       GLU  51   0.658 -12.603   0.191
  414   1HG   GLU  51          2HG       GLU  51  -1.613 -12.836   1.100
  415   2HG   GLU  51          1HG       GLU  51  -2.050 -11.305   0.345
  416    H    GLU  52           H        GLU  52   2.323  -9.814   0.464
  417    HA   GLU  52           HA       GLU  52   4.497 -11.342   1.419
  418   1HB   GLU  52          2HB       GLU  52   4.289  -8.681   0.061
  419   2HB   GLU  52          1HB       GLU  52   5.838  -9.270   0.652
  420   1HG   GLU  52          2HG       GLU  52   5.385 -11.371  -0.688
  421   2HG   GLU  52          1HG       GLU  52   4.060 -10.488  -1.433
  422    H    LEU  53           H        LEU  53   2.826  -8.565   2.696
  423    HA   LEU  53           HA       LEU  53   4.731  -7.798   4.635
  424   1HB   LEU  53          2HB       LEU  53   2.895  -6.342   4.018
  425   2HB   LEU  53          1HB       LEU  53   1.725  -7.517   4.586
  426    HG   LEU  53           HG       LEU  53   2.627  -7.202   6.898
  427   1HD1  LEU  53          1HD1      LEU  53   4.122  -4.922   5.608
  428   2HD1  LEU  53          2HD1      LEU  53   4.836  -6.368   6.325
  429   3HD1  LEU  53          3HD1      LEU  53   3.979  -5.212   7.343
  430   1HD2  LEU  53          1HD2      LEU  53   1.548  -4.757   5.499
  431   2HD2  LEU  53          2HD2      LEU  53   1.524  -5.039   7.241
  432   3HD2  LEU  53          3HD2      LEU  53   0.599  -6.084   6.164
  433    H    GLN  54           H        GLN  54   1.798  -9.816   4.945
  434    HA   GLN  54           HA       GLN  54   2.373 -10.568   7.623
  435   1HB   GLN  54          2HB       GLN  54   0.344 -11.232   5.596
  436   2HB   GLN  54          1HB       GLN  54   0.658 -12.498   6.771
  437   1HG   GLN  54          2HG       GLN  54  -1.179 -11.099   7.494
  438   2HG   GLN  54          1HG       GLN  54   0.189 -10.930   8.591
  439   1HE2  GLN  54          1HE2      GLN  54  -0.477  -8.914   9.350
  440   2HE2  GLN  54          2HE2      GLN  54  -0.408  -7.493   8.364
  441    H    LYS  55           H        LYS  55   3.131 -11.983   4.514
  442    HA   LYS  55           HA       LYS  55   4.354 -14.325   5.786
  443   1HB   LYS  55          2HB       LYS  55   2.920 -14.364   3.626
  444   2HB   LYS  55          1HB       LYS  55   4.361 -13.718   2.856
  445   1HG   LYS  55          2HG       LYS  55   5.632 -15.675   3.655
  446   2HG   LYS  55          1HG       LYS  55   4.136 -16.342   4.309
  447   1HD   LYS  55          2HD       LYS  55   3.167 -16.305   2.034
  448   2HD   LYS  55          1HD       LYS  55   4.716 -15.724   1.420
  449   1HE   LYS  55          2HE       LYS  55   5.799 -17.764   2.242
  450   2HE   LYS  55          1HE       LYS  55   4.246 -18.340   2.844
  451   1HZ   LYS  55          1HZ       LYS  55   3.419 -18.308   0.548
  452   2HZ   LYS  55          2HZ       LYS  55   4.745 -19.352   0.732
  453   3HZ   LYS  55          3HZ       LYS  55   4.951 -17.833   0.000
  454    H    ASN  56           H        ASN  56   5.338 -11.608   6.087
  455    HA   ASN  56           HA       ASN  56   7.397 -10.699   4.618
  456   1HB   ASN  56          2HB       ASN  56   8.401  -9.797   6.715
  457   2HB   ASN  56          1HB       ASN  56   6.675  -9.500   6.566
  458   1HD2  ASN  56          1HD2      ASN  56   6.474  -9.176   8.777
  459   2HD2  ASN  56          2HD2      ASN  56   6.541 -10.483   9.912
  460    HA   PRO  57           HA       PRO  57  10.765 -13.575   4.750
  461   1HB   PRO  57          2HB       PRO  57  12.750 -11.918   3.980
  462   2HB   PRO  57          1HB       PRO  57  11.493 -12.449   2.856
  463   1HG   PRO  57          2HG       PRO  57  11.729  -9.868   4.351
  464   2HG   PRO  57          1HG       PRO  57  11.270 -10.142   2.660
  465   1HD   PRO  57          2HD       PRO  57   9.463  -9.691   4.651
  466   2HD   PRO  57          1HD       PRO  57   9.100 -10.657   3.207
  467    HA   PRO  58           HA       PRO  58  12.883 -13.001   8.628
  468   1HB   PRO  58          2HB       PRO  58  15.327 -14.083   8.088
  469   2HB   PRO  58          1HB       PRO  58  13.877 -15.048   8.379
  470   1HG   PRO  58          2HG       PRO  58  15.162 -14.295   5.785
  471   2HG   PRO  58          1HG       PRO  58  14.449 -15.843   6.275
  472   1HD   PRO  58          2HD       PRO  58  13.154 -14.074   4.690
  473   2HD   PRO  58          1HD       PRO  58  12.306 -15.137   5.829
  474    H    TYR  59           H        TYR  59  14.525 -11.805   9.656
  475    HA   TYR  59           HA       TYR  59  15.925  -9.868   7.938
  476   1HB   TYR  59          2HB       TYR  59  13.895  -8.967   9.134
  477   2HB   TYR  59          1HB       TYR  59  14.723  -9.287  10.648
  478    HD1  TYR  59           HD1      TYR  59  15.284  -7.476   7.420
  479    HD2  TYR  59           HD2      TYR  59  15.929  -7.579  11.624
  480    HE1  TYR  59           HE1      TYR  59  16.349  -5.261   7.306
  481    HE2  TYR  59           HE2      TYR  59  16.997  -5.366  11.518
  482    HH   TYR  59           HH       TYR  59  16.926  -3.420   8.637
  483    H    GLU  60           H        GLU  60  18.054  -9.874   8.217
  484    HA   GLU  60           HA       GLU  60  19.362 -11.555  10.060
  485   1HB   GLU  60          2HB       GLU  60  20.399 -10.841   7.949
  486   2HB   GLU  60          1HB       GLU  60  20.463  -9.183   8.530
  487   1HG   GLU  60          2HG       GLU  60  21.945  -9.946  10.368
  488   2HG   GLU  60          1HG       GLU  60  21.955 -11.547   9.635
  Start of MODEL   20
    1   1H    MET   1          1H        MET   1  -9.812  -4.590   5.165
    2   2H    MET   1          2H        MET   1 -10.122  -5.397   3.705
    3   3H    MET   1          3H        MET   1 -10.286  -3.712   3.796
    4    HA   MET   1           HA       MET   1  -7.743  -5.163   4.208
    5   1HB   MET   1          2HB       MET   1  -8.869  -3.798   1.761
    6   2HB   MET   1          1HB       MET   1  -7.147  -4.082   1.971
    7   1HG   MET   1          2HG       MET   1  -9.263  -6.222   1.943
    8   2HG   MET   1          1HG       MET   1  -8.246  -5.777   0.575
    9   1HE   MET   1          1HE       MET   1  -5.668  -6.251   0.410
   10   2HE   MET   1          2HE       MET   1  -4.692  -6.837   1.757
   11   3HE   MET   1          3HE       MET   1  -5.440  -5.242   1.838
   12    H    ILE   2           H        ILE   2  -6.215  -3.945   5.136
   13    HA   ILE   2           HA       ILE   2  -6.777  -1.138   5.630
   14    HB   ILE   2           HB       ILE   2  -4.312  -2.666   6.445
   15   1HG1  ILE   2          2HG1      ILE   2  -6.286  -3.810   7.336
   16   2HG1  ILE   2          1HG1      ILE   2  -5.390  -3.016   8.625
   17   1HG2  ILE   2          1HG2      ILE   2  -5.569  -0.146   7.517
   18   2HG2  ILE   2          2HG2      ILE   2  -4.101  -0.248   6.545
   19   3HG2  ILE   2          3HG2      ILE   2  -4.133  -0.935   8.169
   20   1HD1  ILE   2          1HD1      ILE   2  -7.917  -2.010   7.337
   21   2HD1  ILE   2          2HD1      ILE   2  -7.015  -1.187   8.610
   22   3HD1  ILE   2          3HD1      ILE   2  -7.771  -2.747   8.929
   23    H    LEU   3           H        LEU   3  -6.276   0.276   4.112
   24    HA   LEU   3           HA       LEU   3  -4.598  -0.345   1.927
   25   1HB   LEU   3          2HB       LEU   3  -6.339   1.833   2.789
   26   2HB   LEU   3          1HB       LEU   3  -4.957   2.373   1.875
   27    HG   LEU   3           HG       LEU   3  -6.864   2.052   0.413
   28   1HD1  LEU   3          1HD1      LEU   3  -5.862   0.560  -1.233
   29   2HD1  LEU   3          2HD1      LEU   3  -4.778  -0.083   0.003
   30   3HD1  LEU   3          3HD1      LEU   3  -4.650   1.605  -0.491
   31   1HD2  LEU   3          1HD2      LEU   3  -7.820  -0.179   0.060
   32   2HD2  LEU   3          2HD2      LEU   3  -8.075   0.391   1.708
   33   3HD2  LEU   3          3HD2      LEU   3  -6.826  -0.808   1.376
   34    H    TYR   4           H        TYR   4  -4.163   1.547   4.867
   35    HA   TYR   4           HA       TYR   4  -1.903   2.989   4.169
   36   1HB   TYR   4          2HB       TYR   4  -3.213   3.317   6.255
   37   2HB   TYR   4          1HB       TYR   4  -2.491   1.848   6.903
   38    HD1  TYR   4           HD1      TYR   4  -0.931   2.335   8.540
   39    HD2  TYR   4           HD2      TYR   4  -1.132   4.827   5.095
   40    HE1  TYR   4           HE1      TYR   4   0.978   3.644   9.379
   41    HE2  TYR   4           HE2      TYR   4   0.767   6.141   5.924
   42    HH   TYR   4           HH       TYR   4   2.704   5.115   8.573
   43    H    ASP   5           H        ASP   5  -2.047  -0.225   5.685
   44    HA   ASP   5           HA       ASP   5   0.705  -0.660   5.891
   45   1HB   ASP   5          2HB       ASP   5  -1.642  -2.526   5.619
   46   2HB   ASP   5          1HB       ASP   5   0.001  -3.132   5.764
   47    H    ALA   6           H        ALA   6  -1.551  -1.593   3.321
   48    HA   ALA   6           HA       ALA   6   0.283  -2.896   1.663
   49   1HB   ALA   6          1HB       ALA   6  -2.151  -3.067   1.436
   50   2HB   ALA   6          2HB       ALA   6  -1.381  -2.637  -0.088
   51   3HB   ALA   6          3HB       ALA   6  -2.209  -1.402   0.858
   52    H    ILE   7           H        ILE   7  -0.829   0.485   1.597
   53    HA   ILE   7           HA       ILE   7   0.713   1.271  -0.630
   54    HB   ILE   7           HB       ILE   7  -0.323   2.973   1.650
   55   1HG1  ILE   7          2HG1      ILE   7  -1.500   2.426  -1.086
   56   2HG1  ILE   7          1HG1      ILE   7  -2.063   1.703   0.416
   57   1HG2  ILE   7          1HG2      ILE   7  -0.117   4.844   0.075
   58   2HG2  ILE   7          2HG2      ILE   7   0.622   3.762  -1.106
   59   3HG2  ILE   7          3HG2      ILE   7   1.448   4.100   0.415
   60   1HD1  ILE   7          1HD1      ILE   7  -2.130   4.625  -0.287
   61   2HD1  ILE   7          2HD1      ILE   7  -2.649   3.934   1.251
   62   3HD1  ILE   7          3HD1      ILE   7  -3.503   3.523  -0.237
   63    H    MET   8           H        MET   8   1.338   1.385   2.858
   64    HA   MET   8           HA       MET   8   3.759   2.855   2.682
   65   1HB   MET   8          2HB       MET   8   2.327   2.553   4.738
   66   2HB   MET   8          1HB       MET   8   2.971   0.925   4.869
   67   1HG   MET   8          2HG       MET   8   4.394   1.960   6.280
   68   2HG   MET   8          1HG       MET   8   5.272   2.243   4.781
   69   1HE   MET   8          1HE       MET   8   5.411   4.554   3.542
   70   2HE   MET   8          2HE       MET   8   4.482   5.980   4.003
   71   3HE   MET   8          3HE       MET   8   3.658   4.565   3.349
   72    H    TYR   9           H        TYR   9   2.989  -0.458   2.167
   73    HA   TYR   9           HA       TYR   9   5.616  -1.494   2.659
   74   1HB   TYR   9          2HB       TYR   9   3.556  -2.856   2.895
   75   2HB   TYR   9          1HB       TYR   9   3.301  -2.737   1.159
   76    HD1  TYR   9           HD1      TYR   9   4.187  -4.362  -0.256
   77    HD2  TYR   9           HD2      TYR   9   5.785  -3.944   3.669
   78    HE1  TYR   9           HE1      TYR   9   5.536  -6.389  -0.598
   79    HE2  TYR   9           HE2      TYR   9   7.138  -5.971   3.339
   80    HH   TYR   9           HH       TYR   9   7.345  -7.562   0.220
   81    H    LYS  10           H        LYS  10   3.734  -0.773  -0.308
   82    HA   LYS  10           HA       LYS  10   6.018  -1.458  -1.935
   83   1HB   LYS  10          2HB       LYS  10   3.573  -1.993  -2.462
   84   2HB   LYS  10          1HB       LYS  10   3.408  -0.296  -2.882
   85   1HG   LYS  10          2HG       LYS  10   5.635  -1.758  -4.149
   86   2HG   LYS  10          1HG       LYS  10   4.000  -2.189  -4.657
   87   1HD   LYS  10          2HD       LYS  10   4.417   0.682  -4.475
   88   2HD   LYS  10          1HD       LYS  10   5.505  -0.098  -5.609
   89   1HE   LYS  10          2HE       LYS  10   2.496  -0.242  -5.590
   90   2HE   LYS  10          1HE       LYS  10   3.501   0.599  -6.767
   91   1HZ   LYS  10          1HZ       LYS  10   3.684  -2.327  -6.344
   92   2HZ   LYS  10          2HZ       LYS  10   4.256  -1.425  -7.658
   93   3HZ   LYS  10          3HZ       LYS  10   2.585  -1.648  -7.443
   94    H    TYR  11           H        TYR  11   4.404   1.389  -0.726
   95    HA   TYR  11           HA       TYR  11   6.449   3.046  -2.061
   96   1HB   TYR  11          2HB       TYR  11   3.744   3.923  -1.013
   97   2HB   TYR  11          1HB       TYR  11   4.934   4.961  -1.788
   98    HD1  TYR  11           HD1      TYR  11   2.088   2.889  -2.280
   99    HD2  TYR  11           HD2      TYR  11   5.569   4.367  -4.233
  100    HE1  TYR  11           HE1      TYR  11   1.061   2.406  -4.464
  101    HE2  TYR  11           HE2      TYR  11   4.552   3.892  -6.420
  102    HH   TYR  11           HH       TYR  11   1.283   3.213  -6.832
  103    HA   PRO  12           HA       PRO  12   7.458   2.722   2.415
  104   1HB   PRO  12          2HB       PRO  12  10.181   3.289   1.458
  105   2HB   PRO  12          1HB       PRO  12   9.590   1.926   2.410
  106   1HG   PRO  12          2HG       PRO  12  10.324   1.638  -0.152
  107   2HG   PRO  12          1HG       PRO  12   8.975   0.715   0.538
  108   1HD   PRO  12          2HD       PRO  12   8.910   3.155  -1.200
  109   2HD   PRO  12          1HD       PRO  12   7.892   1.700  -1.259
  110    H    ASN  13           H        ASN  13   8.338   5.206   0.112
  111    HA   ASN  13           HA       ASN  13   8.872   7.056   2.323
  112   1HB   ASN  13          2HB       ASN  13   9.893   6.955  -0.506
  113   2HB   ASN  13          1HB       ASN  13  10.050   8.388   0.496
  114   1HD2  ASN  13          1HD2      ASN  13  11.139   5.157  -0.064
  115   2HD2  ASN  13          2HD2      ASN  13  12.439   5.171   1.078
  116    H    ALA  14           H        ALA  14   6.230   6.351   1.161
  117    HA   ALA  14           HA       ALA  14   5.374   8.707  -0.269
  118   1HB   ALA  14          1HB       ALA  14   4.344   6.534  -0.716
  119   2HB   ALA  14          2HB       ALA  14   3.154   7.715  -0.166
  120   3HB   ALA  14          3HB       ALA  14   3.742   6.477   0.942
  121    H    VAL  15           H        VAL  15   4.165  10.397   0.529
  122    HA   VAL  15           HA       VAL  15   4.509  10.947   3.339
  123    HB   VAL  15           HB       VAL  15   3.135  12.645   1.254
  124   1HG1  VAL  15          1HG1      VAL  15   2.568  13.272   3.545
  125   2HG1  VAL  15          2HG1      VAL  15   3.590  14.502   2.799
  126   3HG1  VAL  15          3HG1      VAL  15   4.281  13.363   3.955
  127   1HG2  VAL  15          1HG2      VAL  15   5.283  13.884   1.161
  128   2HG2  VAL  15          2HG2      VAL  15   5.400  12.236   0.544
  129   3HG2  VAL  15          3HG2      VAL  15   6.015  12.621   2.152
  130    H    SER  16           H        SER  16   3.150   9.934   4.679
  131    HA   SER  16           HA       SER  16   0.501   9.196   3.990
  132   1HB   SER  16          2HB       SER  16   1.655   9.376   6.777
  133   2HB   SER  16          1HB       SER  16   0.348   8.336   6.217
  134    HG   SER  16           HG       SER  16   2.110   7.044   6.235
  135    H    ARG  17           H        ARG  17  -1.415  10.135   4.407
  136    HA   ARG  17           HA       ARG  17  -3.014  11.510   5.211
  137   1HB   ARG  17          2HB       ARG  17  -0.877  12.374   7.155
  138   2HB   ARG  17          1HB       ARG  17  -2.549  12.916   7.220
  139   1HG   ARG  17          2HG       ARG  17  -3.259  10.554   7.467
  140   2HG   ARG  17          1HG       ARG  17  -1.558  10.085   7.522
  141   1HD   ARG  17          2HD       ARG  17  -1.215  11.378   9.522
  142   2HD   ARG  17          1HD       ARG  17  -2.850  12.033   9.428
  143    HE   ARG  17           HE       ARG  17  -2.107   9.284  10.184
  144   1HH1  ARG  17          1HH1      ARG  17  -4.554  11.762   9.774
  145   2HH1  ARG  17          2HH1      ARG  17  -5.747  10.925  10.726
  146   1HH2  ARG  17          1HH2      ARG  17  -3.664   8.185  11.444
  147   2HH2  ARG  17          2HH2      ARG  17  -5.232   8.895  11.690
  148    H    LYS  18           H        LYS  18  -0.629  12.420   3.344
  149    HA   LYS  18           HA       LYS  18  -1.920  15.003   2.885
  150   1HB   LYS  18          2HB       LYS  18   0.172  15.531   4.062
  151   2HB   LYS  18          1HB       LYS  18   1.084  14.632   2.853
  152   1HG   LYS  18          2HG       LYS  18   0.267  16.201   1.124
  153   2HG   LYS  18          1HG       LYS  18  -0.537  17.127   2.392
  154   1HD   LYS  18          2HD       LYS  18   2.428  16.593   2.266
  155   2HD   LYS  18          1HD       LYS  18   1.648  18.074   1.710
  156   1HE   LYS  18          2HE       LYS  18   0.773  18.416   4.001
  157   2HE   LYS  18          1HE       LYS  18   1.679  16.998   4.525
  158   1HZ   LYS  18          1HZ       LYS  18   3.725  18.100   3.864
  159   2HZ   LYS  18          2HZ       LYS  18   2.877  19.046   4.991
  160   3HZ   LYS  18          3HZ       LYS  18   2.854  19.459   3.346
  161    H    ASP  19           H        ASP  19   0.657  12.939   1.520
  162    HA   ASP  19           HA       ASP  19  -0.219  13.469  -1.158
  163   1HB   ASP  19          2HB       ASP  19   1.949  11.893   0.103
  164   2HB   ASP  19          1HB       ASP  19   1.409  11.351  -1.483
  165    H    PHE  20           H        PHE  20  -0.759  10.994   1.231
  166    HA   PHE  20           HA       PHE  20  -3.110  10.327  -0.334
  167   1HB   PHE  20          2HB       PHE  20  -2.932   7.927   0.098
  168   2HB   PHE  20          1HB       PHE  20  -1.573   8.502  -0.850
  169    HD1  PHE  20           HD1      PHE  20   0.644   8.877   0.353
  170    HD2  PHE  20           HD2      PHE  20  -2.619   6.749   2.071
  171    HE1  PHE  20           HE1      PHE  20   2.183   7.797   1.940
  172    HE2  PHE  20           HE2      PHE  20  -1.086   5.672   3.661
  173    HZ   PHE  20           HZ       PHE  20   1.320   6.196   3.596
  174    H    GLU  21           H        GLU  21  -4.738  10.841   0.847
  175    HA   GLU  21           HA       GLU  21  -4.495  10.874   3.760
  176   1HB   GLU  21          2HB       GLU  21  -5.331  12.908   2.701
  177   2HB   GLU  21          1HB       GLU  21  -6.613  12.001   1.914
  178   1HG   GLU  21          2HG       GLU  21  -7.714  11.606   3.968
  179   2HG   GLU  21          1HG       GLU  21  -6.339  12.200   4.897
  180    H    LEU  22           H        LEU  22  -5.685   9.611   5.090
  181    HA   LEU  22           HA       LEU  22  -7.090   7.388   3.761
  182   1HB   LEU  22          2HB       LEU  22  -6.033   7.435   6.579
  183   2HB   LEU  22          1HB       LEU  22  -6.541   6.043   5.649
  184    HG   LEU  22           HG       LEU  22  -4.116   7.711   4.989
  185   1HD1  LEU  22          1HD1      LEU  22  -4.298   5.056   6.403
  186   2HD1  LEU  22          2HD1      LEU  22  -3.867   6.595   7.149
  187   3HD1  LEU  22          3HD1      LEU  22  -2.817   5.881   5.924
  188   1HD2  LEU  22          1HD2      LEU  22  -5.036   5.019   3.987
  189   2HD2  LEU  22          2HD2      LEU  22  -3.534   5.833   3.547
  190   3HD2  LEU  22          3HD2      LEU  22  -5.087   6.530   3.080
  191    H    ARG  23           H        ARG  23  -9.038   6.623   4.629
  192    HA   ARG  23           HA       ARG  23 -10.238   8.157   6.810
  193   1HB   ARG  23          2HB       ARG  23 -11.057   8.448   4.132
  194   2HB   ARG  23          1HB       ARG  23 -12.289   7.463   4.913
  195   1HG   ARG  23          2HG       ARG  23 -13.008   9.666   5.199
  196   2HG   ARG  23          1HG       ARG  23 -12.296   9.225   6.748
  197   1HD   ARG  23          2HD       ARG  23 -10.202  10.319   6.078
  198   2HD   ARG  23          1HD       ARG  23 -10.954  10.809   4.564
  199    HE   ARG  23           HE       ARG  23 -12.022  11.703   7.165
  200   1HH1  ARG  23          1HH1      ARG  23 -10.856  12.363   3.940
  201   2HH1  ARG  23          2HH1      ARG  23 -11.102  14.075   4.047
  202   1HH2  ARG  23          1HH2      ARG  23 -12.327  13.968   7.341
  203   2HH2  ARG  23          2HH2      ARG  23 -11.942  14.988   5.987
  204    H    ASN  24           H        ASN  24 -11.987   7.054   7.877
  205    HA   ASN  24           HA       ASN  24 -11.509   4.182   7.893
  206   1HB   ASN  24          2HB       ASN  24 -11.600   5.594   9.992
  207   2HB   ASN  24          1HB       ASN  24 -13.325   5.772   9.711
  208   1HD2  ASN  24          1HD2      ASN  24 -11.879   4.549  11.919
  209   2HD2  ASN  24          2HD2      ASN  24 -12.470   2.931  12.024
  210    H    ASP  25           H        ASP  25 -12.641   3.004   6.495
  211    HA   ASP  25           HA       ASP  25 -15.209   3.928   5.517
  212   1HB   ASP  25          2HB       ASP  25 -13.677   2.975   3.906
  213   2HB   ASP  25          1HB       ASP  25 -13.555   1.490   4.847
  214    H    GLY  26           H        GLY  26 -13.945   1.247   7.421
  215   1HA   GLY  26          2HA       GLY  26 -15.847   0.747   9.187
  216   2HA   GLY  26          1HA       GLY  26 -16.627   0.133   7.736
  217    H    ASN  27           H        ASN  27 -14.381  -0.923   6.449
  218    HA   ASN  27           HA       ASN  27 -13.661  -3.145   8.247
  219   1HB   ASN  27          2HB       ASN  27 -14.894  -3.515   5.980
  220   2HB   ASN  27          1HB       ASN  27 -13.331  -3.175   5.249
  221   1HD2  ASN  27          1HD2      ASN  27 -14.873  -5.616   5.155
  222   2HD2  ASN  27          2HD2      ASN  27 -13.871  -6.856   5.831
  223    H    GLY  28           H        GLY  28 -12.456  -0.473   8.129
  224   1HA   GLY  28          2HA       GLY  28 -10.036  -0.446   8.802
  225   2HA   GLY  28          1HA       GLY  28  -9.742  -1.197   7.240
  226    H    SER  29           H        SER  29  -8.321   0.921   7.529
  227    HA   SER  29           HA       SER  29  -9.715   3.291   6.584
  228   1HB   SER  29          2HB       SER  29  -6.739   2.962   6.980
  229   2HB   SER  29          1HB       SER  29  -7.684   4.452   7.009
  230    HG   SER  29           HG       SER  29  -8.305   4.052   9.014
  231    H    TYR  30           H        TYR  30  -9.747   3.934   4.495
  232    HA   TYR  30           HA       TYR  30  -7.925   2.583   2.621
  233   1HB   TYR  30          2HB       TYR  30  -9.638   2.334   0.995
  234   2HB   TYR  30          1HB       TYR  30 -10.307   1.738   2.504
  235    HD1  TYR  30           HD1      TYR  30 -11.149   3.417  -0.321
  236    HD2  TYR  30           HD2      TYR  30 -11.457   3.876   3.900
  237    HE1  TYR  30           HE1      TYR  30 -13.094   4.885  -0.629
  238    HE2  TYR  30           HE2      TYR  30 -13.403   5.349   3.600
  239    HH   TYR  30           HH       TYR  30 -14.330   6.836   1.818
  240    H    ILE  31           H        ILE  31  -8.321   3.890   0.347
  241    HA   ILE  31           HA       ILE  31  -7.003   6.370   0.882
  242    HB   ILE  31           HB       ILE  31  -7.952   5.286  -1.773
  243   1HG1  ILE  31          2HG1      ILE  31  -5.231   5.028  -0.473
  244   2HG1  ILE  31          1HG1      ILE  31  -6.424   3.738  -0.544
  245   1HG2  ILE  31          1HG2      ILE  31  -5.879   7.368  -1.095
  246   2HG2  ILE  31          2HG2      ILE  31  -7.452   7.664  -1.836
  247   3HG2  ILE  31          3HG2      ILE  31  -6.222   6.751  -2.711
  248   1HD1  ILE  31          1HD1      ILE  31  -6.307   3.778  -2.989
  249   2HD1  ILE  31          2HD1      ILE  31  -4.743   3.439  -2.246
  250   3HD1  ILE  31          3HD1      ILE  31  -5.082   5.042  -2.897
  251    H    GLU  32           H        GLU  32  -7.931   8.228   1.256
  252    HA   GLU  32           HA       GLU  32 -10.661   8.743   0.324
  253   1HB   GLU  32          2HB       GLU  32 -10.340   9.162   2.664
  254   2HB   GLU  32          1HB       GLU  32  -8.882  10.092   2.361
  255   1HG   GLU  32          2HG       GLU  32 -10.502  11.686   2.848
  256   2HG   GLU  32          1HG       GLU  32 -10.373  11.714   1.091
  257    H    LYS  33           H        LYS  33  -7.462  10.268   0.441
  258    HA   LYS  33           HA       LYS  33  -8.179  11.868  -1.925
  259   1HB   LYS  33          2HB       LYS  33  -8.037  12.929   0.563
  260   2HB   LYS  33          1HB       LYS  33  -6.355  13.068   0.084
  261   1HG   LYS  33          2HG       LYS  33  -8.687  14.210  -1.432
  262   2HG   LYS  33          1HG       LYS  33  -7.636  15.107  -0.349
  263   1HD   LYS  33          2HD       LYS  33  -5.736  14.310  -1.842
  264   2HD   LYS  33          1HD       LYS  33  -6.995  13.883  -2.993
  265   1HE   LYS  33          2HE       LYS  33  -6.486  16.612  -1.829
  266   2HE   LYS  33          1HE       LYS  33  -6.122  16.100  -3.475
  267   1HZ   LYS  33          1HZ       LYS  33  -8.486  15.787  -3.864
  268   2HZ   LYS  33          2HZ       LYS  33  -8.159  17.377  -3.373
  269   3HZ   LYS  33          3HZ       LYS  33  -8.841  16.278  -2.278
  270    H    TRP  34           H        TRP  34  -6.868  11.178  -3.511
  271    HA   TRP  34           HA       TRP  34  -4.193  10.201  -2.822
  272   1HB   TRP  34          2HB       TRP  34  -5.794   8.741  -4.122
  273   2HB   TRP  34          1HB       TRP  34  -5.676   9.898  -5.439
  274    HD1  TRP  34           HD1      TRP  34  -3.655   9.649  -7.066
  275    HE1  TRP  34           HE1      TRP  34  -1.675   8.013  -7.233
  276    HE3  TRP  34           HE3      TRP  34  -4.115   7.352  -2.524
  277    HZ2  TRP  34           HZ2      TRP  34  -0.469   6.021  -5.655
  278    HZ3  TRP  34           HZ3      TRP  34  -2.505   5.589  -1.931
  279    HH2  TRP  34           HH2      TRP  34  -0.718   4.936  -3.465
  280    H    ASN  35           H        ASN  35  -2.651  11.670  -2.970
  281    HA   ASN  35           HA       ASN  35  -2.773  13.661  -5.137
  282   1HB   ASN  35          2HB       ASN  35  -1.640  13.829  -2.353
  283   2HB   ASN  35          1HB       ASN  35  -1.119  14.931  -3.622
  284   1HD2  ASN  35          1HD2      ASN  35  -2.591  15.361  -1.088
  285   2HD2  ASN  35          2HD2      ASN  35  -4.023  16.214  -1.546
  286    H    LEU  36           H        LEU  36  -1.287  10.906  -4.158
  287    HA   LEU  36           HA       LEU  36   1.427  11.430  -4.711
  288   1HB   LEU  36          2HB       LEU  36  -0.198   8.913  -4.605
  289   2HB   LEU  36          1HB       LEU  36   1.471   8.880  -5.122
  290    HG   LEU  36           HG       LEU  36   0.602   9.970  -2.458
  291   1HD1  LEU  36          1HD1      LEU  36   1.368   7.863  -1.507
  292   2HD1  LEU  36          2HD1      LEU  36   1.688   7.239  -3.125
  293   3HD1  LEU  36          3HD1      LEU  36   0.032   7.592  -2.628
  294   1HD2  LEU  36          1HD2      LEU  36   2.964   9.715  -1.903
  295   2HD2  LEU  36          2HD2      LEU  36   2.755  10.787  -3.289
  296   3HD2  LEU  36          3HD2      LEU  36   3.289   9.122  -3.532
  297    H    ARG  37           H        ARG  37   2.593  11.366  -6.495
  298    HA   ARG  37           HA       ARG  37   1.241  11.343  -9.051
  299   1HB   ARG  37          2HB       ARG  37   4.151  11.748  -8.318
  300   2HB   ARG  37          1HB       ARG  37   3.496  11.921  -9.942
  301   1HG   ARG  37          2HG       ARG  37   2.238  13.817  -9.352
  302   2HG   ARG  37          1HG       ARG  37   2.447  13.520  -7.627
  303   1HD   ARG  37          2HD       ARG  37   3.850  15.360  -8.344
  304   2HD   ARG  37          1HD       ARG  37   4.842  13.992  -7.844
  305    HE   ARG  37           HE       ARG  37   4.255  14.346 -10.694
  306   1HH1  ARG  37          1HH1      ARG  37   6.533  14.506  -8.035
  307   2HH1  ARG  37          2HH1      ARG  37   7.933  14.554  -9.069
  308   1HH2  ARG  37          1HH2      ARG  37   6.092  14.416 -12.055
  309   2HH2  ARG  37          2HH2      ARG  37   7.685  14.516 -11.349
  310    H    ALA  38           H        ALA  38   1.131   8.960  -7.670
  311    HA   ALA  38           HA       ALA  38   2.713   7.131  -9.348
  312   1HB   ALA  38          1HB       ALA  38   2.787   5.568  -7.455
  313   2HB   ALA  38          2HB       ALA  38   1.959   6.756  -6.447
  314   3HB   ALA  38          3HB       ALA  38   3.577   7.094  -7.060
  315    HA   PRO  39           HA       PRO  39  -1.122   5.416 -10.694
  316   1HB   PRO  39          2HB       PRO  39   0.212   2.780 -10.429
  317   2HB   PRO  39          1HB       PRO  39  -0.554   3.519 -11.839
  318   1HG   PRO  39          2HG       PRO  39   2.106   3.351 -11.637
  319   2HG   PRO  39          1HG       PRO  39   1.323   4.765 -12.369
  320   1HD   PRO  39          2HD       PRO  39   2.551   4.459  -9.663
  321   2HD   PRO  39          1HD       PRO  39   2.557   5.856 -10.757
  322    H    LEU  40           H        LEU  40  -2.941   4.562  -9.852
  323    HA   LEU  40           HA       LEU  40  -3.125   3.984  -7.092
  324   1HB   LEU  40          2HB       LEU  40  -4.973   3.812  -9.433
  325   2HB   LEU  40          1HB       LEU  40  -5.436   3.045  -7.932
  326    HG   LEU  40           HG       LEU  40  -6.462   5.223  -8.070
  327   1HD1  LEU  40          1HD1      LEU  40  -4.193   5.268  -6.096
  328   2HD1  LEU  40          2HD1      LEU  40  -5.735   4.447  -5.873
  329   3HD1  LEU  40          3HD1      LEU  40  -5.685   6.205  -5.998
  330   1HD2  LEU  40          1HD2      LEU  40  -4.908   6.298  -9.601
  331   2HD2  LEU  40          2HD2      LEU  40  -3.669   6.323  -8.346
  332   3HD2  LEU  40          3HD2      LEU  40  -5.139   7.277  -8.153
  333    HA   PRO  41           HA       PRO  41  -1.712  -0.230  -7.122
  334   1HB   PRO  41          2HB       PRO  41  -2.971  -0.911  -4.746
  335   2HB   PRO  41          1HB       PRO  41  -1.368  -0.191  -4.882
  336   1HG   PRO  41          2HG       PRO  41  -3.983   1.101  -4.266
  337   2HG   PRO  41          1HG       PRO  41  -2.371   1.456  -3.617
  338   1HD   PRO  41          2HD       PRO  41  -3.522   3.017  -5.477
  339   2HD   PRO  41          1HD       PRO  41  -1.769   2.721  -5.456
  340    H    THR  42           H        THR  42  -2.541  -2.296  -7.459
  341    HA   THR  42           HA       THR  42  -5.378  -2.315  -8.206
  342    HB   THR  42           HB       THR  42  -4.790  -4.329  -9.567
  343    HG1  THR  42           HG1      THR  42  -2.074  -3.581  -9.147
  344   1HG2  THR  42          1HG2      THR  42  -4.902  -2.121 -10.595
  345   2HG2  THR  42          2HG2      THR  42  -3.615  -3.082 -11.326
  346   3HG2  THR  42          3HG2      THR  42  -3.223  -1.821 -10.155
  347    H    GLN  43           H        GLN  43  -6.420  -4.528  -8.038
  348    HA   GLN  43           HA       GLN  43  -6.711  -5.227  -5.357
  349   1HB   GLN  43          2HB       GLN  43  -8.312  -5.652  -7.276
  350   2HB   GLN  43          1HB       GLN  43  -7.315  -7.031  -7.701
  351   1HG   GLN  43          2HG       GLN  43  -9.215  -7.769  -6.433
  352   2HG   GLN  43          1HG       GLN  43  -7.744  -8.004  -5.490
  353   1HE2  GLN  43          1HE2      GLN  43  -7.443  -6.865  -3.626
  354   2HE2  GLN  43          2HE2      GLN  43  -8.669  -5.876  -2.902
  355    H    ALA  44           H        ALA  44  -5.129  -7.075  -7.944
  356    HA   ALA  44           HA       ALA  44  -4.157  -9.167  -6.373
  357   1HB   ALA  44          1HB       ALA  44  -2.869  -8.022  -8.846
  358   2HB   ALA  44          2HB       ALA  44  -4.205  -9.174  -8.834
  359   3HB   ALA  44          3HB       ALA  44  -2.632  -9.641  -8.184
  360    H    GLU  45           H        GLU  45  -2.610  -6.101  -7.250
  361    HA   GLU  45           HA       GLU  45  -0.156  -6.497  -5.991
  362   1HB   GLU  45          2HB       GLU  45  -1.763  -4.055  -6.651
  363   2HB   GLU  45          1HB       GLU  45  -0.275  -3.898  -5.733
  364   1HG   GLU  45          2HG       GLU  45   0.953  -4.974  -7.564
  365   2HG   GLU  45          1HG       GLU  45  -0.552  -5.103  -8.477
  366    H    LEU  46           H        LEU  46  -3.068  -4.889  -4.708
  367    HA   LEU  46           HA       LEU  46  -2.147  -4.230  -2.198
  368   1HB   LEU  46          2HB       LEU  46  -4.889  -5.074  -3.113
  369   2HB   LEU  46          1HB       LEU  46  -4.567  -4.446  -1.516
  370    HG   LEU  46           HG       LEU  46  -4.090  -2.937  -4.084
  371   1HD1  LEU  46          1HD1      LEU  46  -6.467  -3.296  -3.664
  372   2HD1  LEU  46          2HD1      LEU  46  -6.025  -1.605  -3.421
  373   3HD1  LEU  46          3HD1      LEU  46  -6.277  -2.661  -2.030
  374   1HD2  LEU  46          1HD2      LEU  46  -2.583  -2.295  -2.260
  375   2HD2  LEU  46          2HD2      LEU  46  -3.974  -2.035  -1.208
  376   3HD2  LEU  46          3HD2      LEU  46  -3.740  -1.018  -2.628
  377    H    GLU  47           H        GLU  47  -3.737  -7.262  -3.180
  378    HA   GLU  47           HA       GLU  47  -3.602  -8.380  -0.575
  379   1HB   GLU  47          2HB       GLU  47  -4.140  -9.609  -3.269
  380   2HB   GLU  47          1HB       GLU  47  -4.209 -10.516  -1.762
  381   1HG   GLU  47          2HG       GLU  47  -5.926  -8.947  -0.942
  382   2HG   GLU  47          1HG       GLU  47  -5.898  -8.144  -2.511
  383    H    THR  48           H        THR  48  -1.459  -8.463  -3.364
  384    HA   THR  48           HA       THR  48   0.163 -10.611  -2.445
  385    HB   THR  48           HB       THR  48   0.867  -8.325  -4.310
  386    HG1  THR  48           HG1      THR  48  -0.844  -9.789  -4.982
  387   1HG2  THR  48          1HG2      THR  48   2.881  -9.353  -3.365
  388   2HG2  THR  48          2HG2      THR  48   2.705  -9.758  -5.072
  389   3HG2  THR  48          3HG2      THR  48   2.292 -10.947  -3.838
  390    H    TRP  49           H        TRP  49   0.436  -7.062  -2.092
  391    HA   TRP  49           HA       TRP  49   2.841  -7.122  -0.609
  392   1HB   TRP  49          2HB       TRP  49   0.621  -5.079  -0.397
  393   2HB   TRP  49          1HB       TRP  49   2.301  -4.857   0.080
  394    HD1  TRP  49           HD1      TRP  49   3.610  -6.102  -2.611
  395    HE1  TRP  49           HE1      TRP  49   3.504  -4.710  -4.779
  396    HE3  TRP  49           HE3      TRP  49  -0.240  -2.987  -1.378
  397    HZ2  TRP  49           HZ2      TRP  49   1.988  -2.572  -5.804
  398    HZ3  TRP  49           HZ3      TRP  49  -0.954  -1.290  -3.005
  399    HH2  TRP  49           HH2      TRP  49   0.141  -1.089  -5.177
  400    H    TRP  50           H        TRP  50  -0.548  -7.256   0.305
  401    HA   TRP  50           HA       TRP  50  -0.268  -7.262   3.087
  402   1HB   TRP  50          2HB       TRP  50  -2.404  -7.042   1.791
  403   2HB   TRP  50          1HB       TRP  50  -2.323  -8.765   1.451
  404    HD1  TRP  50           HD1      TRP  50  -3.094 -10.418   3.353
  405    HE1  TRP  50           HE1      TRP  50  -4.252 -10.074   5.628
  406    HE3  TRP  50           HE3      TRP  50  -2.486  -5.365   3.799
  407    HZ2  TRP  50           HZ2      TRP  50  -4.824  -7.931   7.378
  408    HZ3  TRP  50           HZ3      TRP  50  -3.370  -4.242   5.801
  409    HH2  TRP  50           HH2      TRP  50  -4.516  -5.500   7.553
  410    H    GLU  51           H        GLU  51  -0.398  -9.963   0.783
  411    HA   GLU  51           HA       GLU  51  -0.022 -12.031   2.633
  412   1HB   GLU  51          2HB       GLU  51   0.220 -11.698  -0.312
  413   2HB   GLU  51          1HB       GLU  51   0.912 -13.135   0.401
  414   1HG   GLU  51          2HG       GLU  51  -1.275 -13.648   1.422
  415   2HG   GLU  51          1HG       GLU  51  -1.945 -12.230   0.619
  416    H    GLU  52           H        GLU  52   2.350 -10.251   0.656
  417    HA   GLU  52           HA       GLU  52   4.605 -11.631   1.599
  418   1HB   GLU  52          2HB       GLU  52   4.242  -8.880   0.451
  419   2HB   GLU  52          1HB       GLU  52   5.814  -9.441   1.005
  420   1HG   GLU  52          2HG       GLU  52   5.582 -11.384  -0.530
  421   2HG   GLU  52          1HG       GLU  52   4.120 -10.639  -1.166
  422    H    LEU  53           H        LEU  53   2.838  -8.861   2.876
  423    HA   LEU  53           HA       LEU  53   4.630  -8.206   4.946
  424   1HB   LEU  53          2HB       LEU  53   2.785  -6.753   4.190
  425   2HB   LEU  53          1HB       LEU  53   1.624  -7.887   4.855
  426    HG   LEU  53           HG       LEU  53   2.605  -7.460   7.113
  427   1HD1  LEU  53          1HD1      LEU  53   3.984  -5.462   7.413
  428   2HD1  LEU  53          2HD1      LEU  53   4.063  -5.257   5.663
  429   3HD1  LEU  53          3HD1      LEU  53   4.796  -6.672   6.418
  430   1HD2  LEU  53          1HD2      LEU  53   1.487  -5.077   5.638
  431   2HD2  LEU  53          2HD2      LEU  53   1.525  -5.271   7.391
  432   3HD2  LEU  53          3HD2      LEU  53   0.556  -6.364   6.402
  433    H    GLN  54           H        GLN  54   1.915 -10.488   4.789
  434    HA   GLN  54           HA       GLN  54   1.997 -11.277   7.499
  435   1HB   GLN  54          2HB       GLN  54   1.102 -12.892   5.108
  436   2HB   GLN  54          1HB       GLN  54   0.684 -13.196   6.777
  437   1HG   GLN  54          2HG       GLN  54  -0.194 -10.895   5.066
  438   2HG   GLN  54          1HG       GLN  54  -1.189 -12.199   5.708
  439   1HE2  GLN  54          1HE2      GLN  54   0.369  -9.204   6.355
  440   2HE2  GLN  54          2HE2      GLN  54  -0.305  -8.930   7.929
  441    H    LYS  55           H        LYS  55   3.612 -12.342   4.593
  442    HA   LYS  55           HA       LYS  55   4.969 -14.554   5.900
  443   1HB   LYS  55          2HB       LYS  55   4.095 -14.560   3.530
  444   2HB   LYS  55          1HB       LYS  55   5.395 -13.448   3.130
  445   1HG   LYS  55          2HG       LYS  55   7.010 -15.173   3.920
  446   2HG   LYS  55          1HG       LYS  55   5.649 -16.283   4.096
  447   1HD   LYS  55          2HD       LYS  55   5.128 -16.085   1.745
  448   2HD   LYS  55          1HD       LYS  55   6.393 -14.874   1.541
  449   1HE   LYS  55          2HE       LYS  55   8.078 -16.550   2.157
  450   2HE   LYS  55          1HE       LYS  55   6.801 -17.755   2.322
  451   1HZ   LYS  55          1HZ       LYS  55   6.293 -17.553   0.006
  452   2HZ   LYS  55          2HZ       LYS  55   7.958 -17.844   0.161
  453   3HZ   LYS  55          3HZ       LYS  55   7.397 -16.280  -0.184
  454    H    ASN  56           H        ASN  56   5.414 -11.399   6.181
  455    HA   ASN  56           HA       ASN  56   8.309 -11.368   5.732
  456   1HB   ASN  56          2HB       ASN  56   7.157  -9.528   4.706
  457   2HB   ASN  56          1HB       ASN  56   6.296  -9.160   6.189
  458   1HD2  ASN  56          1HD2      ASN  56   7.209  -7.857   7.641
  459   2HD2  ASN  56          2HD2      ASN  56   8.758  -7.129   7.457
  460    HA   PRO  57           HA       PRO  57   9.209 -11.696  10.102
  461   1HB   PRO  57          2HB       PRO  57  11.629 -10.375  10.007
  462   2HB   PRO  57          1HB       PRO  57  11.407 -12.087   9.632
  463   1HG   PRO  57          2HG       PRO  57  11.621  -9.752   7.777
  464   2HG   PRO  57          1HG       PRO  57  12.309 -11.379   7.619
  465   1HD   PRO  57          2HD       PRO  57  10.114 -10.639   6.263
  466   2HD   PRO  57          1HD       PRO  57  10.313 -12.291   6.884
  467    HA   PRO  58           HA       PRO  58   7.430  -7.916  11.532
  468   1HB   PRO  58          2HB       PRO  58   8.438  -8.119  14.135
  469   2HB   PRO  58          1HB       PRO  58   6.895  -8.743  13.554
  470   1HG   PRO  58          2HG       PRO  58   9.477 -10.157  13.973
  471   2HG   PRO  58          1HG       PRO  58   7.820 -10.755  14.169
  472   1HD   PRO  58          2HD       PRO  58   9.335 -11.442  12.058
  473   2HD   PRO  58          1HD       PRO  58   7.580 -11.207  11.916
  474    H    TYR  59           H        TYR  59   8.004  -5.856  11.731
  475    HA   TYR  59           HA       TYR  59  10.782  -5.163  11.404
  476   1HB   TYR  59          2HB       TYR  59   8.993  -3.995  10.149
  477   2HB   TYR  59          1HB       TYR  59   8.334  -3.394  11.665
  478    HD1  TYR  59           HD1      TYR  59  11.309  -3.246   9.454
  479    HD2  TYR  59           HD2      TYR  59   9.159  -1.408  12.627
  480    HE1  TYR  59           HE1      TYR  59  12.749  -1.262   9.269
  481    HE2  TYR  59           HE2      TYR  59  10.593   0.584  12.456
  482    HH   TYR  59           HH       TYR  59  12.850   1.176  11.633
  483    H    GLU  60           H        GLU  60  12.130  -4.695  13.017
  484    HA   GLU  60           HA       GLU  60  11.443  -4.813  15.721
  485   1HB   GLU  60          2HB       GLU  60  13.730  -5.142  14.930
  486   2HB   GLU  60          1HB       GLU  60  13.812  -3.463  14.411
  487   1HG   GLU  60          2HG       GLU  60  13.576  -2.744  16.742
  488   2HG   GLU  60          1HG       GLU  60  13.532  -4.433  17.249