*HEADER    PROTEIN BINDING                         19-DEC-00   1GHH              
*TITLE     SOLUTION STRUCTURE OF DINI                                            
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: DNA-DAMAGE-INDUCIBLE PROTEIN I;                            
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: DINI;                                                       
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI;                               
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: PET21A                                    
*KEYWDS    BICELLE, DINI, DIPOLAR COUPLING, LIQUID CRYSTAL, NMR, PF1,            
*KEYWDS   2 RECA                                                                 
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    B.E.RAMIREZ, O.N.VOLOSHIN, R.D.CAMERINI-OTERO, A.BAX                  
*REVDAT   1   10-JAN-01 1GHH    0                                                



! DinI NOE restraint table

assign ((resid   2 and name   HB2) or 
        (resid   2 and name   HB1))   ((resid   2 and name    HA))    2.69  0.67  0.67
assign ((resid   2 and name   HB2) or 
        (resid   2 and name   HB1))   ((resid   2 and name    HN))    2.89  0.72  0.72
assign ((resid   2 and name   HB1) or 
        (resid   2 and name   HB2))   ((resid   2 and name    HA))    2.75  0.69  0.69
assign ((resid   2 and name   HB1) or 
        (resid   2 and name   HB2))   ((resid   2 and name    HN))    2.99  0.75  0.75
assign ((resid  13 and name    HA))   ((resid  13 and name    HN))    2.95  0.74  0.74
assign ((resid  13 and name    HA))   ((resid  14 and name   HD2) or 
                                       (resid  14 and name   HD1))    2.35  0.59  0.59
assign ((resid  13 and name    HA))   ((resid  14 and name   HD1) or 
                                       (resid  14 and name   HD2))    1.97  0.49  0.49
assign ((resid   9 and name   HB1) or 
        (resid   9 and name   HB2))   ((resid   9 and name   HD1) or 
                                       (resid   9 and name   HD2))    2.81  0.70  0.70
assign ((resid   9 and name   HB1) or 
        (resid   9 and name   HB2))   ((resid   9 and name    HA))    2.62  0.65  0.65
assign ((resid   9 and name   HB1) or 
        (resid   9 and name   HB2))   ((resid   9 and name    HN))    2.82  0.70  0.70
assign ((resid   9 and name   HB1) or 
        (resid   9 and name   HB2))   ((resid  44 and name   HB1) or 
                                       (resid  44 and name   HB2))    3.46  0.86  0.86
assign ((resid  29 and name  HD1#))   ((resid  29 and name    HN))    3.87  0.97  0.97
assign ((resid  29 and name  HD1#))   ((resid  29 and name    HB))    3.19  0.80  0.80
assign ((resid  29 and name  HD1#))   ((resid  29 and name    HA))    2.86  0.72  0.72
assign ((resid   7 and name  HD1#))   ((resid  13 and name    HG))    3.55  0.89  0.89
assign ((resid   7 and name  HD1#))   ((resid   7 and name    HN))    3.94  0.99  0.99
assign ((resid   7 and name  HD1#))   ((resid  18 and name  HD1#))    2.97  0.74  0.74
assign ((resid   7 and name  HD1#))   ((resid   7 and name    HA))    3.14  0.78  0.78
assign ((resid   7 and name  HD1#))   ((resid   7 and name    HB))    2.98  0.74  0.74
assign ((resid  57 and name   HB2) or 
        (resid  57 and name   HB1))   ((resid  56 and name    HB))    3.37  0.84  0.84
assign ((resid  57 and name   HB1) or 
        (resid  57 and name   HB2))   ((resid  57 and name    HN))    3.02  0.75  0.75
assign ((resid  57 and name   HB2) or 
        (resid  57 and name   HB1))   ((resid  57 and name    HA))    2.61  0.65  0.65
assign ((resid  57 and name   HB1) or 
        (resid  57 and name   HB2))   ((resid  57 and name    HA))    2.50  0.63  0.63
assign ((resid  57 and name   HB1) or 
        (resid  57 and name   HB2))   ((resid  56 and name    HB))    3.42  0.85  0.85
assign ((resid   8 and name    HA))   ((resid   8 and name    HN))    2.58  0.64  0.64
assign ((resid   8 and name    HA))   ((resid   9 and name    HN))    1.81  0.45  0.45
assign ((resid   8 and name    HA))   ((resid   8 and name   HB#))    1.96  0.49  0.49
assign ((resid   8 and name    HA))   ((resid   9 and name   HB1) or 
                                       (resid   9 and name   HB2))    3.05  0.76  0.76
assign ((resid   8 and name    HA))   ((resid  47 and name    HA))    2.93  0.73  0.73
assign ((resid   8 and name    HA))   ((resid  47 and name    HN))    3.39  0.85  0.85
assign ((resid  57 and name   HB2) or 
        (resid  57 and name   HB1))   ((resid  58 and name    HN))    2.91  0.73  0.73
assign ((resid  48 and name    HA))   ((resid   8 and name    HN))    2.90  0.72  0.72
assign ((resid  48 and name    HA))   ((resid  48 and name   HB1) or 
                                       (resid  48 and name   HB2))    2.65  0.66  0.66
assign ((resid  48 and name    HA))   ((resid  49 and name    HN))    1.95  0.49  0.49
assign ((resid  48 and name    HA))   ((resid  48 and name   HB2) or 
                                       (resid  48 and name   HB1))    2.38  0.60  0.60
assign ((resid  48 and name    HA))   ((resid   7 and name    HA))    2.30  0.58  0.58
assign ((resid  48 and name    HA))   ((resid  48 and name    HN))    2.79  0.70  0.70
assign ((resid   4 and name   HB2) or 
        (resid   4 and name   HB1))   ((resid  51 and name   HB2) or 
                                       (resid  51 and name   HB1))    2.79  0.70  0.70
assign ((resid   4 and name   HB1) or 
        (resid   4 and name   HB2))   ((resid  51 and name   HB2) or 
                                       (resid  51 and name   HB1))    3.02  0.76  0.76
assign ((resid  56 and name    HB))   ((resid  56 and name    HA))    2.01  0.50  0.50
assign ((resid  56 and name    HB))   ((resid  56 and name  HG2#))    1.90  0.48  0.48
assign ((resid  45 and name    HA))   ((resid  45 and name   HB#))    1.93  0.48  0.48
assign ((resid  45 and name    HA))   ((resid  45 and name    HN))    2.78  0.69  0.69
assign ((resid  12 and name   HB1) or 
        (resid  12 and name   HB2))   ((resid  13 and name    HN))    3.36  0.84  0.84
assign ((resid  12 and name   HB1) or 
        (resid  12 and name   HB2))   ((resid  12 and name    HA))    2.56  0.64  0.64
assign ((resid  18 and name  HD1#))   ((resid   7 and name    HB))    3.42  0.86  0.86
assign ((resid  18 and name  HD1#))   ((resid  18 and name    HB))    3.06  0.76  0.76
assign ((resid  18 and name  HD1#))   ((resid  18 and name    HA))    2.97  0.74  0.74
assign ((resid  39 and name   HB1) or 
        (resid  39 and name   HB2))   ((resid  39 and name    HA))    2.44  0.61  0.61
assign ((resid  39 and name   HB1) or 
        (resid  39 and name   HB2))   ((resid  39 and name    HN))    2.86  0.71  0.71
assign ((resid   6 and name    HB))   ((resid   7 and name    HN))    2.46  0.62  0.62
assign ((resid   6 and name    HB))   ((resid  45 and name   HB#))    1.99  0.50  0.50
assign ((resid   6 and name    HB))   ((resid   6 and name  HG2#))    1.90  0.47  0.47
assign ((resid   6 and name    HB))   ((resid   6 and name    HA))    2.08  0.52  0.52
assign ((resid  28 and name   HB2) or 
        (resid  28 and name   HB1))   ((resid  28 and name    HA))    2.37  0.59  0.59
assign ((resid  28 and name   HB1) or 
        (resid  28 and name   HB2))   ((resid  28 and name    HA))    2.35  0.59  0.59
assign ((resid  63 and name  HG12) or 
        (resid  63 and name  HG11))   ((resid  63 and name    HA))    2.67  0.67  0.67
assign ((resid  63 and name  HG11) or 
        (resid  63 and name  HG12))   ((resid  63 and name    HN))    3.18  0.79  0.79
assign ((resid  14 and name   HD1) or 
        (resid  14 and name   HD2))   ((resid  13 and name  HD2#) or 
                                       (resid  13 and name  HD1#))    3.13  0.78  0.78
assign ((resid  14 and name   HD1) or 
        (resid  14 and name   HD2))   ((resid  17 and name   HB#))    2.91  0.73  0.73
assign ((resid  63 and name  HG12) or 
        (resid  63 and name  HG11))   ((resid  63 and name    HN))    2.53  0.63  0.63
assign ((resid  63 and name  HG11) or 
        (resid  63 and name  HG12))   ((resid  63 and name    HA))    3.13  0.78  0.78
assign ((resid  27 and name   HB2) or 
        (resid  27 and name   HB1))   ((resid  28 and name    HN))    3.15  0.79  0.79
assign ((resid  27 and name   HB1) or 
        (resid  27 and name   HB2))   ((resid  28 and name    HN))    2.90  0.73  0.73
assign ((resid  14 and name   HD2) or 
        (resid  14 and name   HD1))   ((resid  13 and name  HD2#) or 
                                       (resid  13 and name  HD1#))    2.96  0.74  0.74
assign ((resid  14 and name   HD1) or 
        (resid  14 and name   HD2))   ((resid  13 and name    HA))    2.04  0.51  0.51
assign ((resid  14 and name   HD2) or 
        (resid  14 and name   HD1))   ((resid  17 and name   HB#))    2.52  0.63  0.63
assign ((resid  14 and name   HD2) or 
        (resid  14 and name   HD1))   ((resid  13 and name    HA))    2.15  0.54  0.54
assign ((resid  14 and name   HD1) or 
        (resid  14 and name   HD2))   ((resid  13 and name   HB2) or 
                                       (resid  13 and name   HB1))    2.42  0.61  0.61
assign ((resid  14 and name   HD2) or 
        (resid  14 and name   HD1))   ((resid  13 and name   HB2) or 
                                       (resid  13 and name   HB1))    2.41  0.60  0.60
assign ((resid  12 and name   HD1) or 
        (resid  12 and name   HD2))   ((resid  11 and name    HA))    2.30  0.57  0.57
assign ((resid   1 and name   HG1) or 
        (resid   1 and name   HG2))   ((resid   1 and name   HE#))    2.97  0.74  0.74
assign ((resid   1 and name   HG2) or 
        (resid   1 and name   HG1))   ((resid   1 and name   HE#))    3.00  0.75  0.75
assign ((resid  47 and name    HA))   ((resid  48 and name    HN))    2.01  0.50  0.50
assign ((resid  47 and name    HA))   ((resid   8 and name    HA))    2.93  0.73  0.73
assign ((resid  47 and name    HA))   ((resid  47 and name   HB#))    1.72  0.43  0.43
assign ((resid  47 and name    HA))   ((resid  47 and name    HN))    2.73  0.68  0.68
assign ((resid  37 and name   HB1) or 
        (resid  37 and name   HB2))   ((resid  37 and name    HA))    2.87  0.72  0.72
assign ((resid  34 and name   HD2) or 
        (resid  34 and name   HD1))   ((resid  33 and name    HA))    2.32  0.58  0.58
assign ((resid  34 and name   HD1) or 
        (resid  34 and name   HD2))   ((resid  33 and name    HA))    2.22  0.56  0.56
assign ((resid  34 and name   HD2) or 
        (resid  34 and name   HD1))   ((resid  33 and name    HN))    3.31  0.83  0.83
assign ((resid  34 and name   HD1) or 
        (resid  34 and name   HD2))   ((resid  33 and name    HN))    3.27  0.82  0.82
assign ((resid  62 and name   HB2) or 
        (resid  62 and name   HB1))   ((resid  62 and name    HN))    2.40  0.60  0.60
assign ((resid  62 and name   HB1) or 
        (resid  62 and name   HB2))   ((resid  63 and name    HN))    2.95  0.74  0.74
assign ((resid  62 and name   HB1) or 
        (resid  62 and name   HB2))   ((resid  62 and name    HN))    2.40  0.60  0.60
assign ((resid  62 and name   HB2) or 
        (resid  62 and name   HB1))   ((resid  62 and name    HA))    2.57  0.64  0.64
assign ((resid  62 and name   HB2) or 
        (resid  62 and name   HB1))   ((resid  59 and name    HA))    2.95  0.74  0.74
assign ((resid  62 and name   HB2) or 
        (resid  62 and name   HB1))   ((resid  63 and name    HN))    3.00  0.75  0.75
assign ((resid  62 and name   HB1) or 
        (resid  62 and name   HB2))   ((resid  59 and name    HA))    2.91  0.73  0.73
assign ((resid  62 and name   HB1) or 
        (resid  62 and name   HB2))   ((resid  62 and name    HA))    2.51  0.63  0.63
assign ((resid  55 and name    HA))   ((resid  55 and name    HN))    2.97  0.74  0.74
assign ((resid  55 and name    HA))   ((resid  56 and name    HN))    2.04  0.51  0.51
assign ((resid  55 and name    HA))   ((resid  55 and name   HB#))    1.91  0.48  0.48
assign ((resid  69 and name   HB2) or 
        (resid  69 and name   HB1))   ((resid  69 and name    HA))    2.42  0.61  0.61
assign ((resid  69 and name   HB2) or 
        (resid  69 and name   HB1))   ((resid  69 and name    HN))    2.67  0.67  0.67
assign ((resid  72 and name   HB1) or 
        (resid  72 and name   HB2))   ((resid  69 and name    HA))    2.91  0.73  0.73
assign ((resid  72 and name   HB1) or 
        (resid  72 and name   HB2))   ((resid  72 and name    HN))    2.51  0.63  0.63
assign ((resid  72 and name   HB1) or 
        (resid  72 and name   HB2))   ((resid  72 and name    HA))    2.48  0.62  0.62
assign ((resid   3 and name  HG12) or 
        (resid   3 and name  HG11))   ((resid  63 and name  HD1#))    2.79  0.70  0.70
assign ((resid   3 and name  HG11) or 
        (resid   3 and name  HG12))   ((resid   3 and name    HA))    2.65  0.66  0.66
assign ((resid   3 and name  HG12) or 
        (resid   3 and name  HG11))   ((resid   3 and name    HA))    2.93  0.73  0.73
assign ((resid  65 and name   HB1) or 
        (resid  65 and name   HB2))   ((resid  62 and name    HA))    2.81  0.70  0.70
assign ((resid  65 and name   HB2) or 
        (resid  65 and name   HB1))   ((resid  65 and name    HN))    2.72  0.68  0.68
assign ((resid  65 and name   HB2) or 
        (resid  65 and name   HB1))   ((resid  62 and name    HA))    2.90  0.72  0.72
assign ((resid  65 and name   HB1) or 
        (resid  65 and name   HB2))   ((resid  66 and name    HN))    2.93  0.73  0.73
assign ((resid  65 and name   HB1) or 
        (resid  65 and name   HB2))   ((resid  65 and name    HA))    2.57  0.64  0.64
assign ((resid  65 and name   HB2) or 
        (resid  65 and name   HB1))   ((resid  65 and name    HA))    2.40  0.60  0.60
assign ((resid  65 and name   HB1) or 
        (resid  65 and name   HB2))   ((resid  65 and name    HN))    2.41  0.60  0.60
assign ((resid  66 and name  HG12) or 
        (resid  66 and name  HG11))   ((resid  66 and name    HA))    2.31  0.58  0.58
assign ((resid  66 and name  HG11) or 
        (resid  66 and name  HG12))   ((resid  66 and name    HA))    2.44  0.61  0.61
assign ((resid  66 and name  HG11) or 
        (resid  66 and name  HG12))   ((resid  66 and name    HN))    2.33  0.58  0.58
assign ((resid  66 and name  HG12) or 
        (resid  66 and name  HG11))   ((resid  66 and name    HN))    2.43  0.61  0.61
assign ((resid  29 and name  HG12) or 
        (resid  29 and name  HG11))   ((resid  29 and name    HA))    2.73  0.68  0.68
assign ((resid  29 and name  HG11) or 
        (resid  29 and name  HG12))   ((resid  29 and name    HA))    2.88  0.72  0.72
assign ((resid  29 and name  HG12) or 
        (resid  29 and name  HG11))   ((resid  29 and name    HN))    2.74  0.69  0.69
assign ((resid  29 and name  HG11) or 
        (resid  29 and name  HG12))   ((resid  29 and name    HN))    2.67  0.67  0.67
assign ((resid  10 and name    HB))   ((resid  10 and name    HA))    2.25  0.56  0.56
assign ((resid  10 and name    HB))   ((resid  10 and name  HG2#))    2.06  0.51  0.51
assign ((resid  58 and name   HB2) or 
        (resid  58 and name   HB1))   ((resid  58 and name    HN))    2.78  0.69  0.69
assign ((resid  58 and name   HB1) or 
        (resid  58 and name   HB2))   ((resid  58 and name    HN))    2.55  0.64  0.64
assign ((resid  58 and name   HB1) or 
        (resid  58 and name   HB2))   ((resid  59 and name    HN))    2.84  0.71  0.71
assign ((resid  58 and name   HB2) or 
        (resid  58 and name   HB1))   ((resid  59 and name    HN))    3.22  0.81  0.81
assign ((resid  18 and name  HG11) or 
        (resid  18 and name  HG12))   ((resid  18 and name    HB))    2.68  0.67  0.67
assign ((resid  18 and name  HG12) or 
        (resid  18 and name  HG11))   ((resid  18 and name    HN))    2.92  0.73  0.73
assign ((resid  18 and name  HG11) or 
        (resid  18 and name  HG12))   ((resid  18 and name    HN))    2.93  0.73  0.73
assign ((resid  18 and name  HG12) or 
        (resid  18 and name  HG11))   ((resid  18 and name    HB))    2.61  0.65  0.65
assign ((resid  70 and name    HA))   ((resid  70 and name    HN))    2.33  0.58  0.58
assign ((resid  70 and name    HA))   ((resid  70 and name  HG2#))    2.00  0.50  0.50
assign ((resid  70 and name    HA))   ((resid  70 and name    HB))    2.07  0.52  0.52
assign ((resid  30 and name   HB1) or 
        (resid  30 and name   HB2))   ((resid  31 and name    HN))    2.91  0.73  0.73
assign ((resid  30 and name   HB1) or 
        (resid  30 and name   HB2))   ((resid  30 and name    HN))    2.36  0.59  0.59
assign ((resid  30 and name   HB2) or 
        (resid  30 and name   HB1))   ((resid  31 and name    HN))    2.92  0.73  0.73
assign ((resid  30 and name   HB1) or 
        (resid  30 and name   HB2))   ((resid  27 and name    HA))    3.16  0.79  0.79
assign ((resid  30 and name   HB1) or 
        (resid  30 and name   HB2))   ((resid  30 and name    HA))    2.44  0.61  0.61
assign ((resid  30 and name   HB2) or 
        (resid  30 and name   HB1))   ((resid  30 and name    HN))    2.43  0.61  0.61
assign ((resid  30 and name   HB2) or 
        (resid  30 and name   HB1))   ((resid  30 and name    HA))    2.49  0.62  0.62
assign ((resid  30 and name   HB2) or 
        (resid  30 and name   HB1))   ((resid  27 and name    HA))    3.13  0.78  0.78
assign ((resid  70 and name    HB))   ((resid  70 and name  HG2#))    2.01  0.50  0.50
assign ((resid  70 and name    HB))   ((resid  70 and name    HN))    2.11  0.53  0.53
assign ((resid  68 and name   HB1) or 
        (resid  68 and name   HB2))   ((resid  69 and name    HN))    2.77  0.69  0.69
assign ((resid  68 and name   HB2) or 
        (resid  68 and name   HB1))   ((resid  69 and name    HN))    2.95  0.74  0.74
assign ((resid  68 and name   HB2) or 
        (resid  68 and name   HB1))   ((resid  68 and name    HN))    2.42  0.61  0.61
assign ((resid  68 and name   HB1) or 
        (resid  68 and name   HB2))   ((resid  68 and name    HN))    2.40  0.60  0.60
assign ((resid  14 and name   HG2) or 
        (resid  14 and name   HG1))   ((resid  17 and name   HB#))    3.10  0.78  0.78
assign ((resid  14 and name   HG1) or 
        (resid  14 and name   HG2))   ((resid  17 and name   HB#))    3.23  0.81  0.81
assign ((resid  50 and name    HG))   ((resid  50 and name    HA))    3.00  0.75  0.75
assign ((resid  53 and name  HG12) or 
        (resid  53 and name  HG11))   ((resid  53 and name    HN))    3.38  0.85  0.85
assign ((resid  53 and name  HG12) or 
        (resid  53 and name  HG11))   ((resid  53 and name    HA))    3.41  0.85  0.85
assign ((resid  53 and name  HG11) or 
        (resid  53 and name  HG12))   ((resid  53 and name    HN))    3.61  0.90  0.90
assign ((resid  53 and name  HG11) or 
        (resid  53 and name  HG12))   ((resid  53 and name    HA))    3.36  0.84  0.84
assign ((resid   2 and name   HG2) or 
        (resid   2 and name   HG1))   ((resid   2 and name    HA))    3.00  0.75  0.75
assign ((resid   2 and name   HG1) or 
        (resid   2 and name   HG2))   ((resid   2 and name    HA))    3.10  0.78  0.78
assign ((resid  67 and name    HG))   ((resid  67 and name    HN))    3.19  0.80  0.80
assign ((resid  67 and name    HG))   ((resid  67 and name    HA))    2.85  0.71  0.71
assign ((resid  61 and name   HB1) or 
        (resid  61 and name   HB2))   ((resid  61 and name    HN))    2.32  0.58  0.58
assign ((resid  61 and name   HB2) or 
        (resid  61 and name   HB1))   ((resid  61 and name    HA))    2.38  0.60  0.60
assign ((resid  61 and name   HB2) or 
        (resid  61 and name   HB1))   ((resid  62 and name    HN))    2.34  0.58  0.58
assign ((resid  61 and name   HB1) or 
        (resid  61 and name   HB2))   ((resid  61 and name    HA))    2.27  0.57  0.57
assign ((resid   7 and name  HG12) or 
        (resid   7 and name  HG11))   ((resid   7 and name    HN))    3.33  0.83  0.83
assign ((resid   7 and name  HG11) or 
        (resid   7 and name  HG12))   ((resid   7 and name    HA))    3.02  0.75  0.75
assign ((resid   7 and name  HG12) or 
        (resid   7 and name  HG11))   ((resid   7 and name    HA))    3.00  0.75  0.75
assign ((resid   7 and name  HG11) or 
        (resid   7 and name  HG12))   ((resid   7 and name    HN))    3.33  0.83  0.83
assign ((resid  13 and name    HG))   ((resid   7 and name  HD1#))    3.75  0.94  0.94
assign ((resid  21 and name    HG))   ((resid  21 and name    HN))    3.08  0.77  0.77
assign ((resid  21 and name    HG))   ((resid  22 and name    HN))    3.27  0.82  0.82
assign ((resid  21 and name    HG))   ((resid  21 and name    HA))    2.84  0.71  0.71
assign ((resid  13 and name    HG))   ((resid  13 and name    HA))    2.97  0.74  0.74
assign ((resid  13 and name    HG))   ((resid  12 and name    HA))    3.50  0.88  0.88
assign ((resid  13 and name    HG))   ((resid  13 and name    HN))    2.66  0.67  0.67
assign ((resid  23 and name   HA1) or 
        (resid  23 and name   HA2))   ((resid  24 and name    HN))    2.83  0.71  0.71
assign ((resid  23 and name   HA2) or 
        (resid  23 and name   HA1))   ((resid  23 and name    HN))    2.15  0.54  0.54
assign ((resid  23 and name   HA2) or 
        (resid  23 and name   HA1))   ((resid  24 and name    HN))    2.72  0.68  0.68
assign ((resid  23 and name   HA1) or 
        (resid  23 and name   HA2))   ((resid  23 and name    HN))    2.12  0.53  0.53
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        (resid  62 and name   HG1))   ((resid  66 and name  HD1#))    2.93  0.73  0.73
assign ((resid  62 and name   HG1) or 
        (resid  62 and name   HG2))   ((resid  62 and name    HN))    3.17  0.79  0.79
assign ((resid  62 and name   HG1) or 
        (resid  62 and name   HG2))   ((resid  66 and name  HD1#))    3.09  0.77  0.77
assign ((resid  62 and name   HG2) or 
        (resid  62 and name   HG1))   ((resid  62 and name    HN))    3.37  0.84  0.84
assign ((resid  62 and name   HG1) or 
        (resid  62 and name   HG2))   ((resid  62 and name    HA))    3.35  0.84  0.84
assign ((resid  62 and name   HG2) or 
        (resid  62 and name   HG1))   ((resid  62 and name    HA))    3.34  0.83  0.83
assign ((resid  25 and name    HG))   ((resid  25 and name    HA))    2.93  0.73  0.73
assign ((resid  25 and name    HG))   ((resid  21 and name  HD1#) or 
                                       (resid  21 and name  HD2#))    2.36  0.59  0.59
assign ((resid  67 and name  HD1#) or 
        (resid  67 and name  HD2#))   ((resid  67 and name    HA))    3.56  0.89  0.89
assign ((resid  60 and name   HG2) or 
        (resid  60 and name   HG1))   ((resid  52 and name  HG1#))    3.18  0.80  0.80
assign ((resid  21 and name  HD1#) or 
        (resid  21 and name  HD2#))   ((resid   7 and name  HD1#))    2.82  0.70  0.70
assign ((resid  13 and name  HD1#) or 
        (resid  13 and name  HD2#))   ((resid  18 and name  HD1#))    3.16  0.79  0.79
assign ((resid  63 and name    HA))   ((resid  63 and name    HN))    2.62  0.65  0.65
assign ((resid  63 and name    HA))   ((resid  66 and name    HN))    3.13  0.78  0.78
assign ((resid  63 and name    HA))   ((resid  63 and name    HB))    2.11  0.53  0.53
assign ((resid  63 and name    HA))   ((resid  64 and name    HN))    3.24  0.81  0.81
assign ((resid  63 and name    HA))   ((resid  63 and name  HG2#))    2.01  0.50  0.50
assign ((resid  63 and name    HA))   ((resid  63 and name  HD1#))    3.13  0.78  0.78
assign ((resid  41 and name   HB1) or 
        (resid  41 and name   HB2))   ((resid  42 and name    HN))    3.17  0.79  0.79
assign ((resid  41 and name   HB2) or 
        (resid  41 and name   HB1))   ((resid  41 and name    HN))    2.99  0.75  0.75
assign ((resid  41 and name   HB1) or 
        (resid  41 and name   HB2))   ((resid  41 and name    HA))    2.31  0.58  0.58
assign ((resid  41 and name   HB2) or 
        (resid  41 and name   HB1))   ((resid   4 and name    HA))    3.20  0.80  0.80
assign ((resid  38 and name   HA1) or 
        (resid  38 and name   HA2))   ((resid  40 and name  HG2#))    3.38  0.84  0.84
assign ((resid  38 and name   HA2) or 
        (resid  38 and name   HA1))   ((resid  38 and name    HN))    2.45  0.61  0.61
assign ((resid  38 and name   HA2) or 
        (resid  38 and name   HA1))   ((resid  39 and name    HN))    2.57  0.64  0.64
assign ((resid  38 and name   HA1) or 
        (resid  38 and name   HA2))   ((resid  39 and name    HN))    2.68  0.67  0.67
assign ((resid  38 and name   HA1) or 
        (resid  38 and name   HA2))   ((resid  38 and name    HN))    2.78  0.69  0.69
assign ((resid  38 and name   HA2) or 
        (resid  38 and name   HA1))   ((resid  40 and name  HG2#))    2.83  0.71  0.71
assign ((resid  66 and name    HA))   ((resid  66 and name    HN))    2.58  0.64  0.64
assign ((resid  66 and name    HA))   ((resid  67 and name    HN))    3.26  0.81  0.81
assign ((resid  66 and name    HA))   ((resid  69 and name   HB1) or 
                                       (resid  69 and name   HB2))    2.52  0.63  0.63
assign ((resid   9 and name   HG2) or 
        (resid   9 and name   HG1))   ((resid   9 and name    HA))    3.67  0.92  0.92
assign ((resid   9 and name   HG1) or 
        (resid   9 and name   HG2))   ((resid   9 and name   HB1) or 
                                       (resid   9 and name   HB2))    2.60  0.65  0.65
assign ((resid   9 and name   HG1) or 
        (resid   9 and name   HG2))   ((resid   9 and name    HN))    3.29  0.82  0.82
assign ((resid   9 and name   HG2) or 
        (resid   9 and name   HG1))   ((resid   9 and name    HN))    3.52  0.88  0.88
assign ((resid   9 and name   HG1) or 
        (resid   9 and name   HG2))   ((resid   9 and name    HA))    3.53  0.88  0.88
assign ((resid   9 and name   HG2) or 
        (resid   9 and name   HG1))   ((resid   9 and name   HB1) or 
                                       (resid   9 and name   HB2))    2.60  0.65  0.65
assign ((resid  25 and name  HD1#) or 
        (resid  25 and name  HD2#))   ((resid  67 and name    HA))    3.45  0.86  0.86
assign ((resid  25 and name  HD1#) or 
        (resid  25 and name  HD2#))   ((resid  25 and name    HA))    3.01  0.75  0.75
assign ((resid  25 and name  HD1#) or 
        (resid  25 and name  HD2#))   ((resid  21 and name    HG))    2.87  0.72  0.72
assign ((resid  25 and name  HD1#) or 
        (resid  25 and name  HD2#))   ((resid  22 and name    HA))    3.85  0.96  0.96
assign ((resid  57 and name   HG2) or 
        (resid  57 and name   HG1))   ((resid  57 and name    HA))    3.69  0.92  0.92
assign ((resid  57 and name   HG1) or 
        (resid  57 and name   HG2))   ((resid  57 and name    HA))    3.49  0.87  0.87
assign ((resid  51 and name   HB2) or 
        (resid  51 and name   HB1))   ((resid  51 and name    HN))    2.97  0.74  0.74
assign ((resid  51 and name   HB1) or 
        (resid  51 and name   HB2))   ((resid  51 and name    HN))    2.78  0.69  0.69
assign ((resid  51 and name   HB1) or 
        (resid  51 and name   HB2))   ((resid   4 and name   HB2) or 
                                       (resid   4 and name   HB1))    2.72  0.68  0.68
assign ((resid  51 and name   HB2) or 
        (resid  51 and name   HB1))   ((resid   4 and name   HB2) or 
                                       (resid   4 and name   HB1))    2.85  0.71  0.71
assign ((resid  51 and name   HB2) or 
        (resid  51 and name   HB1))   ((resid  51 and name    HA))    2.67  0.67  0.67
assign ((resid  51 and name   HB1) or 
        (resid  51 and name   HB2))   ((resid  51 and name    HA))    2.73  0.68  0.68
assign ((resid  50 and name   HB2) or 
        (resid  50 and name   HB1))   ((resid  50 and name    HN))    2.65  0.66  0.66
assign ((resid  50 and name   HB1) or 
        (resid  50 and name   HB2))   ((resid  50 and name    HA))    4.50  4.50  0.00
assign ((resid  50 and name   HB1) or 
        (resid  50 and name   HB2))   ((resid  50 and name    HN))    4.50  4.50  0.00
assign ((resid  50 and name   HB2) or 
        (resid  50 and name   HB1))   ((resid  50 and name    HA))    2.40  0.60  0.60
assign ((resid  34 and name    HA))   ((resid  35 and name    HN))    2.65  0.66  0.66
assign ((resid  34 and name    HA))   ((resid  36 and name    HN))    3.67  0.92  0.92
assign ((resid  34 and name    HA))   ((resid  30 and name    HA))    3.42  0.86  0.86
assign ((resid  25 and name  HD2#) or 
        (resid  25 and name  HD1#))   ((resid  67 and name    HA))    3.29  0.82  0.82
assign ((resid  25 and name  HD2#) or 
        (resid  25 and name  HD1#))   ((resid  25 and name    HA))    2.92  0.73  0.73
assign ((resid  18 and name    HA))   ((resid  22 and name    HN))    3.68  0.92  0.92
assign ((resid  18 and name    HA))   ((resid  19 and name    HN))    3.70  0.92  0.92
assign ((resid  18 and name    HA))   ((resid  21 and name   HB2) or 
                                       (resid  21 and name   HB1))    3.17  0.79  0.79
assign ((resid  18 and name    HA))   ((resid  18 and name    HB))    2.49  0.62  0.62
assign ((resid  18 and name    HA))   ((resid  18 and name    HN))    2.60  0.65  0.65
assign ((resid  18 and name    HA))   ((resid  18 and name  HG2#))    2.19  0.55  0.55
assign ((resid  18 and name    HA))   ((resid  18 and name  HD1#))    2.65  0.66  0.66
assign ((resid  18 and name    HA))   ((resid  21 and name  HD1#) or 
                                       (resid  21 and name  HD2#))    2.89  0.72  0.72
assign ((resid  18 and name    HA))   ((resid  21 and name   HB1) or 
                                       (resid  21 and name   HB2))    2.71  0.68  0.68
assign ((resid  18 and name    HA))   ((resid  21 and name    HN))    3.48  0.87  0.87
assign ((resid  73 and name   HB1) or 
        (resid  73 and name   HB2))   ((resid  73 and name    HA))    1.96  0.49  0.49
assign ((resid  73 and name   HB2) or 
        (resid  73 and name   HB1))   ((resid  73 and name    HA))    1.96  0.49  0.49
assign ((resid  50 and name  HD2#) or 
        (resid  50 and name  HD1#))   ((resid   5 and name    HA))    3.14  0.78  0.78
assign ((resid  50 and name  HD2#) or 
        (resid  50 and name  HD1#))   ((resid  51 and name    HN))    2.81  0.70  0.70
assign ((resid  50 and name  HD2#) or 
        (resid  50 and name  HD1#))   ((resid  50 and name    HA))    2.56  0.64  0.64
assign ((resid  50 and name  HD2#) or 
        (resid  50 and name  HD1#))   ((resid  50 and name   HB1) or 
                                       (resid  50 and name   HB2))    3.12  0.78  0.78
assign ((resid  80 and name   HB2) or 
        (resid  80 and name   HB1))   ((resid  80 and name    HA))    3.26  0.81  0.81
assign ((resid  80 and name   HB1) or 
        (resid  80 and name   HB2))   ((resid  80 and name    HA))    3.10  0.78  0.78
assign ((resid  80 and name   HB1) or 
        (resid  80 and name   HB2))   ((resid  80 and name    HN))    3.81  0.95  0.95
assign ((resid  80 and name   HB2) or 
        (resid  80 and name   HB1))   ((resid  80 and name    HN))    3.68  0.92  0.92
assign ((resid  11 and name   HB1) or 
        (resid  11 and name   HB2))   ((resid  11 and name    HN))    3.20  0.80  0.80
assign ((resid  11 and name   HB1) or 
        (resid  11 and name   HB2))   ((resid   8 and name   HB#))    3.68  0.92  0.92
assign ((resid  11 and name   HB1) or 
        (resid  11 and name   HB2))   ((resid  11 and name    HA))    2.64  0.66  0.66
assign ((resid  11 and name   HB1) or 
        (resid  11 and name   HB2))   ((resid   7 and name  HG2#))    3.38  0.85  0.85
assign ((resid  29 and name    HA))   ((resid  32 and name   HB#))    2.44  0.61  0.61
assign ((resid  29 and name    HA))   ((resid  29 and name    HN))    2.62  0.66  0.66
assign ((resid  29 and name    HA))   ((resid  29 and name    HB))    2.69  0.67  0.67
assign ((resid  29 and name    HA))   ((resid  30 and name    HN))    3.22  0.81  0.81
assign ((resid  21 and name  HD2#) or 
        (resid  21 and name  HD1#))   ((resid  21 and name    HA))    2.57  0.64  0.64
assign ((resid  13 and name  HD2#) or 
        (resid  13 and name  HD1#))   ((resid  13 and name   HB1) or 
                                       (resid  13 and name   HB2))    3.20  0.80  0.80
assign ((resid  13 and name  HD2#) or 
        (resid  13 and name  HD1#))   ((resid  13 and name    HN))    3.56  0.89  0.89
assign ((resid  13 and name  HD2#) or 
        (resid  13 and name  HD1#))   ((resid  14 and name   HD1) or 
                                       (resid  14 and name   HD2))    3.08  0.77  0.77
assign ((resid  13 and name  HD2#) or 
        (resid  13 and name  HD1#))   ((resid  17 and name   HB#))    2.68  0.67  0.67
assign ((resid  13 and name  HD2#) or 
        (resid  13 and name  HD1#))   ((resid  14 and name   HD2) or 
                                       (resid  14 and name   HD1))    3.18  0.80  0.80
assign ((resid  13 and name  HD2#) or 
        (resid  13 and name  HD1#))   ((resid  13 and name    HG))    2.43  0.61  0.61
assign ((resid  13 and name  HD2#) or 
        (resid  13 and name  HD1#))   ((resid  13 and name    HA))    2.32  0.58  0.58
assign ((resid  13 and name  HD2#) or 
        (resid  13 and name  HD1#))   ((resid  13 and name   HB2) or 
                                       (resid  13 and name   HB1))    2.67  0.67  0.67
assign ((resid  55 and name   HB#))   ((resid  52 and name  HG2#))    3.08  0.77  0.77
assign ((resid  55 and name   HB#))   ((resid  60 and name    HN))    3.50  0.88  0.88
assign ((resid  55 and name   HB#))   ((resid  55 and name    HN))    2.89  0.72  0.72
assign ((resid  55 and name   HB#))   ((resid  59 and name   HB1) or 
                                       (resid  59 and name   HB2))    2.66  0.67  0.67
assign ((resid  55 and name   HB#))   ((resid  56 and name    HN))    2.78  0.70  0.70
assign ((resid  55 and name   HB#))   ((resid  55 and name    HA))    2.33  0.58  0.58
assign ((resid  55 and name   HB#))   ((resid  52 and name  HG1#))    2.24  0.56  0.56
assign ((resid  55 and name   HB#))   ((resid  59 and name   HB2) or 
                                       (resid  59 and name   HB1))    3.01  0.75  0.75
assign ((resid  55 and name   HB#))   ((resid  63 and name  HD1#))    3.47  0.87  0.87
assign ((resid  12 and name    HA))   ((resid  13 and name    HN))    2.06  0.52  0.52
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        (resid  49 and name   HB1))   ((resid  49 and name    HA))    2.52  0.63  0.63
assign ((resid  49 and name   HB1) or 
        (resid  49 and name   HB2))   ((resid  49 and name    HA))    2.62  0.65  0.65
assign ((resid  49 and name   HB2) or 
        (resid  49 and name   HB1))   ((resid  49 and name    HN))    3.19  0.80  0.80
assign ((resid  49 and name   HB1) or 
        (resid  49 and name   HB2))   ((resid  49 and name    HN))    2.94  0.74  0.74
assign ((resid  26 and name    HA))   ((resid  40 and name  HG2#))    4.50  4.50  0.00
assign ((resid  26 and name    HA))   ((resid  26 and name    HN))    4.50  4.50  0.00
assign ((resid  52 and name  HG1#))   ((resid   3 and name  HG12) or 
                                       (resid   3 and name  HG11))    3.16  0.79  0.79
assign ((resid  52 and name  HG1#))   ((resid  52 and name    HB))    2.37  0.59  0.59
assign ((resid  52 and name  HG1#))   ((resid  53 and name    HN))    3.10  0.77  0.77
assign ((resid  52 and name  HG1#))   ((resid  52 and name    HN))    3.77  0.94  0.94
assign ((resid  52 and name  HG1#))   ((resid  52 and name    HA))    2.87  0.72  0.72
assign ((resid  64 and name    HA))   ((resid  64 and name    HN))    4.50  4.50  0.00
assign ((resid  64 and name    HA))   ((resid  65 and name    HN))    4.50  4.50  0.00
assign ((resid  47 and name   HB#))   ((resid  47 and name    HN))    2.60  0.65  0.65
assign ((resid  47 and name   HB#))   ((resid  47 and name    HA))    2.09  0.52  0.52
assign ((resid  47 and name   HB#))   ((resid  48 and name    HN))    2.52  0.63  0.63
assign ((resid  14 and name    HA))   ((resid  15 and name    HN))    2.17  0.54  0.54
assign ((resid  14 and name    HA))   ((resid  15 and name   HB#))    3.07  0.77  0.77
assign ((resid  25 and name   HB1) or 
        (resid  25 and name   HB2))   ((resid  22 and name    HA))    2.99  0.75  0.75
assign ((resid  25 and name   HB1) or 
        (resid  25 and name   HB2))   ((resid  25 and name    HN))    2.35  0.59  0.59
assign ((resid  25 and name   HB1) or 
        (resid  25 and name   HB2))   ((resid  26 and name    HN))    2.80  0.70  0.70
assign ((resid  10 and name  HG2#))   ((resid  10 and name    HB))    2.35  0.59  0.59
assign ((resid  10 and name  HG2#))   ((resid  10 and name    HA))    2.44  0.61  0.61
assign ((resid  10 and name  HG2#))   ((resid  10 and name    HN))    3.19  0.80  0.80
assign ((resid  13 and name   HB2) or 
        (resid  13 and name   HB1))   ((resid  13 and name    HA))    2.47  0.62  0.62
assign ((resid  13 and name   HB1) or 
        (resid  13 and name   HB2))   ((resid  14 and name   HD2) or 
                                       (resid  14 and name   HD1))    2.62  0.65  0.65
assign ((resid  13 and name   HB1) or 
        (resid  13 and name   HB2))   ((resid  17 and name   HB#))    2.43  0.61  0.61
assign ((resid  13 and name   HB1) or 
        (resid  13 and name   HB2))   ((resid  13 and name    HN))    2.57  0.64  0.64
assign ((resid  13 and name   HB1) or 
        (resid  13 and name   HB2))   ((resid  13 and name    HA))    2.56  0.64  0.64
assign ((resid  13 and name   HB2) or 
        (resid  13 and name   HB1))   ((resid  13 and name    HN))    2.76  0.69  0.69
assign ((resid  13 and name   HB2) or 
        (resid  13 and name   HB1))   ((resid  14 and name   HD2) or 
                                       (resid  14 and name   HD1))    2.34  0.59  0.59
assign ((resid  42 and name  HG1#))   ((resid  21 and name   HB1) or 
                                       (resid  21 and name   HB2))    3.76  0.94  0.94
assign ((resid  42 and name  HG1#))   ((resid  42 and name    HA))    2.71  0.68  0.68
assign ((resid  42 and name  HG1#))   ((resid  42 and name    HB))    2.28  0.57  0.57
assign ((resid  42 and name  HG1#))   ((resid  21 and name    HG))    3.29  0.82  0.82
assign ((resid  42 and name  HG1#))   ((resid  18 and name  HD1#))    2.78  0.70  0.70
assign ((resid  42 and name  HG1#))   ((resid  18 and name  HG11) or 
                                       (resid  18 and name  HG12))    2.99  0.75  0.75
assign ((resid  42 and name  HG1#))   ((resid  43 and name    HN))    2.88  0.72  0.72
assign ((resid  42 and name  HG1#))   ((resid   5 and name    HB))    2.90  0.72  0.72
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assign ((resid  56 and name  HG2#))   ((resid  56 and name    HB))    2.14  0.53  0.53
assign ((resid  56 and name  HG2#))   ((resid  56 and name    HA))    2.54  0.64  0.64
assign ((resid  56 and name  HG2#))   ((resid  56 and name    HN))    2.42  0.61  0.61
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assign ((resid  40 and name  HG2#))   ((resid  29 and name    HB))    3.47  0.87  0.87
assign ((resid  40 and name  HG2#))   ((resid  40 and name    HA))    2.72  0.68  0.68
assign ((resid  40 and name  HG2#))   ((resid  40 and name    HB))    2.39  0.60  0.60
assign ((resid  10 and name    HA))   ((resid  11 and name    HN))    3.21  0.80  0.80
assign ((resid  10 and name    HA))   ((resid  10 and name  HG2#))    2.09  0.52  0.52
assign ((resid  10 and name    HA))   ((resid  12 and name   HD1) or 
                                       (resid  12 and name   HD2))    3.20  0.80  0.80
assign ((resid  10 and name    HA))   ((resid  10 and name    HN))    3.12  0.78  0.78
assign ((resid  10 and name    HA))   ((resid  10 and name    HB))    2.24  0.56  0.56
assign ((resid  76 and name   HB1) or 
        (resid  76 and name   HB2))   ((resid  76 and name    HA))    4.50  4.50  0.00
assign ((resid  76 and name   HB2) or 
        (resid  76 and name   HB1))   ((resid  76 and name    HA))    4.50  4.50  0.00
assign ((resid  76 and name   HB1) or 
        (resid  76 and name   HB2))   ((resid  76 and name    HN))    4.50  4.50  0.00
assign ((resid  76 and name   HB2) or 
        (resid  76 and name   HB1))   ((resid  76 and name    HN))    4.50  4.50  0.00
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assign ((resid  40 and name  HG1#))   ((resid  29 and name  HG11) or 
                                       (resid  29 and name  HG12))    3.08  0.77  0.77
assign ((resid  40 and name  HG1#))   ((resid  40 and name    HA))    2.64  0.66  0.66
assign ((resid  40 and name  HG1#))   ((resid  25 and name   HB2) or 
                                       (resid  25 and name   HB1))    2.94  0.73  0.73
assign ((resid  40 and name  HG1#))   ((resid  40 and name    HN))    2.93  0.73  0.73
assign ((resid  40 and name  HG1#))   ((resid  40 and name    HB))    2.37  0.59  0.59
assign ((resid  40 and name  HG1#))   ((resid   3 and name    HB))    3.45  0.86  0.86
assign ((resid   5 and name  HG1#))   ((resid   5 and name    HA))    2.58  0.65  0.65
assign ((resid   5 and name  HG1#))   ((resid   6 and name    HN))    2.86  0.72  0.72
assign ((resid   5 and name  HG1#))   ((resid   7 and name  HD1#))    2.87  0.72  0.72
assign ((resid   5 and name  HG1#))   ((resid   5 and name    HN))    3.55  0.89  0.89
assign ((resid  45 and name   HB#))   ((resid  45 and name    HN))    3.27  0.82  0.82
assign ((resid  45 and name   HB#))   ((resid  45 and name    HA))    2.26  0.57  0.57
assign ((resid  45 and name   HB#))   ((resid  47 and name    HN))    3.20  0.80  0.80
assign ((resid  45 and name   HB#))   ((resid   7 and name    HN))    3.60  0.90  0.90
assign ((resid  45 and name   HB#))   ((resid   6 and name  HG2#))    2.46  0.62  0.62
assign ((resid  45 and name   HB#))   ((resid   6 and name    HB))    2.57  0.64  0.64
assign ((resid  21 and name   HB2) or 
        (resid  21 and name   HB1))   ((resid  22 and name    HN))    2.72  0.68  0.68
assign ((resid  21 and name   HB2) or 
        (resid  21 and name   HB1))   ((resid  18 and name    HA))    2.89  0.72  0.72
assign ((resid   5 and name  HG2#))   ((resid  50 and name    HG))    3.21  0.80  0.80
assign ((resid   5 and name  HG2#))   ((resid   5 and name    HN))    3.00  0.75  0.75
assign ((resid   5 and name  HG2#))   ((resid   4 and name    HA))    3.43  0.86  0.86
assign ((resid   5 and name  HG2#))   ((resid   5 and name    HB))    2.37  0.59  0.59
assign ((resid   5 and name  HG2#))   ((resid   5 and name    HA))    2.67  0.67  0.67
assign ((resid   5 and name  HG2#))   ((resid  50 and name    HA))    3.41  0.85  0.85
assign ((resid  21 and name   HB2) or 
        (resid  21 and name   HB1))   ((resid  21 and name    HN))    2.27  0.57  0.57
assign ((resid  21 and name   HB1) or 
        (resid  21 and name   HB2))   ((resid  21 and name    HN))    2.31  0.58  0.58
assign ((resid  21 and name   HB1) or 
        (resid  21 and name   HB2))   ((resid  22 and name    HN))    2.87  0.72  0.72
assign ((resid  40 and name    HA))   ((resid   3 and name    HB))    2.20  0.55  0.55
assign ((resid  79 and name    HA))   ((resid  80 and name    HN))    2.24  0.56  0.56
assign ((resid  79 and name    HA))   ((resid  79 and name    HN))    2.98  0.74  0.74
assign ((resid  79 and name    HA))   ((resid  79 and name    HB))    3.19  0.80  0.80
assign ((resid  67 and name   HB1) or 
        (resid  67 and name   HB2))   ((resid  68 and name    HN))    2.66  0.66  0.66
assign ((resid  67 and name   HB2) or 
        (resid  67 and name   HB1))   ((resid  67 and name    HN))    2.16  0.54  0.54
assign ((resid  67 and name   HB2) or 
        (resid  67 and name   HB1))   ((resid  67 and name    HA))    2.18  0.55  0.55
assign ((resid  67 and name   HB1) or 
        (resid  67 and name   HB2))   ((resid  67 and name    HN))    2.29  0.57  0.57
assign ((resid  67 and name   HB1) or 
        (resid  67 and name   HB2))   ((resid  67 and name    HA))    2.27  0.57  0.57
assign ((resid  52 and name  HG2#))   ((resid  52 and name    HN))    3.34  0.84  0.84
assign ((resid  52 and name  HG2#))   ((resid  60 and name    HA))    3.50  0.87  0.87
assign ((resid  52 and name  HG2#))   ((resid  63 and name    HB))    3.41  0.85  0.85
assign ((resid  52 and name  HG2#))   ((resid  60 and name   HG1) or 
                                       (resid  60 and name   HG2))    3.34  0.84  0.84
assign ((resid  52 and name  HG2#))   ((resid  53 and name    HN))    3.79  0.95  0.95
assign ((resid  52 and name  HG2#))   ((resid  63 and name  HD1#))    2.85  0.71  0.71
assign ((resid  52 and name  HG2#))   ((resid  52 and name    HA))    2.69  0.67  0.67
assign ((resid  52 and name  HG2#))   ((resid   3 and name    HA))    3.56  0.89  0.89
assign ((resid  52 and name  HG2#))   ((resid  50 and name    HG))    2.69  0.67  0.67
assign ((resid  52 and name  HG2#))   ((resid  52 and name    HB))    2.25  0.56  0.56
assign ((resid  52 and name    HA))   ((resid  53 and name    HN))    1.85  0.46  0.46
assign ((resid  52 and name    HA))   ((resid   3 and name    HA))    2.09  0.52  0.52
assign ((resid  79 and name  HG1#) or 
        (resid  79 and name  HG2#))   ((resid  79 and name    HB))    2.35  0.59  0.59
assign ((resid  52 and name    HA))   ((resid  52 and name    HN))    3.14  0.79  0.79
assign ((resid  79 and name  HG1#) or 
        (resid  79 and name  HG2#))   ((resid  79 and name    HA))    3.00  0.75  0.75
assign ((resid  56 and name    HA))   ((resid  56 and name    HB))    2.00  0.50  0.50
assign ((resid  56 and name    HA))   ((resid  56 and name  HG2#))    2.09  0.52  0.52
assign ((resid  56 and name    HA))   ((resid  56 and name    HN))    2.74  0.69  0.69
assign ((resid  60 and name    HA))   ((resid  63 and name    HN))    3.18  0.79  0.79
assign ((resid  60 and name    HA))   ((resid  63 and name  HD1#))    2.63  0.66  0.66
assign ((resid  60 and name    HA))   ((resid  60 and name    HN))    2.67  0.67  0.67
assign ((resid  60 and name    HA))   ((resid  52 and name  HG2#))    2.83  0.71  0.71
assign ((resid  60 and name    HA))   ((resid  52 and name  HG1#))    3.19  0.80  0.80
assign ((resid   3 and name    HA))   ((resid   4 and name    HN))    1.85  0.46  0.46
assign ((resid   3 and name    HA))   ((resid   3 and name    HB))    2.91  0.73  0.73
assign ((resid  35 and name   HB2) or 
        (resid  35 and name   HB1))   ((resid  35 and name    HN))    2.82  0.70  0.70
assign ((resid  35 and name   HB1) or 
        (resid  35 and name   HB2))   ((resid  35 and name    HN))    2.90  0.72  0.72
assign ((resid  35 and name   HB2) or 
        (resid  35 and name   HB1))   ((resid  35 and name    HA))    2.55  0.64  0.64
assign ((resid  35 and name   HB1) or 
        (resid  35 and name   HB2))   ((resid  35 and name    HA))    2.45  0.61  0.61
assign ((resid  71 and name    HA))   ((resid  71 and name   HB2) or 
                                       (resid  71 and name   HB1))    2.35  0.59  0.59
assign ((resid  71 and name    HA))   ((resid  72 and name    HN))    2.49  0.62  0.62
assign ((resid  71 and name    HA))   ((resid  74 and name   HB#))    2.56  0.64  0.64
assign ((resid  71 and name    HA))   ((resid  71 and name   HB1) or 
                                       (resid  71 and name   HB2))    2.61  0.65  0.65
assign ((resid  42 and name  HG2#))   ((resid  21 and name   HB2) or 
                                       (resid  21 and name   HB1))    3.53  0.88  0.88
assign ((resid  42 and name  HG2#))   ((resid  42 and name    HB))    2.31  0.58  0.58
assign ((resid  42 and name  HG2#))   ((resid  22 and name    HA))    2.64  0.66  0.66
assign ((resid  42 and name  HG2#))   ((resid  22 and name   HB#))    2.42  0.61  0.61
assign ((resid  42 and name  HG2#))   ((resid   5 and name    HB))    2.55  0.64  0.64
assign ((resid  42 and name  HG2#))   ((resid  42 and name    HA))    2.79  0.70  0.70
assign ((resid  42 and name  HG2#))   ((resid  42 and name    HN))    3.06  0.76  0.76
assign ((resid  42 and name  HG2#))   ((resid  22 and name    HN))    3.49  0.87  0.87
assign ((resid   6 and name  HG2#))   ((resid   7 and name    HN))    3.50  0.87  0.87
assign ((resid   6 and name  HG2#))   ((resid   6 and name    HA))    2.83  0.71  0.71
assign ((resid   6 and name  HG2#))   ((resid  45 and name   HB#))    2.41  0.60  0.60
assign ((resid   6 and name  HG2#))   ((resid   6 and name    HB))    2.52  0.63  0.63
assign ((resid   6 and name  HG2#))   ((resid  43 and name   HG2) or 
                                       (resid  43 and name   HG1))    3.18  0.80  0.80
assign ((resid   5 and name    HA))   ((resid   5 and name    HN))    2.71  0.68  0.68
assign ((resid   3 and name    HB))   ((resid   3 and name  HG12) or 
                                       (resid   3 and name  HG11))    2.78  0.69  0.69
assign ((resid   3 and name    HB))   ((resid  40 and name    HA))    2.36  0.59  0.59
assign ((resid   5 and name    HA))   ((resid   6 and name    HN))    1.92  0.48  0.48
assign ((resid   3 and name    HB))   ((resid   3 and name    HN))    2.35  0.59  0.59
assign ((resid   3 and name    HB))   ((resid   3 and name  HG11) or 
                                       (resid   3 and name  HG12))    2.47  0.62  0.62
assign ((resid   5 and name    HA))   ((resid  50 and name    HA))    2.23  0.56  0.56
assign ((resid  42 and name    HA))   ((resid   5 and name    HN))    2.60  0.65  0.65
assign ((resid  19 and name   HB1) or 
        (resid  19 and name   HB2))   ((resid  20 and name    HN))    3.07  0.77  0.77
assign ((resid  19 and name   HB2) or 
        (resid  19 and name   HB1))   ((resid  20 and name    HN))    3.41  0.85  0.85
assign ((resid  42 and name    HA))   ((resid  42 and name    HB))    2.75  0.69  0.69
assign ((resid  19 and name   HB1) or 
        (resid  19 and name   HB2))   ((resid  19 and name    HA))    2.52  0.63  0.63
assign ((resid  19 and name   HB2) or 
        (resid  19 and name   HB1))   ((resid  19 and name    HA))    2.82  0.70  0.70
assign ((resid  53 and name    HB))   ((resid  53 and name  HD1#))    2.74  0.68  0.68
assign ((resid  19 and name   HB1) or 
        (resid  19 and name   HB2))   ((resid  19 and name    HN))    2.64  0.66  0.66
assign ((resid  19 and name   HB2) or 
        (resid  19 and name   HB1))   ((resid  19 and name    HN))    2.62  0.66  0.66
assign ((resid  53 and name    HB))   ((resid  53 and name    HA))    3.15  0.79  0.79
assign ((resid  53 and name    HB))   ((resid  53 and name    HN))    2.46  0.62  0.62
assign ((resid  53 and name    HB))   ((resid  53 and name  HG2#))    2.14  0.53  0.53
assign ((resid  42 and name    HA))   ((resid  42 and name    HN))    2.89  0.72  0.72
assign ((resid  53 and name    HB))   ((resid   2 and name    HN))    3.24  0.81  0.81
assign ((resid  42 and name    HA))   ((resid  43 and name    HN))    1.96  0.49  0.49
assign ((resid  42 and name    HA))   ((resid   5 and name    HB))    2.36  0.59  0.59
assign ((resid  36 and name   HB1) or 
        (resid  36 and name   HB2))   ((resid  36 and name    HA))    2.58  0.64  0.64
assign ((resid  36 and name   HB2) or 
        (resid  36 and name   HB1))   ((resid  36 and name    HA))    2.65  0.66  0.66
assign ((resid  36 and name   HB1) or 
        (resid  36 and name   HB2))   ((resid  36 and name    HN))    2.62  0.65  0.65
assign ((resid  58 and name    HA))   ((resid  58 and name    HN))    2.68  0.67  0.67
assign ((resid  59 and name   HB2) or 
        (resid  59 and name   HB1))   ((resid  56 and name    HN))    2.87  0.72  0.72
assign ((resid  59 and name   HB1) or 
        (resid  59 and name   HB2))   ((resid  59 and name    HN))    2.52  0.63  0.63
assign ((resid  59 and name   HB1) or 
        (resid  59 and name   HB2))   ((resid  56 and name    HN))    2.74  0.68  0.68
assign ((resid  59 and name   HB2) or 
        (resid  59 and name   HB1))   ((resid  60 and name    HN))    2.70  0.68  0.68
assign ((resid  59 and name   HB1) or 
        (resid  59 and name   HB2))   ((resid  59 and name    HA))    2.59  0.65  0.65
assign ((resid  59 and name   HB2) or 
        (resid  59 and name   HB1))   ((resid  59 and name    HA))    2.52  0.63  0.63
assign ((resid  59 and name   HB2) or 
        (resid  59 and name   HB1))   ((resid  59 and name    HN))    2.72  0.68  0.68
assign ((resid  59 and name   HB1) or 
        (resid  59 and name   HB2))   ((resid  60 and name    HN))    2.73  0.68  0.68
assign ((resid  79 and name  HG2#) or 
        (resid  79 and name  HG1#))   ((resid  79 and name    HB))    2.54  0.64  0.64
assign ((resid  79 and name  HG2#) or 
        (resid  79 and name  HG1#))   ((resid  79 and name    HA))    2.69  0.67  0.67
assign ((resid  79 and name  HG2#) or 
        (resid  79 and name  HG1#))   ((resid  79 and name    HN))    2.85  0.71  0.71
assign ((resid  53 and name    HA))   ((resid  53 and name    HB))    2.70  0.67  0.67
assign ((resid  53 and name    HA))   ((resid  53 and name  HG12) or 
                                       (resid  53 and name  HG11))    2.67  0.67  0.67
assign ((resid  53 and name    HA))   ((resid  53 and name  HD1#))    3.05  0.76  0.76
assign ((resid  53 and name    HA))   ((resid  53 and name  HG11) or 
                                       (resid  53 and name  HG12))    2.82  0.70  0.70
assign ((resid  53 and name    HA))   ((resid  53 and name    HN))    2.54  0.64  0.64
assign ((resid  53 and name    HA))   ((resid  53 and name  HG2#))    2.19  0.55  0.55
assign ((resid  57 and name    HA))   ((resid  60 and name    HN))    3.28  0.82  0.82
assign ((resid  57 and name    HA))   ((resid  57 and name    HN))    3.14  0.78  0.78
assign ((resid   7 and name    HB))   ((resid   7 and name    HA))    2.90  0.73  0.73
assign ((resid   7 and name    HB))   ((resid   7 and name    HN))    2.37  0.59  0.59
assign ((resid   7 and name    HB))   ((resid  44 and name    HA))    2.88  0.72  0.72
assign ((resid   7 and name    HB))   ((resid  18 and name  HD1#))    3.25  0.81  0.81
assign ((resid   7 and name    HB))   ((resid   6 and name    HA))    3.23  0.81  0.81
assign ((resid  32 and name   HB#))   ((resid  32 and name    HN))    2.39  0.60  0.60
assign ((resid  32 and name   HB#))   ((resid  33 and name    HN))    3.27  0.82  0.82
assign ((resid  75 and name   HB1) or 
        (resid  75 and name   HB2))   ((resid  75 and name    HN))    2.64  0.66  0.66
assign ((resid  75 and name   HB2) or 
        (resid  75 and name   HB1))   ((resid  75 and name    HN))    2.47  0.62  0.62
assign ((resid  75 and name   HB1) or 
        (resid  75 and name   HB2))   ((resid  75 and name    HA))    2.40  0.60  0.60
assign ((resid  75 and name   HB2) or 
        (resid  75 and name   HB1))   ((resid  75 and name    HA))    2.63  0.66  0.66
assign ((resid  17 and name   HB#))   ((resid  18 and name    HN))    3.18  0.79  0.79
assign ((resid  17 and name   HB#))   ((resid  14 and name   HB2) or 
                                       (resid  14 and name   HB1))    2.97  0.74  0.74
assign ((resid  17 and name   HB#))   ((resid  17 and name    HN))    2.45  0.61  0.61
assign ((resid  17 and name   HB#))   ((resid  17 and name    HA))    2.36  0.59  0.59
assign ((resid  17 and name   HB#))   ((resid  13 and name  HD1#) or 
                                       (resid  13 and name  HD2#))    2.69  0.67  0.67
assign ((resid  17 and name   HB#))   ((resid  14 and name   HD2) or 
                                       (resid  14 and name   HD1))    3.04  0.76  0.76
assign ((resid  17 and name   HB#))   ((resid  13 and name   HB1) or 
                                       (resid  13 and name   HB2))    2.97  0.74  0.74
assign ((resid  31 and name    HA))   ((resid  31 and name    HN))    2.60  0.65  0.65
assign ((resid  31 and name    HA))   ((resid  31 and name   HB1) or 
                                       (resid  31 and name   HB2))    2.03  0.51  0.51
assign ((resid  31 and name    HA))   ((resid  32 and name    HN))    3.44  0.86  0.86
assign ((resid  28 and name    HA))   ((resid  31 and name   HB1) or 
                                       (resid  31 and name   HB2))    4.50  4.50  0.00
assign ((resid  28 and name    HA))   ((resid  29 and name    HN))    4.50  4.50  0.00
assign ((resid  28 and name    HA))   ((resid  28 and name    HN))    4.50  4.50  0.00
assign ((resid  27 and name    HA))   ((resid  30 and name   HB2) or 
                                       (resid  30 and name   HB1))    4.50  4.50  0.00
assign ((resid  27 and name    HA))   ((resid  27 and name    HN))    4.50  4.50  0.00
assign ((resid  28 and name    HA))   ((resid  31 and name    HN))    4.50  4.50  0.00
assign ((resid  65 and name    HA))   ((resid  65 and name    HN))    2.60  0.65  0.65
assign ((resid  65 and name    HA))   ((resid  65 and name   HB1) or 
                                       (resid  65 and name   HB2))    2.53  0.63  0.63
assign ((resid  65 and name    HA))   ((resid  65 and name   HG1) or 
                                       (resid  65 and name   HG2))    2.80  0.70  0.70
assign ((resid  65 and name    HA))   ((resid  65 and name   HB2) or 
                                       (resid  65 and name   HB1))    2.45  0.61  0.61
assign ((resid  65 and name    HA))   ((resid  65 and name   HG2) or 
                                       (resid  65 and name   HG1))    2.22  0.56  0.56
assign ((resid  69 and name    HA))   ((resid  69 and name    HN))    4.50  4.50  0.00
assign ((resid  67 and name    HA))   ((resid  67 and name    HN))    2.70  0.67  0.67
assign ((resid  67 and name    HA))   ((resid  25 and name  HD1#) or 
                                       (resid  25 and name  HD2#))    2.30  0.58  0.58
assign ((resid  67 and name    HA))   ((resid  70 and name    HB))    2.64  0.66  0.66
assign ((resid  67 and name    HA))   ((resid  71 and name    HN))    3.42  0.85  0.85
assign ((resid  20 and name   HB#))   ((resid  21 and name    HN))    2.87  0.72  0.72
assign ((resid  20 and name   HB#))   ((resid  20 and name    HN))    2.38  0.60  0.60
assign ((resid  20 and name   HB#))   ((resid  20 and name    HA))    2.27  0.57  0.57
assign ((resid  20 and name   HB#))   ((resid  17 and name    HA))    2.72  0.68  0.68
assign ((resid   6 and name    HA))   ((resid   6 and name    HN))    2.77  0.69  0.69
assign ((resid   6 and name    HA))   ((resid   7 and name    HN))    1.77  0.44  0.44
assign ((resid   6 and name    HA))   ((resid   7 and name    HB))    3.14  0.79  0.79
assign ((resid   6 and name    HA))   ((resid   6 and name    HB))    2.26  0.57  0.57
assign ((resid   6 and name    HA))   ((resid   6 and name  HG2#))    2.11  0.53  0.53
assign ((resid   6 and name    HA))   ((resid  45 and name   HB#))    3.09  0.77  0.77
assign ((resid  61 and name    HA))   ((resid  61 and name    HN))    2.50  0.62  0.62
assign ((resid  61 and name    HA))   ((resid  64 and name    HN))    3.25  0.81  0.81
assign ((resid   8 and name   HB#))   ((resid  11 and name    HN))    3.60  0.90  0.90
assign ((resid   8 and name   HB#))   ((resid   8 and name    HN))    2.37  0.59  0.59
assign ((resid   8 and name   HB#))   ((resid   9 and name    HN))    3.29  0.82  0.82
assign ((resid   8 and name   HB#))   ((resid   8 and name    HA))    2.33  0.58  0.58
assign ((resid   8 and name   HB#))   ((resid  47 and name    HA))    2.65  0.66  0.66
assign ((resid   8 and name   HB#))   ((resid  48 and name    HN))    3.16  0.79  0.79
assign ((resid   8 and name   HB#))   ((resid  10 and name    HN))    3.39  0.85  0.85
assign ((resid   8 and name   HB#))   ((resid  47 and name    HN))    3.79  0.95  0.95
assign ((resid  62 and name    HA))   ((resid  65 and name   HB1) or 
                                       (resid  65 and name   HB2))    2.66  0.66  0.66
assign ((resid  46 and name   HB#))   ((resid  47 and name    HN))    3.05  0.76  0.76
assign ((resid  46 and name   HB#))   ((resid  46 and name    HA))    2.13  0.53  0.53
assign ((resid  72 and name    HA))   ((resid  72 and name    HN))    2.53  0.63  0.63
assign ((resid  72 and name    HA))   ((resid  72 and name   HB1) or 
                                       (resid  72 and name   HB2))    2.11  0.53  0.53
assign ((resid  72 and name    HA))   ((resid  73 and name    HN))    3.54  0.89  0.89
assign ((resid  72 and name    HA))   ((resid  72 and name   HG2) or 
                                       (resid  72 and name   HG1))    2.51  0.63  0.63
assign ((resid  72 and name    HA))   ((resid  72 and name   HG1) or 
                                       (resid  72 and name   HG2))    3.05  0.76  0.76
assign ((resid  30 and name    HA))   ((resid  29 and name  HG2#))    3.58  0.89  0.89
assign ((resid  30 and name    HA))   ((resid  30 and name    HN))    2.51  0.63  0.63
assign ((resid  30 and name    HA))   ((resid  31 and name    HN))    3.57  0.89  0.89
assign ((resid  48 and name   HB1) or 
        (resid  48 and name   HB2))   ((resid  48 and name    HN))    2.44  0.61  0.61
assign ((resid  74 and name   HB#))   ((resid  78 and name   HB2) or 
                                       (resid  78 and name   HB1))    3.45  0.86  0.86
assign ((resid  74 and name   HB#))   ((resid  74 and name    HN))    2.22  0.56  0.56
assign ((resid  74 and name   HB#))   ((resid  74 and name    HA))    2.29  0.57  0.57
assign ((resid  74 and name   HB#))   ((resid  71 and name    HA))    3.53  0.88  0.88
assign ((resid   3 and name  HG2#))   ((resid   3 and name    HB))    2.48  0.62  0.62
assign ((resid   3 and name  HG2#))   ((resid   3 and name    HA))    2.76  0.69  0.69
assign ((resid  48 and name   HB1) or 
        (resid  48 and name   HB2))   ((resid  48 and name    HA))    2.54  0.64  0.64
assign ((resid  74 and name   HB#))   ((resid  75 and name    HN))    3.02  0.76  0.76
assign ((resid   3 and name  HG2#))   ((resid   4 and name    HN))    3.17  0.79  0.79
assign ((resid  48 and name   HB2) or 
        (resid  48 and name   HB1))   ((resid  48 and name    HA))    2.38  0.59  0.59
assign ((resid  48 and name   HB2) or 
        (resid  48 and name   HB1))   ((resid  48 and name    HN))    2.63  0.66  0.66
assign ((resid  66 and name    HB))   ((resid  66 and name    HA))    2.77  0.69  0.69
assign ((resid  66 and name    HB))   ((resid  66 and name    HN))    2.17  0.54  0.54
assign ((resid  66 and name    HB))   ((resid  63 and name    HA))    2.21  0.55  0.55
assign ((resid  66 and name    HB))   ((resid  67 and name    HN))    2.46  0.62  0.62
assign ((resid   9 and name    HA))   ((resid   9 and name    HN))    2.75  0.69  0.69
assign ((resid   9 and name    HA))   ((resid   9 and name   HB1) or 
                                       (resid   9 and name   HB2))    2.18  0.54  0.54
assign ((resid   9 and name    HA))   ((resid  11 and name    HN))    3.62  0.90  0.90
assign ((resid   9 and name    HA))   ((resid   7 and name  HG2#))    3.81  0.95  0.95
assign ((resid   9 and name    HA))   ((resid  44 and name   HB1) or 
                                       (resid  44 and name   HB2))    3.34  0.83  0.83
assign ((resid  44 and name    HA))   ((resid  44 and name   HB2) or 
                                       (resid  44 and name   HB1))    2.70  0.68  0.68
assign ((resid  44 and name    HA))   ((resid  45 and name    HN))    1.89  0.47  0.47
assign ((resid  44 and name    HA))   ((resid   7 and name    HB))    2.65  0.66  0.66
assign ((resid  44 and name    HA))   ((resid   7 and name    HN))    2.44  0.61  0.61
assign ((resid  44 and name    HA))   ((resid  44 and name   HB1) or 
                                       (resid  44 and name   HB2))    2.35  0.59  0.59
assign ((resid  44 and name    HA))   ((resid  44 and name    HN))    2.73  0.68  0.68
assign ((resid  24 and name    HA))   ((resid  27 and name    HN))    3.07  0.77  0.77
assign ((resid  24 and name    HA))   ((resid  27 and name   HB2) or 
                                       (resid  27 and name   HB1))    2.85  0.71  0.71
assign ((resid  24 and name    HA))   ((resid  24 and name    HN))    2.60  0.65  0.65
assign ((resid  31 and name   HB1) or 
        (resid  31 and name   HB2))   ((resid  31 and name    HN))    2.39  0.60  0.60
assign ((resid  31 and name   HB1) or 
        (resid  31 and name   HB2))   ((resid  31 and name    HA))    2.44  0.61  0.61
assign ((resid  31 and name   HB1) or 
        (resid  31 and name   HB2))   ((resid  28 and name    HA))    3.00  0.75  0.75
assign ((resid  31 and name   HB1) or 
        (resid  31 and name   HB2))   ((resid  32 and name    HN))    2.86  0.71  0.71
assign ((resid  15 and name   HB#))   ((resid  15 and name    HN))    2.50  0.62  0.62
assign ((resid  15 and name   HB#))   ((resid  15 and name    HA))    2.32  0.58  0.58
assign ((resid  78 and name   HB2) or 
        (resid  78 and name   HB1))   ((resid  78 and name    HN))    2.40  0.60  0.60
assign ((resid  78 and name   HB1) or 
        (resid  78 and name   HB2))   ((resid  78 and name    HN))    2.27  0.57  0.57
assign ((resid  78 and name    HA))   ((resid  78 and name    HN))    2.80  0.70  0.70
assign ((resid  78 and name    HA))   ((resid  79 and name    HN))    1.96  0.49  0.49
assign ((resid  78 and name    HA))   ((resid  78 and name   HB2) or 
                                       (resid  78 and name   HB1))    2.33  0.58  0.58
assign ((resid  78 and name    HA))   ((resid  78 and name   HB1) or 
                                       (resid  78 and name   HB2))    2.75  0.69  0.69
assign ((resid  21 and name    HA))   ((resid  21 and name    HN))    2.66  0.67  0.67
assign ((resid  80 and name    HA))   ((resid  80 and name    HN))    3.30  0.83  0.83
assign ((resid  80 and name    HA))   ((resid  81 and name    HN))    2.62  0.65  0.65
assign ((resid  22 and name   HB#))   ((resid  22 and name    HN))    2.32  0.58  0.58
assign ((resid  22 and name   HB#))   ((resid  19 and name    HA))    2.66  0.66  0.66
assign ((resid  22 and name   HB#))   ((resid  42 and name  HG2#))    2.37  0.59  0.59
assign ((resid  22 and name   HB#))   ((resid  42 and name    HB))    2.58  0.65  0.65
assign ((resid  22 and name   HB#))   ((resid  22 and name    HA))    2.27  0.57  0.57
assign ((resid  22 and name   HB#))   ((resid  23 and name    HN))    2.86  0.72  0.72
assign ((resid  25 and name    HA))   ((resid  26 and name    HN))    3.21  0.80  0.80
assign ((resid  25 and name    HA))   ((resid  25 and name    HN))    2.60  0.65  0.65
assign ((resid  53 and name  HG2#))   ((resid  53 and name    HA))    2.83  0.71  0.71
assign ((resid  53 and name  HG2#))   ((resid  53 and name    HB))    2.25  0.56  0.56
assign ((resid  53 and name  HG2#))   ((resid  53 and name    HN))    3.73  0.93  0.93
assign ((resid  53 and name  HG2#))   ((resid   2 and name    HN))    4.15  1.04  1.04
assign ((resid   7 and name    HA))   ((resid  48 and name    HA))    2.37  0.59  0.59
assign ((resid   7 and name    HA))   ((resid   8 and name    HN))    1.90  0.48  0.48
assign ((resid   7 and name    HA))   ((resid   7 and name    HN))    3.06  0.76  0.76
assign ((resid  63 and name  HG2#))   ((resid  64 and name    HN))    3.85  0.96  0.96
assign ((resid  63 and name  HG2#))   ((resid  63 and name    HA))    2.75  0.69  0.69
assign ((resid  63 and name  HG2#))   ((resid   3 and name  HG12) or 
                                       (resid   3 and name  HG11))    2.96  0.74  0.74
assign ((resid  63 and name  HG2#))   ((resid  64 and name    HA))    3.71  0.93  0.93
assign ((resid  63 and name  HG2#))   ((resid  63 and name    HN))    3.83  0.96  0.96
assign ((resid  59 and name    HA))   ((resid  59 and name    HN))    2.68  0.67  0.67
assign ((resid   7 and name  HG2#))   ((resid  11 and name   HB1) or 
                                       (resid  11 and name   HB2))    3.30  0.83  0.83
assign ((resid  66 and name  HG2#))   ((resid  66 and name    HN))    3.73  0.93  0.93
assign ((resid   7 and name  HG2#))   ((resid  13 and name    HG))    3.51  0.88  0.88
assign ((resid  66 and name  HG2#))   ((resid  66 and name    HA))    2.76  0.69  0.69
assign ((resid  66 and name  HG2#))   ((resid  67 and name    HN))    3.79  0.95  0.95
assign ((resid   7 and name  HG2#))   ((resid   8 and name    HN))    2.99  0.75  0.75
assign ((resid   7 and name  HG2#))   ((resid   8 and name   HB#))    2.66  0.67  0.67
assign ((resid  63 and name    HB))   ((resid  64 and name    HN))    2.65  0.66  0.66
assign ((resid   7 and name  HG2#))   ((resid   7 and name    HA))    2.65  0.66  0.66
assign ((resid   7 and name  HG2#))   ((resid   7 and name    HB))    2.26  0.57  0.57
assign ((resid  63 and name    HB))   ((resid  60 and name    HA))    2.28  0.57  0.57
assign ((resid  63 and name    HB))   ((resid  63 and name    HN))    2.10  0.52  0.52
assign ((resid   7 and name  HG2#))   ((resid  18 and name  HD1#))    3.70  0.92  0.92
assign ((resid   7 and name  HG2#))   ((resid   7 and name    HN))    3.85  0.96  0.96
assign ((resid  63 and name    HB))   ((resid  63 and name  HG2#))    1.89  0.47  0.47
assign ((resid  63 and name    HB))   ((resid  63 and name  HD1#))    2.39  0.60  0.60
assign ((resid  63 and name    HB))   ((resid  63 and name    HA))    2.90  0.72  0.72
assign ((resid  58 and name   HG1) or 
        (resid  58 and name   HG2))   ((resid  58 and name    HN))    3.59  0.90  0.90
assign ((resid  58 and name   HG1) or 
        (resid  58 and name   HG2))   ((resid  58 and name    HA))    2.90  0.73  0.73
assign ((resid  58 and name   HG2) or 
        (resid  58 and name   HG1))   ((resid  58 and name    HN))    3.37  0.84  0.84
assign ((resid  58 and name   HG2) or 
        (resid  58 and name   HG1))   ((resid  58 and name    HA))    2.72  0.68  0.68
assign ((resid  18 and name  HG2#))   ((resid  19 and name    HN))    3.30  0.83  0.83
assign ((resid  18 and name  HG2#))   ((resid  18 and name    HB))    2.22  0.55  0.55
assign ((resid  18 and name  HG2#))   ((resid  18 and name    HN))    3.19  0.80  0.80
assign ((resid  18 and name  HG2#))   ((resid  18 and name    HA))    2.76  0.69  0.69
assign ((resid  18 and name  HG2#))   ((resid  43 and name    HA))    3.55  0.89  0.89
assign ((resid  72 and name   HG1) or 
        (resid  72 and name   HG2))   ((resid  72 and name    HN))    2.86  0.71  0.71
assign ((resid  72 and name   HG2) or 
        (resid  72 and name   HG1))   ((resid  72 and name    HN))    3.01  0.75  0.75
assign ((resid  29 and name  HG2#))   ((resid  29 and name    HN))    4.15  1.04  1.04
assign ((resid  72 and name   HG2) or 
        (resid  72 and name   HG1))   ((resid  72 and name    HA))    2.70  0.68  0.68
assign ((resid  29 and name  HG2#))   ((resid  29 and name    HA))    2.85  0.71  0.71
assign ((resid  29 and name  HG2#))   ((resid  29 and name    HB))    2.39  0.60  0.60
assign ((resid  29 and name  HG2#))   ((resid  33 and name   HB1) or 
                                       (resid  33 and name   HB2))    3.65  0.91  0.91
assign ((resid  19 and name    HA))   ((resid  19 and name    HN))    2.55  0.64  0.64
assign ((resid  19 and name    HA))   ((resid  22 and name   HB#))    2.38  0.60  0.60
assign ((resid  19 and name    HA))   ((resid  20 and name    HN))    3.23  0.81  0.81
assign ((resid  19 and name    HA))   ((resid  22 and name    HN))    3.26  0.81  0.81
assign ((resid  51 and name    HA))   ((resid  52 and name    HN))    1.94  0.49  0.49
assign ((resid  51 and name    HA))   ((resid  51 and name    HN))    2.63  0.66  0.66
assign ((resid  37 and name    HA))   ((resid  38 and name    HN))    2.19  0.55  0.55
assign ((resid  37 and name    HA))   ((resid  37 and name   HG2) or 
                                       (resid  37 and name   HG1))    3.04  0.76  0.76
assign ((resid  37 and name    HA))   ((resid  37 and name   HB1) or 
                                       (resid  37 and name   HB2))    2.34  0.58  0.58
assign ((resid  37 and name    HA))   ((resid  37 and name   HG1) or 
                                       (resid  37 and name   HG2))    3.59  0.90  0.90
assign ((resid  41 and name    HA))   ((resid  42 and name    HN))    1.81  0.45  0.45
assign ((resid  41 and name    HA))   ((resid  41 and name    HN))    2.56  0.64  0.64
assign ((resid  69 and name   HG2) or 
        (resid  69 and name   HG1))   ((resid  69 and name    HA))    2.45  0.61  0.61
assign ((resid  69 and name   HG1) or 
        (resid  69 and name   HG2))   ((resid  69 and name    HN))    2.62  0.65  0.65
assign ((resid  69 and name   HG1) or 
        (resid  69 and name   HG2))   ((resid  69 and name    HA))    2.78  0.70  0.70
assign ((resid  69 and name   HG2) or 
        (resid  69 and name   HG1))   ((resid  69 and name    HN))    2.49  0.62  0.62
assign ((resid  75 and name    HA))   ((resid  74 and name   HB#))    3.82  0.96  0.96
assign ((resid  29 and name    HB))   ((resid  29 and name    HN))    2.23  0.56  0.56
assign ((resid  29 and name    HB))   ((resid  30 and name    HN))    2.79  0.70  0.70
assign ((resid  75 and name    HA))   ((resid  75 and name    HN))    2.58  0.65  0.65
assign ((resid  29 and name    HB))   ((resid  29 and name    HA))    2.50  0.62  0.62
assign ((resid  75 and name    HA))   ((resid  75 and name   HB2) or 
                                       (resid  75 and name   HB1))    2.64  0.66  0.66
assign ((resid  75 and name    HA))   ((resid  75 and name   HB1) or 
                                       (resid  75 and name   HB2))    2.41  0.60  0.60
assign ((resid  75 and name    HA))   ((resid  76 and name    HN))    3.43  0.86  0.86
assign ((resid  77 and name    HA))   ((resid  78 and name    HN))    3.38  0.85  0.85
assign ((resid  77 and name    HA))   ((resid  77 and name    HN))    2.79  0.70  0.70
assign ((resid  77 and name    HA))   ((resid  77 and name   HB1) or 
                                       (resid  77 and name   HB2))    2.17  0.54  0.54
assign ((resid  77 and name    HA))   ((resid  77 and name   HB2) or 
                                       (resid  77 and name   HB1))    2.08  0.52  0.52
assign ((resid  18 and name    HB))   ((resid  19 and name    HN))    2.63  0.66  0.66
assign ((resid  18 and name    HB))   ((resid  18 and name    HA))    2.55  0.64  0.64
assign ((resid  18 and name    HB))   ((resid  18 and name    HN))    2.23  0.56  0.56
assign ((resid  18 and name    HB))   ((resid  18 and name  HG2#))    2.14  0.53  0.53
assign ((resid  18 and name    HB))   ((resid  18 and name  HD1#))    2.81  0.70  0.70
assign ((resid   1 and name   HE#))   ((resid  33 and name   HB1) or 
                                       (resid  33 and name   HB2))    2.99  0.75  0.75
assign ((resid   1 and name   HE#))   ((resid   1 and name   HG1) or 
                                       (resid   1 and name   HG2))    2.72  0.68  0.68
assign ((resid   1 and name   HE#))   ((resid  59 and name   HB1) or 
                                       (resid  59 and name   HB2))    3.24  0.81  0.81
assign ((resid   1 and name   HE#))   ((resid   3 and name  HD1#))    2.31  0.58  0.58
assign ((resid   1 and name   HE#))   ((resid   1 and name   HB1) or 
                                       (resid   1 and name   HB2))    2.53  0.63  0.63
assign ((resid   1 and name   HE#))   ((resid  63 and name  HD1#))    2.68  0.67  0.67
assign ((resid   1 and name   HE#))   ((resid  36 and name   HB2) or 
                                       (resid  36 and name   HB1))    3.36  0.84  0.84
assign ((resid   1 and name   HE#))   ((resid   1 and name   HG2) or 
                                       (resid   1 and name   HG1))    2.77  0.69  0.69
assign ((resid   1 and name   HE#))   ((resid  52 and name  HG1#))    3.03  0.76  0.76
assign ((resid   1 and name   HE#))   ((resid  36 and name   HB1) or 
                                       (resid  36 and name   HB2))    3.37  0.84  0.84
assign ((resid  37 and name   HG1) or 
        (resid  37 and name   HG2))   ((resid  37 and name    HA))    3.67  0.92  0.92
assign ((resid  37 and name   HG2) or 
        (resid  37 and name   HG1))   ((resid  37 and name    HA))    3.38  0.85  0.85
assign ((resid  65 and name   HG1) or 
        (resid  65 and name   HG2))   ((resid  65 and name    HA))    2.73  0.68  0.68
assign ((resid  65 and name   HG2) or 
        (resid  65 and name   HG1))   ((resid  65 and name    HN))    2.99  0.75  0.75
assign ((resid  65 and name   HG2) or 
        (resid  65 and name   HG1))   ((resid  65 and name    HA))    2.69  0.67  0.67
assign ((resid  65 and name   HG1) or 
        (resid  65 and name   HG2))   ((resid  65 and name    HN))    2.49  0.62  0.62
assign ((resid  22 and name    HA))   ((resid  22 and name    HN))    2.60  0.65  0.65
assign ((resid  22 and name    HA))   ((resid  22 and name   HB#))    2.00  0.50  0.50
assign ((resid  22 and name    HA))   ((resid  42 and name  HG2#))    2.11  0.53  0.53
assign ((resid  22 and name    HA))   ((resid  23 and name    HN))    3.24  0.81  0.81
assign ((resid  11 and name    HA))   ((resid  12 and name   HD1) or 
                                       (resid  12 and name   HD2))    1.96  0.49  0.49
assign ((resid  11 and name    HA))   ((resid  11 and name   HB1) or 
                                       (resid  11 and name   HB2))    2.16  0.54  0.54
assign ((resid  11 and name    HA))   ((resid  11 and name    HN))    3.03  0.76  0.76
assign ((resid  76 and name    HA))   ((resid  76 and name    HN))    2.77  0.69  0.69
assign ((resid  76 and name    HA))   ((resid  76 and name   HB2) or 
                                       (resid  76 and name   HB1))    2.27  0.57  0.57
assign ((resid  76 and name    HA))   ((resid  76 and name   HB1) or 
                                       (resid  76 and name   HB2))    2.51  0.63  0.63
assign ((resid   3 and name  HD1#))   ((resid   3 and name    HB))    2.65  0.66  0.66
assign ((resid   3 and name  HD1#))   ((resid   3 and name    HN))    3.36  0.84  0.84
assign ((resid   3 and name  HD1#))   ((resid   1 and name   HE#))    3.06  0.77  0.77
assign ((resid  39 and name    HA))   ((resid  40 and name    HN))    2.08  0.52  0.52
assign ((resid   2 and name    HA))   ((resid   2 and name   HG2) or 
                                       (resid   2 and name   HG1))    2.69  0.67  0.67
assign ((resid   2 and name    HA))   ((resid  39 and name    HN))    2.86  0.72  0.72
assign ((resid   2 and name    HA))   ((resid  39 and name   HB1) or 
                                       (resid  39 and name   HB2))    2.41  0.60  0.60
assign ((resid   2 and name    HA))   ((resid   2 and name   HB2) or 
                                       (resid   2 and name   HB1))    2.44  0.61  0.61
assign ((resid   2 and name    HA))   ((resid   3 and name    HN))    1.78  0.44  0.44
assign ((resid   2 and name    HA))   ((resid   2 and name   HB1) or 
                                       (resid   2 and name   HB2))    2.43  0.61  0.61
assign ((resid  17 and name    HA))   ((resid  18 and name    HN))    3.23  0.81  0.81
assign ((resid  17 and name    HA))   ((resid  17 and name    HN))    2.55  0.64  0.64
assign ((resid  17 and name    HA))   ((resid  20 and name   HB#))    2.24  0.56  0.56
assign ((resid  17 and name    HA))   ((resid  17 and name   HB#))    2.01  0.50  0.50
assign ((resid  17 and name    HA))   ((resid  20 and name    HN))    3.03  0.76  0.76
assign ((resid   1 and name    HA))   ((resid  54 and name   HA2) or 
                                       (resid  54 and name   HA1))    3.59  0.90  0.90
assign ((resid   1 and name    HA))   ((resid  54 and name   HA1) or 
                                       (resid  54 and name   HA2))    2.99  0.75  0.75
assign ((resid   1 and name    HA))   ((resid   2 and name    HN))    1.97  0.49  0.49
assign ((resid   1 and name    HA))   ((resid   1 and name   HB1) or 
                                       (resid   1 and name   HB2))    2.24  0.56  0.56
assign ((resid  20 and name    HA))   ((resid  20 and name    HN))    2.54  0.64  0.64
assign ((resid  20 and name    HA))   ((resid  23 and name    HN))    3.17  0.79  0.79
assign ((resid  20 and name    HA))   ((resid  20 and name   HB#))    1.95  0.49  0.49
assign ((resid  33 and name    HA))   ((resid  34 and name   HD1) or 
                                       (resid  34 and name   HD2))    2.03  0.51  0.51
assign ((resid  33 and name    HA))   ((resid  34 and name   HD2) or 
                                       (resid  34 and name   HD1))    2.39  0.60  0.60
assign ((resid  33 and name    HA))   ((resid  33 and name    HN))    2.74  0.68  0.68
assign ((resid  74 and name    HA))   ((resid  74 and name    HN))    2.35  0.59  0.59
assign ((resid  74 and name    HA))   ((resid  74 and name   HB#))    1.98  0.50  0.50
assign ((resid  74 and name    HA))   ((resid  75 and name    HN))    3.16  0.79  0.79
assign ((resid   4 and name    HA))   ((resid  40 and name    HA))    3.01  0.75  0.75
assign ((resid   4 and name    HA))   ((resid   5 and name  HG2#))    2.81  0.70  0.70
assign ((resid   4 and name    HA))   ((resid  41 and name    HN))    2.61  0.65  0.65
assign ((resid  66 and name  HD1#))   ((resid  62 and name   HG1) or 
                                       (resid  62 and name   HG2))    3.15  0.79  0.79
assign ((resid  66 and name  HD1#))   ((resid  63 and name    HA))    3.08  0.77  0.77
assign ((resid  66 and name  HD1#))   ((resid  66 and name    HA))    3.18  0.79  0.79
assign ((resid  66 and name  HD1#))   ((resid  66 and name    HN))    3.74  0.93  0.93
assign ((resid  46 and name    HA))   ((resid  46 and name   HB#))    1.87  0.47  0.47
assign ((resid  15 and name    HA))   ((resid  15 and name   HB#))    1.90  0.47  0.47
assign ((resid  15 and name    HA))   ((resid  17 and name    HN))    3.48  0.87  0.87
assign ((resid   1 and name   HB1) or 
        (resid   1 and name   HB2))   ((resid   2 and name    HN))    4.50  4.50  0.00
assign ((resid   1 and name   HB1) or 
        (resid   1 and name   HB2))   ((resid   1 and name   HE#))    4.50  4.50  0.00
assign ((resid   1 and name   HB1) or 
        (resid   1 and name   HB2))   ((resid   1 and name    HA))    4.50  4.50  0.00
assign ((resid  50 and name    HA))   ((resid  50 and name    HN))    2.97  0.74  0.74
assign ((resid  35 and name    HA))   ((resid  36 and name    HN))    4.50  4.50  0.00
assign ((resid  42 and name    HB))   ((resid  42 and name    HA))    4.50  4.50  0.00
assign ((resid  35 and name    HA))   ((resid  35 and name    HN))    4.50  4.50  0.00
assign ((resid  50 and name    HA))   ((resid  51 and name    HN))    1.83  0.46  0.46
assign ((resid  50 and name    HA))   ((resid   5 and name    HA))    2.23  0.56  0.56
assign ((resid  42 and name    HB))   ((resid  42 and name    HN))    4.50  4.50  0.00
assign ((resid  52 and name    HB))   ((resid  52 and name  HG1#))    4.50  4.50  0.00
assign ((resid  30 and name   HG2) or 
        (resid  30 and name   HG1))   ((resid  30 and name    HA))    3.27  0.82  0.82
assign ((resid  30 and name   HG1) or 
        (resid  30 and name   HG2))   ((resid  30 and name    HA))    3.28  0.82  0.82
assign ((resid  30 and name   HG2) or 
        (resid  30 and name   HG1))   ((resid  30 and name    HN))    3.48  0.87  0.87
assign ((resid  43 and name    HA))   ((resid  44 and name    HN))    4.50  4.50  0.00
assign ((resid  43 and name    HA))   ((resid  43 and name    HN))    4.50  4.50  0.00
assign ((resid  30 and name   HG1) or 
        (resid  30 and name   HG2))   ((resid  30 and name    HN))    3.43  0.86  0.86
assign ((resid  43 and name   HB1) or 
        (resid  43 and name   HB2))   ((resid  43 and name    HA))    2.37  0.59  0.59
assign ((resid  30 and name   HG1) or 
        (resid  30 and name   HG2))   ((resid  27 and name    HA))    3.95  0.99  0.99
assign ((resid  52 and name    HB))   ((resid  52 and name  HG2#))    4.50  4.50  0.00
assign ((resid  52 and name    HB))   ((resid  52 and name    HN))    4.50  4.50  0.00
assign ((resid  52 and name    HB))   ((resid  52 and name    HA))    4.50  4.50  0.00
assign ((resid  63 and name  HD1#))   ((resid   3 and name  HG12) or 
                                       (resid   3 and name  HG11))    3.21  0.80  0.80
assign ((resid  63 and name  HD1#))   ((resid   3 and name  HG11) or 
                                       (resid   3 and name  HG12))    3.57  0.89  0.89
assign ((resid  63 and name  HD1#))   ((resid  63 and name    HN))    3.76  0.94  0.94
assign ((resid  63 and name  HD1#))   ((resid  60 and name    HA))    3.06  0.76  0.76
assign ((resid  63 and name  HD1#))   ((resid  63 and name    HA))    3.71  0.93  0.93
assign ((resid   5 and name    HB))   ((resid  42 and name    HA))    2.36  0.59  0.59
assign ((resid   5 and name    HB))   ((resid   5 and name    HN))    2.30  0.58  0.58
assign ((resid   5 and name    HB))   ((resid  42 and name  HG2#))    1.98  0.49  0.49
assign ((resid   5 and name    HB))   ((resid   5 and name    HA))    3.18  0.79  0.79
assign ((resid  49 and name    HA))   ((resid  49 and name    HN))    2.73  0.68  0.68
assign ((resid  49 and name    HA))   ((resid  49 and name   HB1) or 
                                       (resid  49 and name   HB2))    2.59  0.65  0.65
assign ((resid  49 and name    HA))   ((resid  49 and name   HB2) or 
                                       (resid  49 and name   HB1))    2.25  0.56  0.56
assign ((resid  49 and name    HA))   ((resid  50 and name    HN))    1.86  0.46  0.46
assign ((resid  40 and name    HB))   ((resid  40 and name    HN))    2.50  0.63  0.63
assign ((resid  40 and name    HB))   ((resid  40 and name    HA))    2.53  0.63  0.63
assign ((resid  32 and name    HA))   ((resid  32 and name    HN))    2.69  0.67  0.67
assign ((resid  32 and name    HA))   ((resid  32 and name   HB#))    1.98  0.49  0.49
assign ((resid  32 and name    HA))   ((resid  33 and name    HN))    3.53  0.88  0.88
assign ((resid  79 and name    HB))   ((resid  79 and name    HN))    2.80  0.70  0.70
assign ((resid  79 and name    HB))   ((resid  79 and name    HA))    3.21  0.80  0.80
assign ((resid  36 and name    HA))   ((resid  36 and name    HN))    2.73  0.68  0.68
assign ((resid  53 and name  HD1#))   ((resid  53 and name    HA))    3.43  0.86  0.86
assign ((resid  53 and name  HD1#))   ((resid  53 and name    HB))    2.75  0.69  0.69
assign ((resid  18 and name  HD1#))   ((resid  44 and name   HD1) or 
                                       (resid  44 and name   HD2))    3.75  0.75  0.75
assign ((resid  18 and name  HD1#))   ((resid  44 and name   HE1) or 
                                       (resid  44 and name   HE2))    3.20  0.50  0.50
assign ((resid  63 and name  HD1#))   ((resid  33 and name   HD1) or 
                                       (resid  33 and name   HD2))    4.40  1.10  1.10
assign ((resid  63 and name  HD1#))   ((resid  33 and name    HZ))    3.75  0.75  0.75
assign ((resid   7 and name  HD1#))   ((resid  44 and name   HD1) or 
                                       (resid  44 and name   HD2))    4.40  1.10  1.10
assign ((resid   7 and name  HD1#))   ((resid  44 and name   HE1) or 
                                       (resid  44 and name   HE2))    4.40  1.10  1.10
assign ((resid   7 and name  HD1#))   ((resid  71 and name   HZ3))    4.40  1.10  1.10
assign ((resid  20 and name   HB#))   ((resid  77 and name   HE3))    3.20  0.50  0.50
assign ((resid  20 and name   HB#))   ((resid  77 and name   HZ3))    2.35  0.35  0.35
assign ((resid  20 and name   HB#))   ((resid  77 and name   HH2))    3.75  0.75  0.75
assign ((resid  20 and name   HB#))   ((resid  78 and name   HD1) or 
                                       (resid  78 and name   HD2))    2.35  0.35  0.35
assign ((resid  20 and name   HB#))   ((resid  78 and name   HE1) or 
                                       (resid  78 and name   HE2))    2.75  0.35  0.35
assign ((resid  78 and name   HB2) or 
        (resid  78 and name   HB1))   ((resid  77 and name   HE3))    3.75  0.75  0.75
assign ((resid  78 and name   HB1) or 
        (resid  78 and name   HB2))   ((resid  77 and name   HE3))    4.40  1.10  1.10
assign ((resid   9 and name    HA))   ((resid  44 and name   HD1) or 
                                       (resid  44 and name   HD2))    2.35  0.35  0.35
assign ((resid   9 and name    HA))   ((resid  44 and name   HE1) or 
                                       (resid  44 and name   HE2))    3.75  0.75  0.75
assign ((resid  29 and name    HA))   ((resid  33 and name   HD1) or 
                                       (resid  33 and name   HD2))    3.20  0.50  0.50
assign ((resid  12 and name    HA))   ((resid  44 and name   HE1) or 
                                       (resid  44 and name   HE2))    2.75  0.35  0.35
assign ((resid  17 and name    HA))   ((resid  78 and name   HD1) or 
                                       (resid  78 and name   HD2))    3.75  0.75  0.75
assign ((resid  17 and name    HA))   ((resid  78 and name   HE1) or 
                                       (resid  78 and name   HE2))    3.20  0.50  0.50
assign ((resid  77 and name   HZ3))   ((resid  78 and name   HD1) or 
                                       (resid  78 and name   HD2))    3.20  0.50  0.50
assign ((resid  78 and name   HB2) or 
        (resid  78 and name   HB1))   ((resid  78 and name   HD1) or 
                                       (resid  78 and name   HD2))    2.75  0.35  0.35
assign ((resid  78 and name   HB1) or 
        (resid  78 and name   HB2))   ((resid  78 and name   HD1) or 
                                       (resid  78 and name   HD2))    2.75  0.35  0.35
assign ((resid  44 and name   HB2) or 
        (resid  44 and name   HB1))   ((resid  44 and name   HD1) or 
                                       (resid  44 and name   HD2))    2.35  0.35  0.35
assign ((resid  44 and name   HB1) or 
        (resid  44 and name   HB1))   ((resid  44 and name   HD1) or 
                                       (resid  44 and name   HD2))    2.35  0.35  0.35
assign ((resid  77 and name   HB2) or 
        (resid  77 and name   HB1))   ((resid  77 and name   HE3))    3.75  0.75  0.75
assign ((resid  77 and name   HB1) or 
        (resid  77 and name   HB2))   ((resid  77 and name   HE3))    3.75  0.75  0.75
assign ((resid  77 and name   HB2) or 
        (resid  77 and name   HB1))   ((resid  77 and name   HD1))    3.20  0.50  0.50
assign ((resid  77 and name   HB1) or 
        (resid  77 and name   HB2))   ((resid  77 and name   HD1))    3.75  0.75  0.75
assign ((resid  71 and name   HB2) or 
        (resid  71 and name   HB1))   ((resid  71 and name   HE3))    3.20  0.50  0.50
assign ((resid  71 and name   HB1) or 
        (resid  71 and name   HB2))   ((resid  71 and name   HE3))    3.75  0.75  0.75
assign ((resid  71 and name   HB2) or 
        (resid  71 and name   HB1))   ((resid  71 and name   HD1))    3.20  0.50  0.50
assign ((resid  71 and name   HB1) or 
        (resid  71 and name   HB2))   ((resid  71 and name   HD1))    3.20  0.50  0.50
assign ((resid  71 and name    HA))   ((resid  71 and name   HE3))    2.35  0.35  0.35
assign ((resid  78 and name    HA))   ((resid  77 and name   HE3))    3.20  0.50  0.50
assign ((resid  78 and name    HA))   ((resid  78 and name   HD1) or 
                                       (resid  78 and name   HD2))    2.35  0.35  0.35
assign ((resid  71 and name    HA))   ((resid  71 and name   HD1))    3.75  0.75  0.75
assign ((resid  33 and name    HA))   ((resid  33 and name   HD1) or 
                                       (resid  33 and name   HD2))    3.20  0.50  0.50
assign ((resid  77 and name    HA))   ((resid  77 and name   HD1))    3.75  0.75  0.75
assign ((resid  77 and name    HA))   ((resid  77 and name   HE3))    4.40  1.10  1.10
assign ((resid  31 and name    HA))   ((resid  31 and name   HD1) or 
                                       (resid  31 and name   HD2))    3.20  0.50  0.50
assign ((resid  31 and name   HB1) or 
        (resid  31 and name   HB2))   ((resid  31 and name   HD1) or 
                                       (resid  31 and name   HD2))    2.35  0.35  0.35
assign ((resid   7 and name  HG2#))   ((resid  44 and name   HD1) or 
                                       (resid  44 and name   HD2))    2.75  0.35  0.35
assign ((resid   7 and name  HG2#))   ((resid  44 and name   HE1) or 
                                       (resid  44 and name   HE2))    2.35  0.35  0.35
assign ((resid  44 and name    HA))   ((resid  44 and name   HD1) or 
                                       (resid  44 and name   HD2))    2.35  0.35  0.35
assign ((resid  79 and name  HG2#) or 
        (resid  79 and name  HG1#))   ((resid  78 and name   HD1) or 
                                       (resid  78 and name   HD2))    3.75  0.75  0.75
assign ((resid  18 and name  HG11) or 
        (resid  18 and name  HG12))   ((resid  44 and name   HE1) or 
                                       (resid  44 and name   HE2))    3.75  0.75  0.75
assign ((resid   9 and name   HB1) or 
        (resid   9 and name   HB2))   ((resid  44 and name   HD1) or 
                                       (resid  44 and name   HD2))    3.75  0.75  0.75
assign ((resid  32 and name   HB#))   ((resid  33 and name   HD1) or 
                                       (resid  33 and name   HD2))    2.35  0.35  0.35
assign ((resid  32 and name   HB#))   ((resid  33 and name   HE1) or 
                                       (resid  33 and name   HE2))    3.20  0.50  0.50
assign ((resid   1 and name   HE#))   ((resid  33 and name   HD1) or 
                                       (resid  33 and name   HD2))    3.20  0.50  0.50
assign ((resid  67 and name    HG))   ((resid  71 and name   HD1))    3.75  0.75  0.75
assign ((resid  72 and name   HG2) or 
        (resid  72 and name   HG1))   ((resid  71 and name   HD1))    3.75  0.75  0.75
assign ((resid  72 and name   HG1) or 
        (resid  72 and name   HG2))   ((resid  71 and name   HD1))    3.75  0.75  0.75
assign ((resid   7 and name  HD1#))   ((resid  71 and name   HH2))    4.40  1.10  1.10
assign ((resid  63 and name  HD1#))   ((resid  33 and name   HE1) or 
                                       (resid  33 and name   HE2))    3.75  0.75  0.75
assign ((resid  29 and name  HG2#))   ((resid  33 and name   HD1) or 
                                       (resid  33 and name   HD2))    2.35  0.35  0.35
assign ((resid  17 and name   HB#))   ((resid  77 and name   HH2))    4.40  1.10  1.10
assign ((resid  29 and name    HB))   ((resid  33 and name   HD1) or 
                                       (resid  33 and name   HD2))    4.40  1.10  1.10
assign ((resid  36 and name   HB2) or 
        (resid  36 and name   HB1))   ((resid  33 and name   HD1) or 
                                       (resid  33 and name   HD2))    4.40  1.10  1.10
assign ((resid  73 and name   HB2) or 
        (resid  73 and name   HB1))   ((resid  77 and name   HD1))    4.40  1.10  1.10
assign ((resid  34 and name   HD1) or 
        (resid  34 and name   HD2))   ((resid  33 and name   HD1) or 
                                       (resid  33 and name   HD2))    4.40  1.10  1.10
assign ((resid  78 and name    HA))   ((resid  77 and name   HZ3))    4.40  1.10  1.10
assign ((resid   9 and name    HN))   ((resid  10 and name    HN))    3.45  1.03  1.03
assign ((resid  11 and name    HN))   ((resid  10 and name    HN))    2.91  0.87  0.87
assign ((resid   9 and name    HA))   ((resid  10 and name    HN))    3.73  1.12  1.12
assign ((resid  10 and name    HA))   ((resid  10 and name    HN))    3.20  0.96  0.96
assign ((resid  20 and name    HA))   ((resid  23 and name    HN))    3.47  1.04  1.04
assign ((resid  22 and name    HA))   ((resid  23 and name    HN))    3.79  1.14  1.14
assign ((resid  23 and name   HA1) or 
        (resid  23 and name   HA2))   ((resid  23 and name    HN))    2.27  0.68  0.68
assign ((resid  23 and name   HA2) or 
        (resid  23 and name   HA1))   ((resid  23 and name    HN))    2.65  0.80  0.80
assign ((resid   5 and name    HA))   ((resid   5 and name    HN))    3.37  1.01  1.01
assign ((resid  41 and name    HN))   ((resid   5 and name    HN))    3.88  1.16  1.16
assign ((resid   4 and name    HA))   ((resid   5 and name    HN))    2.04  0.61  0.61
assign ((resid   5 and name    HB))   ((resid   5 and name    HN))    2.52  0.76  0.76
assign ((resid  53 and name  HG12) or 
        (resid  53 and name  HG11))   ((resid  53 and name    HN))    3.83  1.15  1.15
assign ((resid  53 and name    HA))   ((resid  53 and name    HN))    2.96  0.89  0.89
assign ((resid  52 and name    HA))   ((resid  53 and name    HN))    2.04  0.61  0.61
assign ((resid  53 and name  HG11) or 
        (resid  53 and name  HG12))   ((resid  53 and name    HN))    3.34  1.00  1.00
assign ((resid   8 and name    HA))   ((resid   8 and name    HN))    3.04  0.91  0.91
assign ((resid   8 and name   HB#))   ((resid   8 and name    HN))    2.24  0.67  0.67
assign ((resid   7 and name    HA))   ((resid   8 and name    HN))    2.17  0.65  0.65
assign ((resid  81 and name    HA))   ((resid  81 and name    HN))    3.66  1.10  1.10
assign ((resid  80 and name    HA))   ((resid  81 and name    HN))    2.32  0.70  0.70
assign ((resid   4 and name   HG1) or 
        (resid   4 and name   HG2))   ((resid   4 and name    HN))    3.73  1.12  1.12
assign ((resid   3 and name  HG2#))   ((resid   4 and name    HN))    2.62  0.78  0.78
assign ((resid   3 and name    HA))   ((resid   4 and name    HN))    2.05  0.62  0.62
assign ((resid  51 and name    HN))   ((resid   4 and name    HN))    3.16  0.95  0.95
assign ((resid   4 and name    HA))   ((resid   4 and name    HN))    3.06  0.92  0.92
assign ((resid   2 and name    HA))   ((resid   3 and name    HN))    2.09  0.63  0.63
assign ((resid   3 and name    HB))   ((resid   3 and name    HN))    2.63  0.79  0.79
assign ((resid   3 and name  HG11) or 
        (resid   3 and name  HG12))   ((resid   3 and name    HN))    3.12  0.93  0.93
assign ((resid   3 and name    HA))   ((resid   3 and name    HN))    3.28  0.98  0.98
assign ((resid  14 and name   HB1) or 
        (resid  14 and name   HB2))   ((resid  15 and name    HN))    3.36  1.01  1.01
assign ((resid  15 and name    HA))   ((resid  15 and name    HN))    2.74  0.82  0.82
assign ((resid  15 and name   HB#))   ((resid  15 and name    HN))    2.19  0.66  0.66
assign ((resid  14 and name    HA))   ((resid  15 and name    HN))    2.17  0.65  0.65
assign ((resid  14 and name   HB2) or 
        (resid  14 and name   HB1))   ((resid  15 and name    HN))    3.53  1.06  1.06
assign ((resid  40 and name    HB))   ((resid  40 and name    HN))    2.56  0.77  0.77
assign ((resid  40 and name    HA))   ((resid  40 and name    HN))    2.01  0.60  0.60
assign ((resid  52 and name    HB))   ((resid  52 and name    HN))    2.88  0.86  0.86
assign ((resid  52 and name    HA))   ((resid  52 and name    HN))    2.06  0.62  0.62
assign ((resid  79 and name    HB))   ((resid  79 and name    HN))    3.05  0.92  0.92
assign ((resid  79 and name    HA))   ((resid  79 and name    HN))    3.31  0.99  0.99
assign ((resid  78 and name    HA))   ((resid  79 and name    HN))    2.28  0.69  0.69
assign ((resid  42 and name    HA))   ((resid  42 and name    HN))    3.22  0.97  0.97
assign ((resid  41 and name    HA))   ((resid  42 and name    HN))    2.50  0.75  0.75
assign ((resid  42 and name    HB))   ((resid  42 and name    HN))    2.54  0.76  0.76
assign ((resid  25 and name    HN))   ((resid  24 and name    HN))    2.72  0.82  0.82
assign ((resid  23 and name   HA2) or 
        (resid  23 and name   HA1))   ((resid  24 and name    HN))    3.52  1.06  1.06
assign ((resid  24 and name    HA))   ((resid  24 and name    HN))    2.81  0.84  0.84
assign ((resid  23 and name   HA1) or 
        (resid  23 and name   HA2))   ((resid  24 and name    HN))    3.03  0.91  0.91
assign ((resid  21 and name    HA))   ((resid  24 and name    HN))    3.82  1.15  1.15
assign ((resid   7 and name    HN))   ((resid  45 and name    HN))    3.62  1.09  1.09
assign ((resid  44 and name   HD1) or 
        (resid  44 and name   HD2))   ((resid  45 and name    HN))    3.27  0.98  0.98
assign ((resid  45 and name    HA))   ((resid  45 and name    HN))    2.84  0.85  0.85
assign ((resid  44 and name    HA))   ((resid  45 and name    HN))    2.04  0.61  0.61
assign ((resid  67 and name    HA))   ((resid  67 and name    HN))    3.17  0.95  0.95
assign ((resid  68 and name    HN))   ((resid  67 and name    HN))    3.08  0.92  0.92
assign ((resid  66 and name    HN))   ((resid  67 and name    HN))    3.08  0.92  0.92
assign ((resid  66 and name    HA))   ((resid  67 and name    HN))    4.21  1.26  1.26
assign ((resid  50 and name   HB2) or 
        (resid  50 and name   HB1))   ((resid  50 and name    HN))    3.24  0.97  0.97
assign ((resid  49 and name    HA))   ((resid  50 and name    HN))    2.14  0.64  0.64
assign ((resid  50 and name   HB1) or 
        (resid  50 and name   HB2))   ((resid  50 and name    HN))    2.86  0.86  0.86
assign ((resid  75 and name    HN))   ((resid  74 and name    HN))    3.35  1.00  1.00
assign ((resid  73 and name    HN))   ((resid  74 and name    HN))    2.82  0.85  0.85
assign ((resid  73 and name    HA))   ((resid  74 and name    HN))    3.02  0.90  0.90
assign ((resid  74 and name    HA))   ((resid  74 and name    HN))    3.54  1.06  1.06
assign ((resid  50 and name    HA))   ((resid  50 and name    HN))    3.44  1.03  1.03
assign ((resid  49 and name   HB1) or 
        (resid  49 and name   HB2))   ((resid  50 and name    HN))    3.88  1.16  1.16
assign ((resid  49 and name   HB2) or 
        (resid  49 and name   HB1))   ((resid  50 and name    HN))    3.89  1.17  1.17
assign ((resid  19 and name    HA))   ((resid  20 and name    HN))    3.76  1.13  1.13
assign ((resid  20 and name    HA))   ((resid  20 and name    HN))    2.81  0.84  0.84
assign ((resid  19 and name   HB1) or 
        (resid  19 and name   HB2))   ((resid  20 and name    HN))    2.90  0.87  0.87
assign ((resid  17 and name    HA))   ((resid  20 and name    HN))    3.19  0.96  0.96
assign ((resid  21 and name    HN))   ((resid  20 and name    HN))    2.64  0.79  0.79
assign ((resid  18 and name    HN))   ((resid  20 and name    HN))    3.56  1.07  1.07
assign ((resid  17 and name    HA))   ((resid  17 and name    HN))    2.58  0.77  0.77
assign ((resid  77 and name    HA))   ((resid  78 and name    HN))    3.21  0.96  0.96
assign ((resid  78 and name    HA))   ((resid  78 and name    HN))    2.98  0.90  0.90
assign ((resid  77 and name    HN))   ((resid  78 and name    HN))    2.51  0.75  0.75
assign ((resid  78 and name   HB2) or 
        (resid  78 and name   HB1))   ((resid  78 and name    HN))    2.82  0.85  0.85
assign ((resid  78 and name   HB1) or 
        (resid  78 and name   HB2))   ((resid  78 and name    HN))    2.85  0.85  0.85
assign ((resid  43 and name    HN))   ((resid   7 and name    HN))    3.32  1.00  1.00
assign ((resid  45 and name    HN))   ((resid   7 and name    HN))    3.77  1.13  1.13
assign ((resid  44 and name    HA))   ((resid   7 and name    HN))    2.88  0.86  0.86
assign ((resid   7 and name    HA))   ((resid   7 and name    HN))    3.40  1.02  1.02
assign ((resid   7 and name    HB))   ((resid   7 and name    HN))    2.70  0.81  0.81
assign ((resid   6 and name    HA))   ((resid   7 and name    HN))    2.18  0.65  0.65
assign ((resid   6 and name    HB))   ((resid   7 and name    HN))    2.93  0.88  0.88
assign ((resid   2 and name   HB2) or 
        (resid   2 and name   HB1))   ((resid   2 and name    HN))    2.68  0.80  0.80
assign ((resid   1 and name    HA))   ((resid   2 and name    HN))    2.05  0.62  0.62
assign ((resid   2 and name    HA))   ((resid   2 and name    HN))    3.14  0.94  0.94
assign ((resid  53 and name    HN))   ((resid   2 and name    HN))    3.15  0.94  0.94
assign ((resid  71 and name    HA))   ((resid  71 and name    HN))    2.90  0.87  0.87
assign ((resid  72 and name    HN))   ((resid  71 and name    HN))    2.77  0.83  0.83
assign ((resid  70 and name    HN))   ((resid  71 and name    HN))    2.71  0.81  0.81
assign ((resid  71 and name   HB1) or 
        (resid  71 and name   HB2))   ((resid  71 and name    HN))    2.52  0.76  0.76
assign ((resid  12 and name    HA))   ((resid  13 and name    HN))    2.21  0.66  0.66
assign ((resid  13 and name    HA))   ((resid  13 and name    HN))    2.93  0.88  0.88
assign ((resid  37 and name    HA))   ((resid  37 and name    HN))    3.26  0.98  0.98
assign ((resid  36 and name    HA))   ((resid  37 and name    HN))    2.16  0.65  0.65
assign ((resid   8 and name    HA))   ((resid   9 and name    HN))    1.99  0.60  0.60
assign ((resid   9 and name   HB1) or 
        (resid   9 and name   HB2))   ((resid   9 and name    HN))    2.48  0.74  0.74
assign ((resid  45 and name    HN))   ((resid   9 and name    HN))    3.25  0.98  0.98
assign ((resid  10 and name    HN))   ((resid   9 and name    HN))    3.32  1.00  1.00
assign ((resid   9 and name    HA))   ((resid   9 and name    HN))    2.05  0.62  0.62
assign ((resid  65 and name    HA))   ((resid  65 and name    HN))    2.68  0.80  0.80
assign ((resid  66 and name    HN))   ((resid  65 and name    HN))    2.77  0.83  0.83
assign ((resid  64 and name    HA))   ((resid  65 and name    HN))    2.75  0.82  0.82
assign ((resid  59 and name    HA))   ((resid  59 and name    HN))    2.89  0.87  0.87
assign ((resid  59 and name   HB1) or 
        (resid  59 and name   HB2))   ((resid  59 and name    HN))    2.61  0.78  0.78
assign ((resid  58 and name    HN))   ((resid  59 and name    HN))    2.62  0.79  0.79
assign ((resid  60 and name    HN))   ((resid  59 and name    HN))    2.73  0.82  0.82
assign ((resid  59 and name   HB2) or 
        (resid  59 and name   HB1))   ((resid  59 and name    HN))    3.06  0.92  0.92
assign ((resid  58 and name    HA))   ((resid  59 and name    HN))    3.66  1.10  1.10
assign ((resid  49 and name   HB1) or 
        (resid  49 and name   HB2))   ((resid  49 and name    HN))    3.51  1.05  1.05
assign ((resid  42 and name    HA))   ((resid  43 and name    HN))    2.10  0.63  0.63
assign ((resid  43 and name    HA))   ((resid  43 and name    HN))    2.99  0.90  0.90
assign ((resid   6 and name    HA))   ((resid  43 and name    HN))    2.73  0.82  0.82
assign ((resid  49 and name   HB2) or 
        (resid  49 and name   HB1))   ((resid  49 and name    HN))    3.32  1.00  1.00
assign ((resid  48 and name    HA))   ((resid  49 and name    HN))    2.29  0.69  0.69
assign ((resid   6 and name    HN))   ((resid  49 and name    HN))    3.16  0.95  0.95
assign ((resid  49 and name    HA))   ((resid  49 and name    HN))    3.24  0.97  0.97
assign ((resid   4 and name    HN))   ((resid  51 and name    HN))    3.52  1.06  1.06
assign ((resid  50 and name    HA))   ((resid  51 and name    HN))    2.17  0.65  0.65
assign ((resid  51 and name    HA))   ((resid  51 and name    HN))    3.06  0.92  0.92
assign ((resid  20 and name    HA))   ((resid  21 and name    HN))    4.24  1.27  1.27
assign ((resid  22 and name    HN))   ((resid  21 and name    HN))    2.99  0.90  0.90
assign ((resid  20 and name    HN))   ((resid  21 and name    HN))    2.75  0.83  0.83
assign ((resid  18 and name    HA))   ((resid  21 and name    HN))    3.81  1.14  1.14
assign ((resid  21 and name    HA))   ((resid  21 and name    HN))    3.10  0.93  0.93
assign ((resid  63 and name    HA))   ((resid  66 and name    HN))    3.71  1.11  1.11
assign ((resid  67 and name    HN))   ((resid  66 and name    HN))    3.02  0.90  0.90
assign ((resid  66 and name    HA))   ((resid  66 and name    HN))    3.08  0.93  0.93
assign ((resid  65 and name    HN))   ((resid  66 and name    HN))    2.85  0.86  0.86
assign ((resid  65 and name    HA))   ((resid  66 and name    HN))    4.13  1.24  1.24
assign ((resid   5 and name    HN))   ((resid  41 and name    HN))    3.63  1.09  1.09
assign ((resid  41 and name    HA))   ((resid  41 and name    HN))    2.43  0.73  0.73
assign ((resid   4 and name    HA))   ((resid  41 and name    HN))    2.97  0.89  0.89
assign ((resid  57 and name   HB2) or 
        (resid  57 and name   HB1))   ((resid  57 and name    HN))    3.58  1.07  1.07
assign ((resid  57 and name   HB1) or 
        (resid  57 and name   HB2))   ((resid  57 and name    HN))    3.38  1.01  1.01
assign ((resid  56 and name    HA))   ((resid  57 and name    HN))    2.89  0.87  0.87
assign ((resid  57 and name    HA))   ((resid  57 and name    HN))    3.59  1.08  1.08
assign ((resid  55 and name    HA))   ((resid  55 and name    HN))    3.73  1.12  1.12
assign ((resid  29 and name  HG12) or 
        (resid  29 and name  HG11))   ((resid  29 and name    HN))    3.03  0.91  0.91
assign ((resid  28 and name    HA))   ((resid  29 and name    HN))    3.64  1.09  1.09
assign ((resid  30 and name    HN))   ((resid  29 and name    HN))    2.48  0.74  0.74
assign ((resid  29 and name    HA))   ((resid  29 and name    HN))    2.85  0.85  0.85
assign ((resid  29 and name    HB))   ((resid  29 and name    HN))    2.32  0.70  0.70
assign ((resid  29 and name  HG11) or 
        (resid  29 and name  HG12))   ((resid  29 and name    HN))    2.80  0.84  0.84
assign ((resid  38 and name    HN))   ((resid  39 and name    HN))    3.69  1.11  1.11
assign ((resid  38 and name   HA2) or 
        (resid  38 and name   HA1))   ((resid  39 and name    HN))    2.85  0.85  0.85
assign ((resid   2 and name    HA))   ((resid  39 and name    HN))    3.15  0.95  0.95
assign ((resid  38 and name   HA1) or 
        (resid  38 and name   HA2))   ((resid  39 and name    HN))    2.34  0.70  0.70
assign ((resid  39 and name    HA))   ((resid  39 and name    HN))    2.47  0.74  0.74
assign ((resid  19 and name    HA))   ((resid  22 and name    HN))    3.62  1.09  1.09
assign ((resid  21 and name    HN))   ((resid  22 and name    HN))    2.68  0.80  0.80
assign ((resid  22 and name    HA))   ((resid  22 and name    HN))    2.64  0.79  0.79
assign ((resid  21 and name    HA))   ((resid  22 and name    HN))    3.93  1.18  1.18
assign ((resid  63 and name    HN))   ((resid  62 and name    HN))    2.81  0.84  0.84
assign ((resid  62 and name    HA))   ((resid  62 and name    HN))    2.83  0.85  0.85
assign ((resid  59 and name    HA))   ((resid  62 and name    HN))    3.39  1.02  1.02
assign ((resid  61 and name    HA))   ((resid  62 and name    HN))    3.62  1.09  1.09
assign ((resid  79 and name    HA))   ((resid  80 and name    HN))    2.09  0.63  0.63
assign ((resid  80 and name    HA))   ((resid  80 and name    HN))    3.15  0.95  0.95
assign ((resid  31 and name    HN))   ((resid  30 and name    HN))    2.81  0.84  0.84
assign ((resid  29 and name    HN))   ((resid  30 and name    HN))    2.68  0.80  0.80
assign ((resid  30 and name    HA))   ((resid  30 and name    HN))    2.59  0.78  0.78
assign ((resid  29 and name    HA))   ((resid  30 and name    HN))    3.34  1.00  1.00
assign ((resid  63 and name    HA))   ((resid  63 and name    HN))    2.99  0.90  0.90
assign ((resid  62 and name    HA))   ((resid  63 and name    HN))    4.10  1.23  1.23
assign ((resid  62 and name    HN))   ((resid  63 and name    HN))    2.67  0.80  0.80
assign ((resid  64 and name    HN))   ((resid  63 and name    HN))    2.68  0.80  0.80
assign ((resid  58 and name    HA))   ((resid  58 and name    HN))    2.82  0.85  0.85
assign ((resid  59 and name    HN))   ((resid  58 and name    HN))    2.69  0.81  0.81
assign ((resid  58 and name   HB2) or 
        (resid  58 and name   HB1))   ((resid  58 and name    HN))    2.70  0.81  0.81
assign ((resid  58 and name   HB1) or 
        (resid  58 and name   HB2))   ((resid  58 and name    HN))    2.56  0.77  0.77
assign ((resid  58 and name   HG2) or 
        (resid  58 and name   HG1))   ((resid  58 and name    HN))    3.68  1.10  1.10
assign ((resid  57 and name    HA))   ((resid  58 and name    HN))    3.94  1.18  1.18
assign ((resid  47 and name    HA))   ((resid  48 and name    HN))    2.13  0.64  0.64
assign ((resid  48 and name    HA))   ((resid  48 and name    HN))    3.05  0.91  0.91
assign ((resid  33 and name    HN))   ((resid  32 and name    HN))    2.35  0.71  0.71
assign ((resid  32 and name    HA))   ((resid  32 and name    HN))    2.75  0.82  0.82
assign ((resid  31 and name    HA))   ((resid  32 and name    HN))    3.92  1.18  1.18
assign ((resid  60 and name    HA))   ((resid  60 and name    HN))    3.60  1.08  1.08
assign ((resid  18 and name    HN))   ((resid  19 and name    HN))    2.73  0.82  0.82
assign ((resid  18 and name  HG2#))   ((resid  19 and name    HN))    3.02  0.91  0.91
assign ((resid  19 and name    HA))   ((resid  19 and name    HN))    2.82  0.85  0.85
assign ((resid  18 and name    HA))   ((resid  19 and name    HN))    3.67  1.10  1.10
assign ((resid  60 and name    HA))   ((resid  61 and name    HN))    4.19  1.26  1.26
assign ((resid  61 and name    HA))   ((resid  61 and name    HN))    2.63  0.79  0.79
assign ((resid  60 and name    HN))   ((resid  61 and name    HN))    3.09  0.93  0.93
assign ((resid  43 and name    HA))   ((resid  44 and name    HN))    2.15  0.65  0.65
assign ((resid  44 and name   HD1) or 
        (resid  44 and name   HD2))   ((resid  44 and name    HN))    3.04  0.91  0.91
assign ((resid  45 and name    HN))   ((resid  44 and name    HN))    3.90  1.17  1.17
assign ((resid  44 and name    HA))   ((resid  44 and name    HN))    3.13  0.94  0.94
assign ((resid  49 and name    HN))   ((resid   6 and name    HN))    3.31  0.99  0.99
assign ((resid   5 and name    HA))   ((resid   6 and name    HN))    2.24  0.67  0.67
assign ((resid   6 and name  HG2#))   ((resid   6 and name    HN))    3.43  1.03  1.03
assign ((resid   6 and name    HA))   ((resid   6 and name    HN))    3.62  1.09  1.09
assign ((resid  70 and name    HA))   ((resid  70 and name    HN))    3.10  0.93  0.93
assign ((resid  70 and name    HB))   ((resid  70 and name    HN))    2.72  0.82  0.82
assign ((resid  66 and name  HG2#))   ((resid  70 and name    HN))    3.57  1.07  1.07
assign ((resid  71 and name    HN))   ((resid  70 and name    HN))    2.92  0.88  0.88
assign ((resid  24 and name    HA))   ((resid  25 and name    HN))    4.10  1.23  1.23
assign ((resid  25 and name    HA))   ((resid  25 and name    HN))    3.11  0.93  0.93
assign ((resid  26 and name    HN))   ((resid  25 and name    HN))    3.00  0.90  0.90
assign ((resid  24 and name    HN))   ((resid  25 and name    HN))    2.95  0.89  0.89
assign ((resid  36 and name   HB1) or 
        (resid  36 and name   HB2))   ((resid  36 and name    HN))    2.73  0.82  0.82
assign ((resid  36 and name   HB2) or 
        (resid  36 and name   HB1))   ((resid  36 and name    HN))    2.63  0.79  0.79
assign ((resid  36 and name    HA))   ((resid  36 and name    HN))    2.39  0.72  0.72
assign ((resid  35 and name    HN))   ((resid  36 and name    HN))    2.39  0.72  0.72
assign ((resid  67 and name    HN))   ((resid  68 and name    HN))    3.11  0.93  0.93
assign ((resid  69 and name    HN))   ((resid  68 and name    HN))    2.93  0.88  0.88
assign ((resid  10 and name    HA))   ((resid  11 and name    HN))    2.91  0.87  0.87
assign ((resid  11 and name    HA))   ((resid  11 and name    HN))    2.49  0.75  0.75
assign ((resid  10 and name    HN))   ((resid  11 and name    HN))    2.68  0.80  0.80
assign ((resid  68 and name    HN))   ((resid  69 and name    HN))    3.02  0.90  0.90
assign ((resid  69 and name    HA))   ((resid  69 and name    HN))    2.75  0.83  0.83
assign ((resid  28 and name    HA))   ((resid  28 and name    HN))    2.81  0.84  0.84
assign ((resid  27 and name    HN))   ((resid  28 and name    HN))    2.85  0.86  0.86
assign ((resid  29 and name    HN))   ((resid  28 and name    HN))    2.79  0.84  0.84
assign ((resid  71 and name    HA))   ((resid  72 and name    HN))    3.48  1.04  1.04
assign ((resid  73 and name    HN))   ((resid  72 and name    HN))    2.94  0.88  0.88
assign ((resid  72 and name    HA))   ((resid  72 and name    HN))    2.84  0.85  0.85
assign ((resid  72 and name   HG1) or 
        (resid  72 and name   HG2))   ((resid  72 and name    HN))    3.31  0.99  0.99
assign ((resid  71 and name    HN))   ((resid  72 and name    HN))    2.99  0.90  0.90
assign ((resid  17 and name    HA))   ((resid  18 and name    HN))    3.71  1.11  1.11
assign ((resid  18 and name  HG2#))   ((resid  18 and name    HN))    3.02  0.91  0.91
assign ((resid  19 and name    HN))   ((resid  18 and name    HN))    2.84  0.85  0.85
assign ((resid  18 and name  HG11) or 
        (resid  18 and name  HG12))   ((resid  18 and name    HN))    2.79  0.84  0.84
assign ((resid  18 and name    HA))   ((resid  18 and name    HN))    2.90  0.87  0.87
assign ((resid  18 and name    HB))   ((resid  18 and name    HN))    2.39  0.72  0.72
assign ((resid  18 and name  HG12) or 
        (resid  18 and name  HG11))   ((resid  18 and name    HN))    3.00  0.90  0.90
assign ((resid  75 and name    HA))   ((resid  76 and name    HN))    3.12  0.94  0.94
assign ((resid  77 and name    HN))   ((resid  76 and name    HN))    2.64  0.79  0.79
assign ((resid  76 and name    HA))   ((resid  76 and name    HN))    2.81  0.84  0.84
assign ((resid  46 and name    HA))   ((resid  47 and name    HN))    3.22  0.97  0.97
assign ((resid  46 and name   HB#))   ((resid  47 and name    HN))    2.68  0.80  0.80
assign ((resid  45 and name   HB#))   ((resid  47 and name    HN))    2.60  0.78  0.78
assign ((resid  47 and name    HA))   ((resid  47 and name    HN))    2.84  0.85  0.85
assign ((resid   8 and name    HA))   ((resid  47 and name    HN))    3.76  1.13  1.13
assign ((resid  35 and name   HB2) or 
        (resid  35 and name   HB1))   ((resid  35 and name    HN))    2.73  0.82  0.82
assign ((resid  36 and name    HN))   ((resid  35 and name    HN))    2.31  0.69  0.69
assign ((resid  35 and name   HB1) or 
        (resid  35 and name   HB2))   ((resid  35 and name    HN))    3.01  0.90  0.90
assign ((resid  35 and name    HA))   ((resid  35 and name    HN))    2.54  0.76  0.76
assign ((resid  34 and name    HA))   ((resid  35 and name    HN))    2.74  0.82  0.82
assign ((resid  63 and name    HA))   ((resid  64 and name    HN))    4.15  1.25  1.25
assign ((resid  65 and name    HN))   ((resid  64 and name    HN))    2.69  0.81  0.81
assign ((resid  63 and name    HN))   ((resid  64 and name    HN))    2.85  0.86  0.86
assign ((resid  32 and name   HB#))   ((resid  33 and name    HN))    2.75  0.83  0.83
assign ((resid  32 and name    HN))   ((resid  33 and name    HN))    2.36  0.71  0.71
assign ((resid  33 and name    HA))   ((resid  33 and name    HN))    3.03  0.91  0.91
assign ((resid  32 and name    HA))   ((resid  33 and name    HN))    3.40  1.02  1.02
assign ((resid  30 and name    HA))   ((resid  33 and name    HN))    3.50  1.05  1.05
assign ((resid  28 and name    HA))   ((resid  31 and name    HN))    3.32  1.00  1.00
assign ((resid  30 and name    HA))   ((resid  31 and name    HN))    3.43  1.03  1.03
assign ((resid  30 and name    HN))   ((resid  31 and name    HN))    2.68  0.80  0.80
assign ((resid  31 and name    HA))   ((resid  31 and name    HN))    2.73  0.82  0.82
assign ((resid  74 and name   HB#))   ((resid  75 and name    HN))    3.01  0.90  0.90
assign ((resid  75 and name    HA))   ((resid  75 and name    HN))    2.72  0.81  0.81
assign ((resid  74 and name    HN))   ((resid  75 and name    HN))    3.09  0.93  0.93
assign ((resid  74 and name    HA))   ((resid  75 and name    HN))    3.73  1.12  1.12
assign ((resid  76 and name    HN))   ((resid  77 and name    HN))    3.23  0.97  0.97
assign ((resid  78 and name    HN))   ((resid  77 and name    HN))    2.82  0.85  0.85
assign ((resid  77 and name    HA))   ((resid  77 and name    HN))    3.82  1.14  1.14
assign ((resid  72 and name    HA))   ((resid  73 and name    HN))    3.35  1.00  1.00
assign ((resid  74 and name    HN))   ((resid  73 and name    HN))    2.74  0.82  0.82
assign ((resid  73 and name    HA))   ((resid  73 and name    HN))    2.64  0.79  0.79
assign ((resid  72 and name    HN))   ((resid  73 and name    HN))    2.91  0.87  0.87
assign ((resid  25 and name    HA))   ((resid  26 and name    HN))    3.25  0.98  0.98
assign ((resid  27 and name    HN))   ((resid  26 and name    HN))    2.77  0.83  0.83
assign ((resid  26 and name    HA))   ((resid  26 and name    HN))    2.27  0.68  0.68
assign ((resid  25 and name    HN))   ((resid  26 and name    HN))    2.79  0.84  0.84
assign ((resid  56 and name  HG2#))   ((resid  56 and name    HN))    2.22  0.66  0.66
assign ((resid  55 and name    HA))   ((resid  56 and name    HN))    2.20  0.66  0.66
assign ((resid  55 and name   HB#))   ((resid  56 and name    HN))    2.56  0.77  0.77
assign ((resid  56 and name    HA))   ((resid  56 and name    HN))    2.85  0.85  0.85
assign ((resid  38 and name   HA2) or 
        (resid  38 and name   HA1))   ((resid  38 and name    HN))    2.63  0.79  0.79
assign ((resid  38 and name   HA1) or 
        (resid  38 and name   HA2))   ((resid  38 and name    HN))    1.98  0.60  0.60
assign ((resid   7 and name  HD1#))
       ((resid  21 and name  HD1#) or
        (resid  21 and name  HD2#) or
        (resid  13 and name  HD1#) or
        (resid  13 and name  HD2#))  1.99  1.99  0.50
assign ((resid  18 and name  HD1#))
       ((resid  43 and name    HA) or
        (resid  13 and name    HA))  3.19  3.19  0.80
assign ((resid  18 and name  HD1#))
       ((resid  21 and name  HD1#) or
        (resid  21 and name  HD2#) or
        (resid  13 and name  HD1#) or
        (resid  13 and name  HD2#) or
        (resid   5 and name  HG1#))  2.84  2.84  0.71
assign ((resid  28 and name   HB1) or
        (resid  28 and name   HB2))
       ((resid  66 and name  HG2#) or
        (resid  66 and name  HD1#))  2.29  2.29  0.57
assign ((resid  67 and name    HG))
       ((resid  50 and name  HD1#) or
        (resid  50 and name  HD2#) or
        (resid  25 and name  HD2#) or
        (resid  25 and name  HD1#))  3.16  3.16  0.79
assign ((resid  21 and name    HG))
       ((resid  25 and name  HD1#) or
        (resid  25 and name  HD2#) or
        (resid  42 and name  HG1#))  2.33  2.33  0.58
assign ((resid  50 and name  HD1#) or
        (resid  50 and name  HD2#))
       ((resid  64 and name    HA) or
        (resid  64 and name   HB1) or
        (resid  64 and name   HB2))  2.69  2.69  0.67
assign ((resid  21 and name  HD1#) or
        (resid  21 and name  HD2#) or
        (resid  13 and name  HD1#) or
        (resid  13 and name  HD2#))
       ((resid   7 and name  HD1#))  2.56  2.56  0.64
assign ((resid  66 and name    HA))
       ((resid  70 and name    HN) or
        (resid  69 and name    HN))  2.88  2.88  0.72
assign ((resid  67 and name  HD2#) or
        (resid  67 and name  HD1#))
       ((resid  25 and name  HD1#) or
        (resid  25 and name  HD2#) or
        (resid  50 and name  HD2#) or
        (resid  50 and name  HD1#))  2.24  2.24  0.56
assign ((resid  55 and name   HB#))
       ((resid  60 and name   HB2) or
        (resid  60 and name   HB1) or
        (resid   1 and name   HB1) or
        (resid   1 and name   HB2))  2.85  2.85  0.71
assign ((resid  52 and name  HG1#))
       ((resid   3 and name  HG11) or
        (resid   3 and name  HG12) or
        (resid  60 and name   HG1) or
        (resid  60 and name   HG2))  3.06  3.06  0.77
assign ((resid  52 and name  HG1#))
       ((resid  55 and name   HB#) or
        (resid   1 and name   HE#))  2.29  2.29  0.57
assign ((resid  64 and name    HA))
       ((resid  50 and name  HD1#) or
        (resid  50 and name  HD2#) or
        (resid  63 and name  HG2#))  4.50  4.50  0.00
assign ((resid  40 and name  HG2#))
       ((resid  26 and name   HB1) or
        (resid  26 and name   HB2) or
        (resid  26 and name    HA))  2.83  2.83  0.71
assign ((resid  40 and name  HG1#))
       ((resid  25 and name   HB1) or
        (resid  25 and name   HB2) or
        (resid  25 and name    HG))  3.04  3.04  0.76
assign ((resid  67 and name   HB1) or
        (resid  67 and name   HB2))
       ((resid  63 and name  HG2#) or
        (resid  25 and name  HD2#) or
        (resid  25 and name  HD1#) or
        (resid  50 and name  HD1#) or
        (resid  50 and name  HD2#))  2.68  2.68  0.67
assign ((resid  56 and name    HA))
       ((resid  57 and name    HN) or
        (resid  58 and name    HN))  2.58  2.58  0.64
assign ((resid   3 and name    HA))
       ((resid  51 and name    HA) or
        (resid  52 and name    HA))  2.24  2.24  0.56
assign ((resid  58 and name    HA))
       ((resid  61 and name    HN) or
        (resid  59 and name    HN))  2.94  2.94  0.73
assign ((resid  59 and name   HB1) or
        (resid  59 and name   HB2))
       ((resid  55 and name   HB#) or
        (resid   1 and name   HE#))  2.26  2.26  0.57
assign ((resid  59 and name   HB2) or
        (resid  59 and name   HB1))
       ((resid  55 and name   HB#) or
        (resid   1 and name   HE#))  2.27  2.27  0.57
assign ((resid  68 and name    HA) or
        (resid  65 and name    HA))
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assign ((resid  62 and name    HA))
       ((resid  65 and name    HN) or
        (resid  62 and name    HN))  2.31  2.31  0.58
assign ((resid  80 and name    HA))
       ((resid  79 and name  HG2#) or
        (resid  79 and name  HG1#))  4.34  4.34  1.09
assign ((resid  21 and name    HA))
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        (resid  25 and name  HD1#) or
        (resid  24 and name   HB2) or
        (resid  24 and name   HB1))  2.70  2.70  0.68
assign ((resid  63 and name  HG2#))
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        (resid   3 and name  HG12) or
        (resid  29 and name  HG11) or
        (resid  29 and name  HG12))  3.32  3.32  0.83
assign ((resid  37 and name    HA))
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        (resid  39 and name    HA))  3.40  3.40  0.85
assign ((resid   1 and name   HE#))
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        (resid  29 and name  HG2#))  2.37  2.37  0.59
assign ((resid   1 and name   HE#))
       ((resid  59 and name   HB2) or
        (resid  59 and name   HB1) or
        (resid  37 and name   HG1) or
        (resid  37 and name   HG2))  3.23  3.23  0.81
assign ((resid   3 and name  HD1#))
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        (resid  66 and name  HG11) or
        (resid  66 and name  HG12) or
        (resid   1 and name   HB1) or
        (resid   1 and name   HB2))  3.35  3.35  0.84
assign ((resid   4 and name    HA))
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        (resid  41 and name   HB1))  2.71  2.71  0.68
assign ((resid  15 and name    HA))
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        (resid  15 and name    HN))  2.50  2.50  0.62
assign ((resid  43 and name    HA))
       ((resid  18 and name  HG2#) or
        (resid  42 and name  HG1#))  4.50  4.50  0.00
assign ((resid  52 and name    HB) or
        (resid  42 and name    HB))
       ((resid  63 and name  HD1#) or
        (resid   7 and name  HD1#))  4.50  4.50  0.00
assign ((resid  63 and name  HD1#))
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        (resid  55 and name   HB#))  2.75  2.75  0.69
assign ((resid  40 and name    HB))
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        (resid  26 and name   HB1) or
        (resid  26 and name   HB2))  3.20  3.20  0.80
assign ((resid  79 and name    HB))
       ((resid  78 and name    HN) or
        (resid  80 and name    HN))  4.03  4.03  1.01
assign ((resid  13 and name   HB2) or
        (resid  13 and name   HB1) or
        (resid   9 and name   HG1) or
        (resid   9 and name   HG2) or
        (resid   7 and name    HB))
       ((resid  44 and name   HD1) or
        (resid  44 and name   HD2))  2.75  2.75  0.35
assign ((resid  13 and name   HB2) or
        (resid  13 and name   HB1) or
        (resid   7 and name    HB))
       ((resid  44 and name   HE1) or
        (resid  44 and name   HE2))  3.75  3.75  0.75
assign ((resid  42 and name  HG1#) or
        (resid  18 and name  HG2#))
       ((resid  44 and name   HE1) or
        (resid  44 and name   HE2))  3.75  3.75  0.75
assign ((resid  42 and name  HG1#) or
        (resid  18 and name  HG2#))
       ((resid  44 and name   HD1) or
        (resid  44 and name   HD2))  4.40  4.40  1.10
assign ((resid  24 and name   HB2) or
        (resid  24 and name   HB1) or
        (resid  25 and name  HD1#) or
        (resid  25 and name  HD2#) or
        (resid  18 and name  HG2#) or
        (resid  42 and name  HG1#))
       ((resid  77 and name   HH2))  2.75  2.75  0.35
assign ((resid   5 and name  HG1#) or
        (resid  13 and name  HD1#) or
        (resid  13 and name  HD2#))
       ((resid  44 and name   HE1) or
        (resid  44 and name   HE2))  3.75  3.75  0.75
assign ((resid   7 and name  HG11) or
        (resid   7 and name  HG12) or
        (resid  18 and name  HG12) or
        (resid  18 and name  HG11))
       ((resid  44 and name   HE1) or
        (resid  44 and name   HE2))  3.75  3.75  0.75
assign ((resid  18 and name    HB) or
        (resid  42 and name    HB) or
        (resid  13 and name    HG))
       ((resid  44 and name   HE1) or
        (resid  44 and name   HE2))  3.75  3.75  0.75
assign ((resid  67 and name  HD1#) or
        (resid  67 and name  HD2#) or
        (resid  21 and name  HD2#) or
        (resid  21 and name  HD1#) or
        (resid  74 and name   HB#))
       ((resid  71 and name   HD1))  3.75  3.75  0.75
assign ((resid  18 and name  HG11) or
        (resid  18 and name  HG12) or
        (resid  17 and name   HB#))
       ((resid  78 and name   HD1) or
        (resid  78 and name   HD2))  3.75  3.75  0.75
assign ((resid  18 and name  HG11) or
        (resid  18 and name  HG12) or
        (resid  17 and name   HB#))
       ((resid  78 and name   HE1) or
        (resid  78 and name   HE2))  3.20  3.20  0.50
assign ((resid  21 and name  HD2#) or
        (resid  21 and name  HD1#) or
        (resid  74 and name   HB#) or
        (resid  13 and name  HD2#) or
        (resid  13 and name  HD1#))
       ((resid  78 and name   HD1) or
        (resid  78 and name   HD2))  3.75  3.75  0.75
assign ((resid  29 and name  HD1#) or
        (resid  66 and name  HD1#) or
        (resid   3 and name  HD1#))
       ((resid  33 and name   HD1) or
        (resid  33 and name   HD2))  3.20  3.20  0.50
assign ((resid  55 and name   HB#) or
        (resid   1 and name   HE#))
       ((resid  33 and name   HE1) or
        (resid  33 and name   HE2))  3.20  3.20  0.50
assign ((resid  67 and name  HD1#) or
        (resid  67 and name  HD2#) or
        (resid  21 and name  HD2#) or
        (resid  21 and name  HD1#) or
        (resid  74 and name   HB#))
       ((resid  77 and name   HH2))  4.40  4.40  1.10
assign ((resid  21 and name  HD2#) or
        (resid  21 and name  HD1#) or
        (resid  74 and name   HB#) or
        (resid  13 and name  HD1#) or
        (resid  13 and name  HD2#))
       ((resid  77 and name   HZ3))  4.40  4.40  1.10
assign ((resid  24 and name   HB2) or
        (resid  24 and name   HB1) or
        (resid  25 and name  HD2#) or
        (resid  25 and name  HD1#) or
        (resid  18 and name  HG2#))
       ((resid  77 and name   HZ3))  3.75  3.75  0.75
assign ((resid   5 and name  HG1#) or
        (resid  50 and name  HD1#) or
        (resid  50 and name  HD2#) or
        (resid   5 and name  HG2#) or
        (resid  13 and name  HD1#) or
        (resid  13 and name  HD2#))
       ((resid  71 and name   HZ3))  3.20  3.20  0.50
assign ((resid  67 and name  HD1#) or
        (resid  67 and name  HD2#) or
        (resid  21 and name  HD2#) or
        (resid  21 and name  HD1#) or
        (resid  74 and name   HB#))
       ((resid  71 and name   HZ3))  3.75  3.75  0.75
assign ((resid  67 and name  HD1#) or
        (resid  67 and name  HD2#) or
        (resid  21 and name  HD2#) or
        (resid  21 and name  HD1#) or
        (resid  74 and name   HB#))
       ((resid  71 and name   HE3) or
        (resid  77 and name   HE3))  3.20  3.20  0.50
assign ((resid  50 and name  HD1#) or
        (resid  50 and name  HD2#) or
        (resid   5 and name  HG2#) or
        (resid  79 and name  HG2#) or
        (resid  79 and name  HG1#))
       ((resid  71 and name   HE3) or
        (resid  77 and name   HE3))  3.20  3.20  0.50
assign ((resid  20 and name    HA) or
        (resid  70 and name    HB))
       ((resid  77 and name   HE3))  4.40  4.40  1.10




! DinI dihedral restraint file

assign (resid   1 and name c ) (resid   2 and name n )
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assign (resid   2 and name c ) (resid   3 and name n )
       (resid   3 and name ca) (resid   3 and name c )   1 -120.00   30.00  2

assign (resid   3 and name c ) (resid   4 and name n )
       (resid   4 and name ca) (resid   4 and name c )   1 -120.00   30.00  2

assign (resid   4 and name c ) (resid   5 and name n )
       (resid   5 and name ca) (resid   5 and name c )   1 -120.00   30.00  2

assign (resid   5 and name c ) (resid   6 and name n )
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assign (resid   6 and name c ) (resid   7 and name n )
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assign (resid   7 and name c ) (resid   8 and name n )
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assign (resid   8 and name c ) (resid   9 and name n )
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assign (resid   9 and name c ) (resid  10 and name n )
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assign (resid  10 and name c ) (resid  11 and name n )
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assign (resid  11 and name c ) (resid  12 and name n )
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assign (resid  12 and name c ) (resid  13 and name n )
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assign (resid  13 and name c ) (resid  14 and name n )
       (resid  14 and name ca) (resid  14 and name c )   1  -90.00   90.00  2

assign (resid  14 and name c ) (resid  15 and name n )
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assign (resid  16 and name c ) (resid  17 and name n )
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assign (resid  17 and name c ) (resid  18 and name n )
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assign (resid  18 and name c ) (resid  19 and name n )
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assign (resid  19 and name c ) (resid  20 and name n )
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assign (resid  20 and name c ) (resid  21 and name n )
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assign (resid  21 and name c ) (resid  22 and name n )
       (resid  22 and name ca) (resid  22 and name c )   1  -40.00   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  -90.00   90.00  2

assign (resid  24 and name c ) (resid  25 and name n )
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assign (resid  25 and name c ) (resid  26 and name n )
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assign (resid  26 and name c ) (resid  27 and name n )
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assign (resid  27 and name c ) (resid  28 and name n )
       (resid  28 and name ca) (resid  28 and name c )   1  -40.00   30.00  2

assign (resid  28 and name c ) (resid  29 and name n )
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assign (resid  29 and name c ) (resid  30 and name n )
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assign (resid  30 and name c ) (resid  31 and name n )
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assign (resid  31 and name c ) (resid  32 and name n )
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assign (resid  32 and name c ) (resid  33 and name n )
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assign (resid  33 and name c ) (resid  34 and name n )
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assign (resid  34 and name c ) (resid  35 and name n )
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assign (resid  35 and name c ) (resid  36 and name n )
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assign (resid  36 and name c ) (resid  37 and name n )
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assign (resid  38 and name c ) (resid  39 and name n )
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assign (resid  39 and name c ) (resid  40 and name n )
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assign (resid  40 and name c ) (resid  41 and name n )
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assign (resid  41 and name c ) (resid  42 and name n )
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assign (resid  42 and name c ) (resid  43 and name n )
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assign (resid  43 and name c ) (resid  44 and name n )
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assign (resid  44 and name c ) (resid  45 and name n )
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assign (resid  45 and name c ) (resid  46 and name n )
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assign (resid  46 and name c ) (resid  47 and name n )
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assign (resid  47 and name c ) (resid  48 and name n )
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assign (resid  48 and name c ) (resid  49 and name n )
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assign (resid  49 and name c ) (resid  50 and name n )
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assign (resid  50 and name c ) (resid  51 and name n )
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assign (resid  51 and name c ) (resid  52 and name n )
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assign (resid  52 and name c ) (resid  53 and name n )
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assign (resid  54 and name c ) (resid  55 and name n )
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assign (resid  55 and name c ) (resid  56 and name n )
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assign (resid  56 and name c ) (resid  57 and name n )
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assign (resid  57 and name c ) (resid  58 and name n )
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assign (resid  58 and name c ) (resid  59 and name n )
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assign (resid  59 and name c ) (resid  60 and name n )
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assign (resid  60 and name c ) (resid  61 and name n )
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assign (resid  61 and name c ) (resid  62 and name n )
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assign (resid  62 and name c ) (resid  63 and name n )
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assign (resid  63 and name c ) (resid  64 and name n )
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assign (resid  64 and name c ) (resid  65 and name n )
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assign (resid  65 and name c ) (resid  66 and name n )
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assign (resid  66 and name c ) (resid  67 and name n )
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assign (resid  67 and name c ) (resid  68 and name n )
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assign (resid  68 and name c ) (resid  69 and name n )
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assign (resid  69 and name c ) (resid  70 and name n )
       (resid  70 and name ca) (resid  70 and name c )   1  -90.00   90.00  2

assign (resid  70 and name c ) (resid  71 and name n )
       (resid  71 and name ca) (resid  71 and name c )   1  -40.00   30.00  2

assign (resid  71 and name c ) (resid  72 and name n )
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assign (resid  72 and name c ) (resid  73 and name n )
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assign (resid  73 and name c ) (resid  74 and name n )
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assign (resid  74 and name c ) (resid  75 and name n )
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assign (resid  75 and name c ) (resid  76 and name n )
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assign (resid  76 and name c ) (resid  77 and name n )
       (resid  77 and name ca) (resid  77 and name c )   1 -120.00   30.00  2

assign (resid  77 and name c ) (resid  78 and name n )
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assign (resid  78 and name c ) (resid  79 and name n )
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assign (resid  79 and name c ) (resid  80 and name n )
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assign (resid  80 and name c ) (resid  81 and name n )
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assign (resid   1 and name n ) (resid   1 and name ca)
       (resid   1 and name c ) (resid   2 and name n )   1  120.00   30.00  2

assign (resid   2 and name n ) (resid   2 and name ca)
       (resid   2 and name c ) (resid   3 and name n )   1  120.00   30.00  2

assign (resid   3 and name n ) (resid   3 and name ca)
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assign (resid   4 and name n ) (resid   4 and name ca)
       (resid   4 and name c ) (resid   5 and name n )   1  120.00   30.00  2

assign (resid   5 and name n ) (resid   5 and name ca)
       (resid   5 and name c ) (resid   6 and name n )   1  120.00   30.00  2

assign (resid   6 and name n ) (resid   6 and name ca)
       (resid   6 and name c ) (resid   7 and name n )   1  120.00   30.00  2

assign (resid   7 and name n ) (resid   7 and name ca)
       (resid   7 and name c ) (resid   8 and name n )   1  120.00   40.00  2

assign (resid   9 and name n ) (resid   9 and name ca)
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assign (resid  10 and name n ) (resid  10 and name ca)
       (resid  10 and name c ) (resid  11 and name n )   1  -60.00   90.00  2

assign (resid  12 and name n ) (resid  12 and name ca)
       (resid  12 and name c ) (resid  13 and name n )   1  120.00   60.00  2

assign (resid  14 and name n ) (resid  14 and name ca)
       (resid  14 and name c ) (resid  15 and name n )   1  120.00   60.00  2

assign (resid  17 and name n ) (resid  17 and name ca)
       (resid  17 and name c ) (resid  18 and name n )   1  -60.00   60.00  2

assign (resid  18 and name n ) (resid  18 and name ca)
       (resid  18 and name c ) (resid  19 and name n )   1  -60.00   60.00  2

assign (resid  19 and name n ) (resid  19 and name ca)
       (resid  19 and name c ) (resid  20 and name n )   1  -60.00   40.00  2

assign (resid  20 and name n ) (resid  20 and name ca)
       (resid  20 and name c ) (resid  21 and name n )   1  -60.00   40.00  2

assign (resid  21 and name n ) (resid  21 and name ca)
       (resid  21 and name c ) (resid  22 and name n )   1  -60.00   40.00  2

assign (resid  24 and name n ) (resid  24 and name ca)
       (resid  24 and name c ) (resid  25 and name n )   1  -60.00   60.00  2

assign (resid  25 and name n ) (resid  25 and name ca)
       (resid  25 and name c ) (resid  26 and name n )   1  -60.00   40.00  2

assign (resid  28 and name n ) (resid  28 and name ca)
       (resid  28 and name c ) (resid  29 and name n )   1  -60.00   60.00  2

assign (resid  29 and name n ) (resid  29 and name ca)
       (resid  29 and name c ) (resid  30 and name n )   1  -60.00   60.00  2

assign (resid  30 and name n ) (resid  30 and name ca)
       (resid  30 and name c ) (resid  31 and name n )   1  -60.00   60.00  2

assign (resid  31 and name n ) (resid  31 and name ca)
       (resid  31 and name c ) (resid  32 and name n )   1  -60.00   40.00  2

assign (resid  32 and name n ) (resid  32 and name ca)
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assign (resid  36 and name n ) (resid  36 and name ca)
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assign (resid  41 and name n ) (resid  41 and name ca)
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assign (resid  42 and name n ) (resid  42 and name ca)
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assign (resid  43 and name n ) (resid  43 and name ca)
       (resid  43 and name c ) (resid  44 and name n )   1  120.00   40.00  2

assign (resid  44 and name n ) (resid  44 and name ca)
       (resid  44 and name c ) (resid  45 and name n )   1  120.00   40.00  2

assign (resid  46 and name n ) (resid  46 and name ca)
       (resid  46 and name c ) (resid  47 and name n )   1  -60.00   90.00  2

assign (resid  47 and name n ) (resid  47 and name ca)
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assign (resid  48 and name n ) (resid  48 and name ca)
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assign (resid  49 and name n ) (resid  49 and name ca)
       (resid  49 and name c ) (resid  50 and name n )   1  120.00   30.00  2

assign (resid  50 and name n ) (resid  50 and name ca)
       (resid  50 and name c ) (resid  51 and name n )   1  120.00   40.00  2

assign (resid  52 and name n ) (resid  52 and name ca)
       (resid  52 and name c ) (resid  53 and name n )   1  120.00   40.00  2

assign (resid  55 and name n ) (resid  55 and name ca)
       (resid  55 and name c ) (resid  56 and name n )   1  120.00   60.00  2

assign (resid  56 and name n ) (resid  56 and name ca)
       (resid  56 and name c ) (resid  57 and name n )   1  120.00   60.00  2

assign (resid  57 and name n ) (resid  57 and name ca)
       (resid  57 and name c ) (resid  58 and name n )   1  -60.00   40.00  2

assign (resid  58 and name n ) (resid  58 and name ca)
       (resid  58 and name c ) (resid  59 and name n )   1  -60.00   60.00  2

assign (resid  60 and name n ) (resid  60 and name ca)
       (resid  60 and name c ) (resid  61 and name n )   1  -60.00   40.00  2

assign (resid  61 and name n ) (resid  61 and name ca)
       (resid  61 and name c ) (resid  62 and name n )   1  -60.00   60.00  2

assign (resid  62 and name n ) (resid  62 and name ca)
       (resid  62 and name c ) (resid  63 and name n )   1  -60.00   40.00  2

assign (resid  65 and name n ) (resid  65 and name ca)
       (resid  65 and name c ) (resid  66 and name n )   1  -60.00   40.00  2

assign (resid  66 and name n ) (resid  66 and name ca)
       (resid  66 and name c ) (resid  67 and name n )   1  -60.00   40.00  2

assign (resid  71 and name n ) (resid  71 and name ca)
       (resid  71 and name c ) (resid  72 and name n )   1  -60.00   60.00  2

assign (resid  72 and name n ) (resid  72 and name ca)
       (resid  72 and name c ) (resid  73 and name n )   1  -60.00   60.00  2

assign (resid  73 and name n ) (resid  73 and name ca)
       (resid  73 and name c ) (resid  74 and name n )   1  120.00   90.00  2

assign (resid  74 and name n ) (resid  74 and name ca)
       (resid  74 and name c ) (resid  75 and name n )   1  -60.00   40.00  2

assign (resid  75 and name n ) (resid  75 and name ca)
       (resid  75 and name c ) (resid  76 and name n )   1  -60.00   90.00  2

assign (resid  78 and name n ) (resid  78 and name ca)
       (resid  78 and name c ) (resid  79 and name n )   1  120.00   40.00  2

assign (resid  79 and name n ) (resid  79 and name ca)
       (resid  79 and name c ) (resid  80 and name n )   1  120.00   30.00  2

assign (resid  80 and name n ) (resid  80 and name ca)
       (resid  80 and name c ) (resid  81 and name n )   1  120.00   30.00  2

assign (resid   3 and name n ) (resid   3 and name ca)
       (resid   3 and name cb) (resid   3 and name cg2)   1  180.00   20.00  2

assign (resid   5 and name n ) (resid   5 and name ca)
       (resid   5 and name cb) (resid   5 and name cg1)   1  180.00   20.00  2

assign (resid   5 and name c ) (resid   5 and name ca)
       (resid   5 and name cb) (resid   5 and name cg2)   1  180.00   20.00  2

assign (resid   7 and name n ) (resid   7 and name ca)
       (resid   7 and name cb) (resid   7 and name cg2)   1  180.00   20.00  2

assign (resid  10 and name c ) (resid  10 and name ca)
       (resid  10 and name cb) (resid  10 and name cg2)   1  180.00   20.00  2

assign (resid  29 and name n ) (resid  29 and name ca)
       (resid  29 and name cb) (resid  29 and name cg2)   1  180.00   30.00  2

assign (resid  40 and name n ) (resid  40 and name ca)
       (resid  40 and name cb) (resid  40 and name cg1)   1  180.00   30.00  2

assign (resid  40 and name c ) (resid  40 and name ca)
       (resid  40 and name cb) (resid  40 and name cg2)   1  180.00   30.00  2

assign (resid  42 and name n ) (resid  42 and name ca)
       (resid  42 and name cb) (resid  42 and name cg1)   1  180.00   20.00  2

assign (resid  42 and name c ) (resid  42 and name ca)
       (resid  42 and name cb) (resid  42 and name cg2)   1  180.00   20.00  2

assign (resid  52 and name n ) (resid  52 and name ca)
       (resid  52 and name cb) (resid  52 and name cg1)   1  180.00   30.00  2

assign (resid  52 and name c ) (resid  52 and name ca)
       (resid  52 and name cb) (resid  52 and name cg2)   1  180.00   30.00  2

assign (resid  53 and name n ) (resid  53 and name ca)
       (resid  53 and name cb) (resid  53 and name cg2)   1  180.00   30.00  2

assign (resid  56 and name c ) (resid  56 and name ca)
       (resid  56 and name cb) (resid  56 and name cg2)   1  180.00   20.00  2

assign (resid  63 and name n ) (resid  63 and name ca)
       (resid  63 and name cb) (resid  63 and name cg2)   1  180.00   20.00  2

assign (resid  66 and name n ) (resid  66 and name ca)
       (resid  66 and name cb) (resid  66 and name cg2)   1  180.00   20.00  2

assign (resid  33 and name n ) (resid  33 and name ca)
       (resid  33 and name cb) (resid  33 and name cg)   1    0.0    75.00  2

assign (resid  44 and name n ) (resid  44 and name ca)
       (resid  44 and name cb) (resid  44 and name cg)   1  -60.0    15.00  2

assign (resid  71 and name n ) (resid  71 and name ca)
       (resid  71 and name cb) (resid  71 and name cg)   1  180.0    15.00  2

assign (resid  77 and name n ) (resid  77 and name ca)
       (resid  77 and name cb) (resid  77 and name cg)   1   60.0    15.00  2

assign (resid  78 and name n ) (resid  78 and name ca)
       (resid  78 and name cb) (resid  78 and name cg)   1  180.0    15.00  2



! Dipolar restraints for DinI

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     2 and name    N)
       ( resid     2 and name   HN) -3.0650  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     3 and name    N)
       ( resid     3 and name   HN)  3.1400  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     4 and name    N)
       ( resid     4 and name   HN) -5.2690  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     5 and name    N)
       ( resid     5 and name   HN)  3.4840  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     6 and name    N)
       ( resid     6 and name   HN)  1.1860  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     7 and name    N)
       ( resid     7 and name   HN) 10.0060  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     8 and name    N)
       ( resid     8 and name   HN) 10.5500  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     9 and name    N)
       ( resid     9 and name   HN) -3.5700  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    10 and name    N)
       ( resid    10 and name   HN) -14.6010  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    11 and name    N)
       ( resid    11 and name   HN) -7.4960  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    13 and name    N)
       ( resid    13 and name   HN)  3.2740  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    15 and name    N)
       ( resid    15 and name   HN) -16.8040  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    17 and name    N)
       ( resid    17 and name   HN) -9.3150  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    18 and name    N)
       ( resid    18 and name   HN) -8.9630  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    19 and name    N)
       ( resid    19 and name   HN) -16.2470  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    20 and name    N)
       ( resid    20 and name   HN) -12.1320  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    21 and name    N)
       ( resid    21 and name   HN) -4.8580  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    22 and name    N)
       ( resid    22 and name   HN) -9.1530  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    23 and name    N)
       ( resid    23 and name   HN) -18.8720  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    24 and name    N)
       ( resid    24 and name   HN) -9.9100  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    25 and name    N)
       ( resid    25 and name   HN) -5.1660  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    26 and name    N)
       ( resid    26 and name   HN) -14.3310  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    27 and name    N)
       ( resid    27 and name   HN) -18.1660  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    28 and name    N)
       ( resid    28 and name   HN) -9.5000  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    29 and name    N)
       ( resid    29 and name   HN) -8.6980  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    30 and name    N)
       ( resid    30 and name   HN) -20.5620  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    31 and name    N)
       ( resid    31 and name   HN) -16.9580  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    32 and name    N)
       ( resid    32 and name   HN) -8.2240  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    33 and name    N)
       ( resid    33 and name   HN) -15.4710  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    36 and name    N)
       ( resid    36 and name   HN)  0.2780  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    37 and name    N)
       ( resid    37 and name   HN) -4.3170  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    38 and name    N)
       ( resid    38 and name   HN)  5.2700  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    39 and name    N)
       ( resid    39 and name   HN) -2.9710  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    40 and name    N)
       ( resid    40 and name   HN)  3.0630  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    41 and name    N)
       ( resid    41 and name   HN) -4.1630  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    42 and name    N)
       ( resid    42 and name   HN)  3.7060  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    43 and name    N)
       ( resid    43 and name   HN)  0.2160  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    44 and name    N)
       ( resid    44 and name   HN)  4.6590  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    45 and name    N)
       ( resid    45 and name   HN)  9.9430  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    47 and name    N)
       ( resid    47 and name   HN) -2.1990  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    48 and name    N)
       ( resid    48 and name   HN)  0.7860  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    49 and name    N)
       ( resid    49 and name   HN)  1.0840  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    50 and name    N)
       ( resid    50 and name   HN)  0.1900  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    51 and name    N)
       ( resid    51 and name   HN) -3.0640  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    52 and name    N)
       ( resid    52 and name   HN)  1.2300  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    53 and name    N)
       ( resid    53 and name   HN) -3.2480  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    55 and name    N)
       ( resid    55 and name   HN)  3.9070  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    56 and name    N)
       ( resid    56 and name   HN)  8.0480  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    57 and name    N)
       ( resid    57 and name   HN) -15.8430  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    58 and name    N)
       ( resid    58 and name   HN) -16.2760  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    59 and name    N)
       ( resid    59 and name   HN) -8.7550  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    60 and name    N)
       ( resid    60 and name   HN) -15.7060  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    61 and name    N)
       ( resid    61 and name   HN) -21.1300  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    62 and name    N)
       ( resid    62 and name   HN) -15.9450  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    63 and name    N)
       ( resid    63 and name   HN) -13.7000  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    64 and name    N)
       ( resid    64 and name   HN) -19.0390  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    65 and name    N)
       ( resid    65 and name   HN) -20.2660  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    66 and name    N)
       ( resid    66 and name   HN) -13.6410  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    67 and name    N)
       ( resid    67 and name   HN) -14.7490  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    68 and name    N)
       ( resid    68 and name   HN) -20.4580  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    69 and name    N)
       ( resid    69 and name   HN) -20.9060  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    70 and name    N)
       ( resid    70 and name   HN) -12.1040  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    71 and name    N)
       ( resid    71 and name   HN) -16.8800  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    73 and name    N)
       ( resid    73 and name   HN) -3.7530  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    74 and name    N)
       ( resid    74 and name   HN)  3.3610  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    75 and name    N)
       ( resid    75 and name   HN)  3.6480  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    76 and name    N)
       ( resid    76 and name   HN) -7.3390  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    77 and name    N)
       ( resid    77 and name   HN)  3.2840  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    78 and name    N)
       ( resid    78 and name   HN)  7.5310  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     1 and name   CA)
       ( resid     1 and name   HA)  1.8120  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     2 and name   CA)
       ( resid     2 and name   HA)  3.2060  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     3 and name   CA)
       ( resid     3 and name   HA) -2.7390  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     4 and name   CA)
       ( resid     4 and name   HA) -4.1370  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     5 and name   CA)
       ( resid     5 and name   HA) -0.4740  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     6 and name   CA)
       ( resid     6 and name   HA)  3.9880  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     7 and name   CA)
       ( resid     7 and name   HA) 13.2140  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     8 and name   CA)
       ( resid     8 and name   HA) 13.9590  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     9 and name   CA)
       ( resid     9 and name   HA) 16.1010  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    10 and name   CA)
       ( resid    10 and name   HA) -18.2840  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    12 and name   CA)
       ( resid    12 and name   HA) -12.1110  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    14 and name   CA)
       ( resid    14 and name   HA) -17.2020  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    15 and name   CA)
       ( resid    15 and name   HA)  2.5300  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    16 and name   CA)
       ( resid    16 and name  HA#) 14.0700  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    17 and name   CA)
       ( resid    17 and name   HA) 24.6560  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    18 and name   CA)
       ( resid    18 and name   HA)  3.2950  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    19 and name   CA)
       ( resid    19 and name   HA) -27.9450  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    20 and name   CA)
       ( resid    20 and name   HA)  9.6880  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    21 and name   CA)
       ( resid    21 and name   HA) 33.2590  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    22 and name   CA)
       ( resid    22 and name   HA) -19.7280  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    23 and name   CA)
       ( resid    23 and name  HA#) -37.4070  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    24 and name   CA)
       ( resid    24 and name   HA) 18.2250  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    25 and name   CA)
       ( resid    25 and name   HA) 23.0770  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    27 and name   CA)
       ( resid    27 and name   HA) -3.9210  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    28 and name   CA)
       ( resid    28 and name   HA) 27.5500  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    29 and name   CA)
       ( resid    29 and name   HA)  4.2570  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    30 and name   CA)
       ( resid    30 and name   HA) -18.6840  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    31 and name   CA)
       ( resid    31 and name   HA)  3.0400  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    32 and name   CA)
       ( resid    32 and name   HA) 29.0270  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    34 and name   CA)
       ( resid    34 and name   HA) -30.8480  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    35 and name   CA)
       ( resid    35 and name   HA)  8.8230  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    36 and name   CA)
       ( resid    36 and name   HA) -10.6140  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    37 and name   CA)
       ( resid    37 and name   HA)  4.3500  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    38 and name   CA)
       ( resid    38 and name  HA#) 20.3200  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    39 and name   CA)
       ( resid    39 and name   HA)  3.9000  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    40 and name   CA)
       ( resid    40 and name   HA) -4.4590  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    41 and name   CA)
       ( resid    41 and name   HA) -5.4630  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    42 and name   CA)
       ( resid    42 and name   HA) -2.7200  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    43 and name   CA)
       ( resid    43 and name   HA) -16.4740  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    44 and name   CA)
       ( resid    44 and name   HA) 25.8180  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    46 and name   CA)
       ( resid    46 and name   HA) -40.8190  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    47 and name   CA)
       ( resid    47 and name   HA) -18.9820  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    48 and name   CA)
       ( resid    48 and name   HA)  9.7300  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    49 and name   CA)
       ( resid    49 and name   HA) 11.1030  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    50 and name   CA)
       ( resid    50 and name   HA)  0.3280  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    51 and name   CA)
       ( resid    51 and name   HA) -1.5020  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    52 and name   CA)
       ( resid    52 and name   HA) -2.1360  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    54 and name   CA)
       ( resid    54 and name  HA#) -20.9000  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    55 and name   CA)
       ( resid    55 and name   HA)  2.0840  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    56 and name   CA)
       ( resid    56 and name   HA)  3.3740  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    57 and name   CA)
       ( resid    57 and name   HA) -12.5330  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    58 and name   CA)
       ( resid    58 and name   HA)  5.5010  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    59 and name   CA)
       ( resid    59 and name   HA) 23.1300  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    60 and name   CA)
       ( resid    60 and name   HA) -9.0060  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    61 and name   CA)
       ( resid    61 and name   HA) -11.2260  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    62 and name   CA)
       ( resid    62 and name   HA) 19.0170  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    63 and name   CA)
       ( resid    63 and name   HA)  6.7600  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    65 and name   CA)
       ( resid    65 and name   HA) -5.5110  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    66 and name   CA)
       ( resid    66 and name   HA) 25.1200  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    67 and name   CA)
       ( resid    67 and name   HA) -0.7640  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    68 and name   CA)
       ( resid    68 and name   HA) -14.7970  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    69 and name   CA)
       ( resid    69 and name   HA)  9.6820  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    71 and name   CA)
       ( resid    71 and name   HA) -0.0910  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    72 and name   CA)
       ( resid    72 and name   HA) -18.5340  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    73 and name   CA)
       ( resid    73 and name   HA)  8.8940  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    74 and name   CA)
       ( resid    74 and name   HA)  4.0860  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    75 and name   CA)
       ( resid    75 and name   HA) -5.9170  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    76 and name   CA)
       ( resid    76 and name   HA) -9.4590  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    77 and name   CA)
       ( resid    77 and name   HA) 13.3310  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    78 and name   CA)
       ( resid    78 and name   HA) 12.5740  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     1 and name   CA)
       ( resid     1 and name    C) -3.2710  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     2 and name   CA)
       ( resid     2 and name    C) -0.1950  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     3 and name   CA)
       ( resid     3 and name    C) -2.2460  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     4 and name   CA)
       ( resid     4 and name    C) -0.0660  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     5 and name   CA)
       ( resid     5 and name    C) -0.8510  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     6 and name   CA)
       ( resid     6 and name    C) -0.3760  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     7 and name   CA)
       ( resid     7 and name    C)  0.4960  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     8 and name   CA)
       ( resid     8 and name    C) -2.8760  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     9 and name   CA)
       ( resid     9 and name    C) -2.1600  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    10 and name   CA)
       ( resid    10 and name    C)  2.1870  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    12 and name   CA)
       ( resid    12 and name    C)  2.0570  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    14 and name   CA)
       ( resid    14 and name    C)  0.8030  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    15 and name   CA)
       ( resid    15 and name    C) -0.3220  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    17 and name   CA)
       ( resid    17 and name    C) -3.3940  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    18 and name   CA)
       ( resid    18 and name    C)  0.0630  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    19 and name   CA)
       ( resid    19 and name    C)  2.9220  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    21 and name   CA)
       ( resid    21 and name    C) -2.9530  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    22 and name   CA)
       ( resid    22 and name    C)  1.4670  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    23 and name   CA)
       ( resid    23 and name    C)  2.1150  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    24 and name   CA)
       ( resid    24 and name    C) -3.2870  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    25 and name   CA)
       ( resid    25 and name    C) -1.6390  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    26 and name   CA)
       ( resid    26 and name    C)  1.7460  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    27 and name   CA)
       ( resid    27 and name    C) -0.0900  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    29 and name   CA)
       ( resid    29 and name    C) -0.6950  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    30 and name   CA)
       ( resid    30 and name    C)  2.0860  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    31 and name   CA)
       ( resid    31 and name    C) -1.7020  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    32 and name   CA)
       ( resid    32 and name    C) -2.4610  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    34 and name   CA)
       ( resid    34 and name    C)  0.3950  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    35 and name   CA)
       ( resid    35 and name    C)  1.9970  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    36 and name   CA)
       ( resid    36 and name    C) -1.6610  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    37 and name   CA)
       ( resid    37 and name    C) -0.0990  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    38 and name   CA)
       ( resid    38 and name    C) -1.5920  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    39 and name   CA)
       ( resid    39 and name    C) -0.4260  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    40 and name   CA)
       ( resid    40 and name    C) -1.0920  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    41 and name   CA)
       ( resid    41 and name    C) -0.2660  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    42 and name   CA)
       ( resid    42 and name    C) -0.1260  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    43 and name   CA)
       ( resid    43 and name    C)  0.5800  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    44 and name   CA)
       ( resid    44 and name    C)  0.7880  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    46 and name   CA)
       ( resid    46 and name    C)  2.5760  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    47 and name   CA)
       ( resid    47 and name    C)  1.7490  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    48 and name   CA)
       ( resid    48 and name    C) -3.9860  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    49 and name   CA)
       ( resid    49 and name    C)  0.7750  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    50 and name   CA)
       ( resid    50 and name    C) -2.8670  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    51 and name   CA)
       ( resid    51 and name    C)  0.3010  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    52 and name   CA)
       ( resid    52 and name    C) -2.2580  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    54 and name   CA)
       ( resid    54 and name    C)  2.9710  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    55 and name   CA)
       ( resid    55 and name    C) -0.5690  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    56 and name   CA)
       ( resid    56 and name    C) -0.8120  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    57 and name   CA)
       ( resid    57 and name    C)  1.8290  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    58 and name   CA)
       ( resid    58 and name    C) -1.8860  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    59 and name   CA)
       ( resid    59 and name    C) -2.3340  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    60 and name   CA)
       ( resid    60 and name    C)  0.8460  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    61 and name   CA)
       ( resid    61 and name    C)  0.2130  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    62 and name   CA)
       ( resid    62 and name    C) -2.0680  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    63 and name   CA)
       ( resid    63 and name    C) -1.8200  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    64 and name   CA)
       ( resid    64 and name    C)  3.2000  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    65 and name   CA)
       ( resid    65 and name    C) -0.8830  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    66 and name   CA)
       ( resid    66 and name    C) -2.1700  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    67 and name   CA)
       ( resid    67 and name    C) -0.4910  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    68 and name   CA)
       ( resid    68 and name    C)  1.2170  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    69 and name   CA)
       ( resid    69 and name    C) -0.8870  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    70 and name   CA)
       ( resid    70 and name    C) -3.7860  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    71 and name   CA)
       ( resid    71 and name    C)  2.8010  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    72 and name   CA)
       ( resid    72 and name    C)  0.5500  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    73 and name   CA)
       ( resid    73 and name    C) -0.8070  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    74 and name   CA)
       ( resid    74 and name    C) -1.6620  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    75 and name   CA)
       ( resid    75 and name    C)  1.1520  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    76 and name   CA)
       ( resid    76 and name    C)  2.0900  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    78 and name   CA)
       ( resid    78 and name    C) -2.5710  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     2 and name    N)
       ( resid     1 and name    C)  0.5240  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     3 and name    N)
       ( resid     2 and name    C) -1.6890  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     4 and name    N)
       ( resid     3 and name    C)  0.5920  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     6 and name    N)
       ( resid     5 and name    C)  0.8230  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     7 and name    N)
       ( resid     6 and name    C) -2.2760  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     8 and name    N)
       ( resid     7 and name    C)  0.4850  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     9 and name    N)
       ( resid     8 and name    C)  1.0710  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    10 and name    N)
       ( resid     9 and name    C)  0.8420  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    13 and name    N)
       ( resid    12 and name    C) -0.2000  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    15 and name    N)
       ( resid    14 and name    C) -0.1040  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    17 and name    N)
       ( resid    16 and name    C)  0.4120  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    18 and name    N)
       ( resid    17 and name    C)  1.4940  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    19 and name    N)
       ( resid    18 and name    C) -0.2160  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    20 and name    N)
       ( resid    19 and name    C) -0.3250  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    21 and name    N)
       ( resid    20 and name    C)  0.5290  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    22 and name    N)
       ( resid    21 and name    C)  1.7510  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    23 and name    N)
       ( resid    22 and name    C) -1.3940  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    24 and name    N)
       ( resid    23 and name    C) -0.2820  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    25 and name    N)
       ( resid    24 and name    C)  1.1960  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    26 and name    N)
       ( resid    25 and name    C)  1.1200  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    28 and name    N)
       ( resid    27 and name    C)  0.3050  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    29 and name    N)
       ( resid    28 and name    C)  1.7300  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    31 and name    N)
       ( resid    30 and name    C)  0.2510  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    32 and name    N)
       ( resid    31 and name    C)  0.7580  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    33 and name    N)
       ( resid    32 and name    C)  1.3620  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    35 and name    N)
       ( resid    34 and name    C) -0.8510  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    36 and name    N)
       ( resid    35 and name    C) -1.4100  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    37 and name    N)
       ( resid    36 and name    C)  1.0160  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    38 and name    N)
       ( resid    37 and name    C) -1.3570  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    39 and name    N)
       ( resid    38 and name    C)  0.6500  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    40 and name    N)
       ( resid    39 and name    C) -1.5830  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    41 and name    N)
       ( resid    40 and name    C)  0.6990  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    42 and name    N)
       ( resid    41 and name    C) -2.3320  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    43 and name    N)
       ( resid    42 and name    C)  0.7550  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    44 and name    N)
       ( resid    43 and name    C) -1.0300  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    45 and name    N)
       ( resid    44 and name    C)  0.4800  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    47 and name    N)
       ( resid    46 and name    C) -0.9220  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    49 and name    N)
       ( resid    48 and name    C) -0.4970  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    50 and name    N)
       ( resid    49 and name    C) -1.5610  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    51 and name    N)
       ( resid    50 and name    C)  0.9280  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    52 and name    N)
       ( resid    51 and name    C) -1.7930  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    53 and name    N)
       ( resid    52 and name    C)  0.4520  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    56 and name    N)
       ( resid    55 and name    C)  0.3170  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    58 and name    N)
       ( resid    57 and name    C)  0.1680  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    59 and name    N)
       ( resid    58 and name    C)  1.3140  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    60 and name    N)
       ( resid    59 and name    C)  1.7750  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    61 and name    N)
       ( resid    60 and name    C)  0.5250  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    62 and name    N)
       ( resid    61 and name    C)  0.2030  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    64 and name    N)
       ( resid    63 and name    C)  0.5420  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    65 and name    N)
       ( resid    64 and name    C)  0.4700  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    66 and name    N)
       ( resid    65 and name    C)  0.1430  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    67 and name    N)
       ( resid    66 and name    C)  1.1780  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    69 and name    N)
       ( resid    68 and name    C) -0.1550  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    70 and name    N)
       ( resid    69 and name    C)  1.8240  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    71 and name    N)
       ( resid    70 and name    C)  0.7690  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    72 and name    N)
       ( resid    71 and name    C)  0.2890  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    73 and name    N)
       ( resid    72 and name    C)  0.3390  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    74 and name    N)
       ( resid    73 and name    C)  0.7310  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    75 and name    N)
       ( resid    74 and name    C)  0.6640  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    76 and name    N)
       ( resid    75 and name    C) -1.6200  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    78 and name    N)
       ( resid    77 and name    C) -0.3260  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     2 and name   HN)
       ( resid     1 and name    C)  2.3840  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     3 and name   HN)
       ( resid     2 and name    C) -2.2220  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     4 and name   HN)
       ( resid     3 and name    C)  1.7300  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     5 and name   HN)
       ( resid     4 and name    C) -2.9930  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     6 and name   HN)
       ( resid     5 and name    C)  1.2500  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     7 and name   HN)
       ( resid     6 and name    C) -2.8600  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     8 and name   HN)
       ( resid     7 and name    C)  3.3370  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     9 and name   HN)
       ( resid     8 and name    C)  4.0220  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    10 and name   HN)
       ( resid     9 and name    C) -0.4320  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    13 and name   HN)
       ( resid    12 and name    C) -0.3420  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    15 and name   HN)
       ( resid    14 and name    C) -3.5800  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    16 and name   HN)
       ( resid    15 and name    C) -2.3860  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    17 and name   HN)
       ( resid    16 and name    C)  1.2990  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    18 and name   HN)
       ( resid    17 and name    C)  3.6920  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    19 and name   HN)
       ( resid    18 and name    C) -3.0170  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    20 and name   HN)
       ( resid    19 and name    C) -3.7420  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    21 and name   HN)
       ( resid    20 and name    C)  2.2110  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    22 and name   HN)
       ( resid    21 and name    C)  3.3510  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    23 and name   HN)
       ( resid    22 and name    C) -5.0480  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    24 and name   HN)
       ( resid    23 and name    C) -2.1300  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    25 and name   HN)
       ( resid    24 and name    C)  2.8950  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    26 and name   HN)
       ( resid    25 and name    C)  0.5450  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    28 and name   HN)
       ( resid    27 and name    C) -0.4320  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    29 and name   HN)
       ( resid    28 and name    C)  2.7830  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    31 and name   HN)
       ( resid    30 and name    C) -1.9340  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    32 and name   HN)
       ( resid    31 and name    C)  1.1330  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    33 and name   HN)
       ( resid    32 and name    C)  1.5550  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    35 and name   HN)
       ( resid    34 and name    C) -0.5790  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    36 and name   HN)
       ( resid    35 and name    C) -3.2530  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    37 and name   HN)
       ( resid    36 and name    C)  2.4530  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    38 and name   HN)
       ( resid    37 and name    C) -1.3270  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    39 and name   HN)
       ( resid    38 and name    C)  1.5700  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    40 and name   HN)
       ( resid    39 and name    C) -3.3030  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    41 and name   HN)
       ( resid    40 and name    C)  1.9880  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    42 and name   HN)
       ( resid    41 and name    C) -3.2520  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    43 and name   HN)
       ( resid    42 and name    C)  1.3420  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    44 and name   HN)
       ( resid    43 and name    C) -0.4130  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    45 and name   HN)
       ( resid    44 and name    C)  2.4460  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    47 and name   HN)
       ( resid    46 and name    C) -2.9740  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    49 and name   HN)
       ( resid    48 and name    C)  1.6420  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    50 and name   HN)
       ( resid    49 and name    C) -3.1710  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    51 and name   HN)
       ( resid    50 and name    C)  1.9270  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    52 and name   HN)
       ( resid    51 and name    C) -3.4160  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    53 and name   HN)
       ( resid    52 and name    C)  1.5210  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    56 and name   HN)
       ( resid    55 and name    C)  2.6840  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    57 and name   HN)
       ( resid    56 and name    C) -2.2000  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    58 and name   HN)
       ( resid    57 and name    C) -4.4280  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    59 and name   HN)
       ( resid    58 and name    C)  2.3810  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    60 and name   HN)
       ( resid    59 and name    C) -0.1120  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    61 and name   HN)
       ( resid    60 and name    C) -2.5320  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    62 and name   HN)
       ( resid    61 and name    C) -2.8620  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    64 and name   HN)
       ( resid    63 and name    C) -0.8190  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    65 and name   HN)
       ( resid    64 and name    C) -2.2790  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    66 and name   HN)
       ( resid    65 and name    C) -0.9500  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    67 and name   HN)
       ( resid    66 and name    C)  1.5340  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    69 and name   HN)
       ( resid    68 and name    C) -3.4760  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    70 and name   HN)
       ( resid    69 and name    C)  2.5660  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    71 and name   HN)
       ( resid    70 and name    C)  0.3610  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    72 and name   HN)
       ( resid    71 and name    C) -2.4060  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    73 and name   HN)
       ( resid    72 and name    C)  3.9760  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    74 and name   HN)
       ( resid    73 and name    C)  2.7670  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    75 and name   HN)
       ( resid    74 and name    C)  3.7430  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    76 and name   HN)
       ( resid    75 and name    C) -5.2640  0.3000  0.3000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    78 and name   HN)
       ( resid    77 and name    C)  1.8900  0.3000  0.3000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid     2 and name    N)
       ( resid     2 and name   HN) -1.9610  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid     3 and name    N)
       ( resid     3 and name   HN) -11.1610  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid     4 and name    N)
       ( resid     4 and name   HN) -18.8990  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid     5 and name    N)
       ( resid     5 and name   HN) -19.5930  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid     6 and name    N)
       ( resid     6 and name   HN) -25.6140  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid     7 and name    N)
       ( resid     7 and name   HN) -18.5450  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid     8 and name    N)
       ( resid     8 and name   HN) -5.0630  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid     9 and name    N)
       ( resid     9 and name   HN) 36.4890  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    10 and name    N)
       ( resid    10 and name   HN) -3.5280  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    13 and name    N)
       ( resid    13 and name   HN) 19.5520  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    15 and name    N)
       ( resid    15 and name   HN) -17.8170  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    17 and name    N)
       ( resid    17 and name   HN) -17.6880  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    18 and name    N)
       ( resid    18 and name   HN) -20.2350  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    19 and name    N)
       ( resid    19 and name   HN) -22.9580  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    20 and name    N)
       ( resid    20 and name   HN) -23.5990  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    21 and name    N)
       ( resid    21 and name   HN) -12.1280  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    22 and name    N)
       ( resid    22 and name   HN) -21.1930  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    23 and name    N)
       ( resid    23 and name   HN) -23.2950  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    24 and name    N)
       ( resid    24 and name   HN) -20.7040  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    25 and name    N)
       ( resid    25 and name   HN) -14.3520  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    26 and name    N)
       ( resid    26 and name   HN) -25.6950  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    29 and name    N)
       ( resid    29 and name   HN) -23.2740  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    30 and name    N)
       ( resid    30 and name   HN) -27.2220  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    31 and name    N)
       ( resid    31 and name   HN) -24.0960  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    32 and name    N)
       ( resid    32 and name   HN) -17.8800  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    35 and name    N)
       ( resid    35 and name   HN) -18.6580  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    37 and name    N)
       ( resid    37 and name   HN) 10.4300  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    38 and name    N)
       ( resid    38 and name   HN) 21.4920  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    39 and name    N)
       ( resid    39 and name   HN)  8.5540  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    40 and name    N)
       ( resid    40 and name   HN)  3.9310  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    41 and name    N)
       ( resid    41 and name   HN) -19.9260  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    42 and name    N)
       ( resid    42 and name   HN) -22.2720  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    43 and name    N)
       ( resid    43 and name   HN) -24.7400  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    44 and name    N)
       ( resid    44 and name   HN) -22.0070  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    45 and name    N)
       ( resid    45 and name   HN) 19.2520  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    47 and name    N)
       ( resid    47 and name   HN) -10.5930  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    49 and name    N)
       ( resid    49 and name   HN) -11.5960  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    50 and name    N)
       ( resid    50 and name   HN) -12.1330  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    51 and name    N)
       ( resid    51 and name   HN) -13.8950  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    52 and name    N)
       ( resid    52 and name   HN) -6.2030  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    53 and name    N)
       ( resid    53 and name   HN) -2.3970  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    56 and name    N)
       ( resid    56 and name   HN) 27.8190  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    57 and name    N)
       ( resid    57 and name   HN)  3.4210  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    58 and name    N)
       ( resid    58 and name   HN) -10.9770  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    60 and name    N)
       ( resid    60 and name   HN)  5.8780  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    61 and name    N)
       ( resid    61 and name   HN) -17.4630  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    62 and name    N)
       ( resid    62 and name   HN) -2.9280  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    64 and name    N)
       ( resid    64 and name   HN) -6.4580  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    66 and name    N)
       ( resid    66 and name   HN) 10.0190  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    67 and name    N)
       ( resid    67 and name   HN)  9.8870  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    71 and name    N)
       ( resid    71 and name   HN)  4.1980  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    72 and name    N)
       ( resid    72 and name   HN) -13.1330  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    73 and name    N)
       ( resid    73 and name   HN) 21.1420  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    74 and name    N)
       ( resid    74 and name   HN)  2.1960  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    75 and name    N)
       ( resid    75 and name   HN) -22.0150  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    76 and name    N)
       ( resid    76 and name   HN)  2.5020  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    77 and name    N)
       ( resid    77 and name   HN) -9.1180  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    78 and name    N)
       ( resid    78 and name   HN) -12.6830  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid     1 and name   CA)
       ( resid     1 and name   HA) 51.3800  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid     2 and name   CA)
       ( resid     2 and name   HA) 17.0270  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid     3 and name   CA)
       ( resid     3 and name   HA) -22.7310  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid     4 and name   CA)
       ( resid     4 and name   HA) -19.4870  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid     5 and name   CA)
       ( resid     5 and name   HA) -36.1260  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid     7 and name   CA)
       ( resid     7 and name   HA) -34.6750  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid     8 and name   CA)
       ( resid     8 and name   HA) 75.7990  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid     9 and name   CA)
       ( resid     9 and name   HA) 18.2510  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    10 and name   CA)
       ( resid    10 and name   HA) -37.1780  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    12 and name   CA)
       ( resid    12 and name   HA) -14.1710  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    14 and name   CA)
       ( resid    14 and name   HA) -24.8920  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    16 and name   CA)
       ( resid    16 and name  HA#) 53.8100  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    17 and name   CA)
       ( resid    17 and name   HA) 46.3140  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    18 and name   CA)
       ( resid    18 and name   HA) -42.3560  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    19 and name   CA)
       ( resid    19 and name   HA) 24.7430  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    20 and name   CA)
       ( resid    20 and name   HA) -24.6930  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    21 and name   CA)
       ( resid    21 and name   HA) 46.8390  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    22 and name   CA)
       ( resid    22 and name   HA) -26.6600  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    23 and name   CA)
       ( resid    23 and name  HA#) -22.1750  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    24 and name   CA)
       ( resid    24 and name   HA) 26.6860  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    25 and name   CA)
       ( resid    25 and name   HA) -9.2940  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    27 and name   CA)
       ( resid    27 and name   HA) -38.0400  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    29 and name   CA)
       ( resid    29 and name   HA) -42.1210  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    30 and name   CA)
       ( resid    30 and name   HA) 35.0540  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    31 and name   CA)
       ( resid    31 and name   HA) -24.8890  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    32 and name   CA)
       ( resid    32 and name   HA) 32.6210  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    34 and name   CA)
       ( resid    34 and name   HA) -35.8040  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    35 and name   CA)
       ( resid    35 and name   HA) -29.5970  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    36 and name   CA)
       ( resid    36 and name   HA) 17.3630  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    37 and name   CA)
       ( resid    37 and name   HA) 47.0480  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    38 and name   CA)
       ( resid    38 and name  HA#) 46.5200  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    39 and name   CA)
       ( resid    39 and name   HA) 25.3000  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    40 and name   CA)
       ( resid    40 and name   HA) -6.7440  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    41 and name   CA)
       ( resid    41 and name   HA) -9.1010  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    42 and name   CA)
       ( resid    42 and name   HA) -25.7710  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    43 and name   CA)
       ( resid    43 and name   HA) -17.2900  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    44 and name   CA)
       ( resid    44 and name   HA)  0.8530  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    46 and name   CA)
       ( resid    46 and name   HA) -30.8890  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    47 and name   CA)
       ( resid    47 and name   HA) -6.7870  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    48 and name   CA)
       ( resid    48 and name   HA) -32.7720  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    49 and name   CA)
       ( resid    49 and name   HA) -44.0330  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    50 and name   CA)
       ( resid    50 and name   HA) -38.0430  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    51 and name   CA)
       ( resid    51 and name   HA) -33.5960  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    52 and name   CA)
       ( resid    52 and name   HA) -29.5200  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    54 and name   CA)
       ( resid    54 and name  HA#) -15.7600  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    55 and name   CA)
       ( resid    55 and name   HA) -13.1650  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    56 and name   CA)
       ( resid    56 and name   HA) 57.5840  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    57 and name   CA)
       ( resid    57 and name   HA) -31.7070  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    58 and name   CA)
       ( resid    58 and name   HA) -25.2750  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    59 and name   CA)
       ( resid    59 and name   HA) 78.5630  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    60 and name   CA)
       ( resid    60 and name   HA) -40.6970  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    61 and name   CA)
       ( resid    61 and name   HA) -27.6070  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    62 and name   CA)
       ( resid    62 and name   HA) 30.4400  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    63 and name   CA)
       ( resid    63 and name   HA) 36.0900  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    65 and name   CA)
       ( resid    65 and name   HA) -37.8680  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    66 and name   CA)
       ( resid    66 and name   HA) 82.6800  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    67 and name   CA)
       ( resid    67 and name   HA) -36.8350  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    69 and name   CA)
       ( resid    69 and name   HA) -0.7970  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    72 and name   CA)
       ( resid    72 and name   HA) -31.2110  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    73 and name   CA)
       ( resid    73 and name   HA) 34.9310  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    74 and name   CA)
       ( resid    74 and name   HA) -10.3000  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    75 and name   CA)
       ( resid    75 and name   HA) -31.8950  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    76 and name   CA)
       ( resid    76 and name   HA) 43.9870  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    77 and name   CA)
       ( resid    77 and name   HA) 13.9040  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    78 and name   CA)
       ( resid    78 and name   HA)  7.2250  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid     1 and name   CA)
       ( resid     1 and name    C) -4.7910  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid     2 and name   CA)
       ( resid     2 and name    C) -3.3610  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid     3 and name   CA)
       ( resid     3 and name    C) -4.2730  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid     4 and name   CA)
       ( resid     4 and name    C) -2.7650  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid     5 and name   CA)
       ( resid     5 and name    C) -3.2320  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid     6 and name   CA)
       ( resid     6 and name    C)  1.0730  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid     7 and name   CA)
       ( resid     7 and name    C) -0.1480  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid     8 and name   CA)
       ( resid     8 and name    C) -1.5560  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid     9 and name   CA)
       ( resid     9 and name    C) -0.5020  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    10 and name   CA)
       ( resid    10 and name    C)  5.8670  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    12 and name   CA)
       ( resid    12 and name    C)  3.5440  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    14 and name   CA)
       ( resid    14 and name    C) -1.3670  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    17 and name   CA)
       ( resid    17 and name    C)  0.4120  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    18 and name   CA)
       ( resid    18 and name    C) -2.8900  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    19 and name   CA)
       ( resid    19 and name    C)  3.7380  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    20 and name   CA)
       ( resid    20 and name    C) -4.6140  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    21 and name   CA)
       ( resid    21 and name    C) -1.9940  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    22 and name   CA)
       ( resid    22 and name    C)  1.5330  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    23 and name   CA)
       ( resid    23 and name    C) -0.1640  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    24 and name   CA)
       ( resid    24 and name    C) -1.5230  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    25 and name   CA)
       ( resid    25 and name    C) -3.8520  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    26 and name   CA)
       ( resid    26 and name    C)  4.0100  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    27 and name   CA)
       ( resid    27 and name    C) -4.1950  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    28 and name   CA)
       ( resid    28 and name    C)  0.8830  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    29 and name   CA)
       ( resid    29 and name    C) -2.7750  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    30 and name   CA)
       ( resid    30 and name    C)  2.5570  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    31 and name   CA)
       ( resid    31 and name    C) -2.9990  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    32 and name   CA)
       ( resid    32 and name    C)  1.3890  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    34 and name   CA)
       ( resid    34 and name    C)  2.4130  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    35 and name   CA)
       ( resid    35 and name    C)  4.9730  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    36 and name   CA)
       ( resid    36 and name    C) -3.2800  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    37 and name   CA)
       ( resid    37 and name    C) -0.8430  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    38 and name   CA)
       ( resid    38 and name    C) -3.3190  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    39 and name   CA)
       ( resid    39 and name    C) -3.6130  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    40 and name   CA)
       ( resid    40 and name    C) -2.7370  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    41 and name   CA)
       ( resid    41 and name    C) -3.2550  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    42 and name   CA)
       ( resid    42 and name    C) -0.9620  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    43 and name   CA)
       ( resid    43 and name    C) -2.9840  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    44 and name   CA)
       ( resid    44 and name    C)  6.6610  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    46 and name   CA)
       ( resid    46 and name    C)  0.5820  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    47 and name   CA)
       ( resid    47 and name    C)  2.0810  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    48 and name   CA)
       ( resid    48 and name    C) -1.7440  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    49 and name   CA)
       ( resid    49 and name    C) -0.7840  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    50 and name   CA)
       ( resid    50 and name    C)  2.4600  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    51 and name   CA)
       ( resid    51 and name    C) -1.7970  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    52 and name   CA)
       ( resid    52 and name    C)  3.0990  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    54 and name   CA)
       ( resid    54 and name    C)  4.6420  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    55 and name   CA)
       ( resid    55 and name    C) -3.0670  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    57 and name   CA)
       ( resid    57 and name    C)  7.1320  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    58 and name   CA)
       ( resid    58 and name    C) -2.2650  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    59 and name   CA)
       ( resid    59 and name    C) -4.4490  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    60 and name   CA)
       ( resid    60 and name    C)  1.9400  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    61 and name   CA)
       ( resid    61 and name    C)  4.4150  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    62 and name   CA)
       ( resid    62 and name    C) -4.8980  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    63 and name   CA)
       ( resid    63 and name    C) -4.1520  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    64 and name   CA)
       ( resid    64 and name    C)  9.8030  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    65 and name   CA)
       ( resid    65 and name    C) -1.9010  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    66 and name   CA)
       ( resid    66 and name    C) -4.0120  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    67 and name   CA)
       ( resid    67 and name    C) -0.4790  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    68 and name   CA)
       ( resid    68 and name    C)  7.5390  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    69 and name   CA)
       ( resid    69 and name    C) -3.9030  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    70 and name   CA)
       ( resid    70 and name    C) -4.2170  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    71 and name   CA)
       ( resid    71 and name    C)  4.7420  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    72 and name   CA)
       ( resid    72 and name    C)  3.9940  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    73 and name   CA)
       ( resid    73 and name    C) -4.8550  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    74 and name   CA)
       ( resid    74 and name    C)  1.6140  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    75 and name   CA)
       ( resid    75 and name    C) -0.5260  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    76 and name   CA)
       ( resid    76 and name    C) -0.6720  0.6000  0.6000

assign ( resid   501 and name   OO)
       ( resid   501 and name    Z)
       ( resid   501 and name    X)
       ( resid   501 and name    Y)
       ( resid    78 and name   CA)
       ( resid    78 and name    C)  0.4190  0.6000  0.6000







  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          HT1       MET   1 -12.979   4.597  -1.378
    2   2H    MET   1          HT2       MET   1 -14.009   4.144  -0.105
    3   3H    MET   1          HT3       MET   1 -14.394   3.720  -1.705
    4    HA   MET   1           HA       MET   1 -13.547   1.778  -0.643
    5   1HB   MET   1          HB2       MET   1 -11.553   3.162  -2.467
    6   2HB   MET   1          HB1       MET   1 -11.408   1.475  -1.985
    7   1HG   MET   1          HG2       MET   1 -13.354   0.849  -3.147
    8   2HG   MET   1          HG1       MET   1 -13.949   2.506  -3.233
    9   1HE   MET   1          HE1       MET   1 -10.170   1.031  -5.406
   10   2HE   MET   1          HE2       MET   1 -10.889   0.349  -3.950
   11   3HE   MET   1          HE3       MET   1 -10.086   1.917  -3.877
   12    H    ARG   2           HN       ARG   2 -12.188   0.846   0.881
   13    HA   ARG   2           HA       ARG   2 -10.197   2.637   2.147
   14   1HB   ARG   2          HB2       ARG   2 -12.089   0.659   3.454
   15   2HB   ARG   2          HB1       ARG   2 -10.699   1.359   4.285
   16   1HG   ARG   2          HG2       ARG   2 -11.581   3.623   3.864
   17   2HG   ARG   2          HG1       ARG   2 -12.974   2.927   3.035
   18   1HD   ARG   2          HD2       ARG   2 -13.600   1.732   5.109
   19   2HD   ARG   2          HD1       ARG   2 -12.226   2.462   5.935
   20    HE   ARG   2           HE       ARG   2 -13.747   4.541   4.831
   21   1HH1  ARG   2          HH21      ARG   2 -13.050   4.496   7.715
   22   2HH1  ARG   2          HH22      ARG   2 -14.585   4.278   8.486
   23   1HH2  ARG   2          HH11      ARG   2 -16.175   3.187   5.603
   24   2HH2  ARG   2          HH12      ARG   2 -16.355   3.538   7.290
   25    H    ILE   3           HN       ILE   3  -8.207   1.846   2.281
   26    HA   ILE   3           HA       ILE   3  -7.750  -1.014   1.577
   27    HB   ILE   3           HB       ILE   3  -6.095   1.436   0.967
   28   1HG1  ILE   3          HG12      ILE   3  -7.511  -0.505  -0.881
   29   2HG1  ILE   3          HG11      ILE   3  -8.239   1.006  -0.337
   30   1HG2  ILE   3          HG21      ILE   3  -4.796  -0.287  -0.404
   31   2HG2  ILE   3          HG22      ILE   3  -5.635  -1.524   0.534
   32   3HG2  ILE   3          HG23      ILE   3  -4.574  -0.371   1.344
   33   1HD1  ILE   3          HD11      ILE   3  -6.455   2.296  -1.350
   34   2HD1  ILE   3          HD12      ILE   3  -7.101   1.190  -2.565
   35   3HD1  ILE   3          HD13      ILE   3  -5.574   0.825  -1.758
   36    H    GLU   4           HN       GLU   4  -6.777  -2.169   3.155
   37    HA   GLU   4           HA       GLU   4  -5.094  -0.741   5.149
   38   1HB   GLU   4          HB2       GLU   4  -6.982  -3.061   5.647
   39   2HB   GLU   4          HB1       GLU   4  -5.895  -2.356   6.847
   40   1HG   GLU   4          HG2       GLU   4  -6.992  -0.166   6.558
   41   2HG   GLU   4          HG1       GLU   4  -8.081  -0.865   5.362
   42    H    VAL   5           HN       VAL   5  -3.116  -1.419   5.407
   43    HA   VAL   5           HA       VAL   5  -2.342  -4.076   4.321
   44    HB   VAL   5           HB       VAL   5  -0.753  -1.496   4.394
   45   1HG1  VAL   5          HG11      VAL   5   0.791  -3.293   4.663
   46   2HG1  VAL   5          HG12      VAL   5   0.836  -2.881   2.949
   47   3HG1  VAL   5          HG13      VAL   5  -0.062  -4.299   3.491
   48   1HG2  VAL   5          HG21      VAL   5  -2.703  -1.911   2.651
   49   2HG2  VAL   5          HG22      VAL   5  -1.527  -2.980   1.893
   50   3HG2  VAL   5          HG23      VAL   5  -1.154  -1.274   2.100
   51    H    THR   6           HN       THR   6  -1.314  -5.441   5.625
   52    HA   THR   6           HA       THR   6  -0.293  -4.450   8.238
   53    HB   THR   6           HB       THR   6  -0.959  -6.559   9.217
   54    HG1  THR   6           HG1      THR   6  -2.220  -7.313   6.833
   55   1HG2  THR   6          HG21      THR   6  -3.233  -5.484   7.522
   56   2HG2  THR   6          HG22      THR   6  -2.680  -4.762   9.033
   57   3HG2  THR   6          HG23      THR   6  -3.386  -6.378   9.034
   58    H    ILE   7           HN       ILE   7   1.697  -4.930   8.718
   59    HA   ILE   7           HA       ILE   7   3.226  -6.778   6.981
   60    HB   ILE   7           HB       ILE   7   3.876  -4.166   8.327
   61   1HG1  ILE   7          HG12      ILE   7   4.386  -5.136   5.498
   62   2HG1  ILE   7          HG11      ILE   7   2.919  -4.288   5.985
   63   1HG2  ILE   7          HG21      ILE   7   5.753  -6.367   7.431
   64   2HG2  ILE   7          HG22      ILE   7   5.799  -5.417   8.915
   65   3HG2  ILE   7          HG23      ILE   7   6.266  -4.678   7.384
   66   1HD1  ILE   7          HD11      ILE   7   5.662  -3.142   6.517
   67   2HD1  ILE   7          HD12      ILE   7   4.110  -2.306   6.519
   68   3HD1  ILE   7          HD13      ILE   7   4.814  -2.854   4.998
   69    H    ALA   8           HN       ALA   8   4.252  -8.453   7.975
   70    HA   ALA   8           HA       ALA   8   3.708  -9.074  10.675
   71   1HB   ALA   8          HB1       ALA   8   4.216 -10.751   8.914
   72   2HB   ALA   8          HB2       ALA   8   5.227 -10.947  10.346
   73   3HB   ALA   8          HB3       ALA   8   5.887 -10.186   8.897
   74    H    LYS   9           HN       LYS   9   4.664  -8.602  12.405
   75    HA   LYS   9           HA       LYS   9   6.607  -6.617  12.659
   76   1HB   LYS   9          HB2       LYS   9   5.011  -7.151  14.473
   77   2HB   LYS   9          HB1       LYS   9   5.784  -8.712  14.699
   78   1HG   LYS   9          HG2       LYS   9   7.892  -7.585  15.357
   79   2HG   LYS   9          HG1       LYS   9   7.124  -6.010  15.138
   80   1HD   LYS   9          HD2       LYS   9   5.550  -6.444  16.901
   81   2HD   LYS   9          HD1       LYS   9   6.063  -8.127  17.018
   82   1HE   LYS   9          HE2       LYS   9   7.090  -6.835  18.821
   83   2HE   LYS   9          HE1       LYS   9   8.335  -7.358  17.687
   84   1HZ   LYS   9          HZ1       LYS   9   7.634  -4.740  18.436
   85   2HZ   LYS   9          HZ2       LYS   9   7.339  -4.926  16.773
   86   3HZ   LYS   9          HZ3       LYS   9   8.882  -5.247  17.406
   87    H    THR  10           HN       THR  10   6.985 -10.017  12.172
   88    HA   THR  10           HA       THR  10   9.594 -10.368  13.207
   89    HB   THR  10           HB       THR  10   9.679 -12.239  11.493
   90    HG1  THR  10           HG1      THR  10   8.210 -12.277  10.015
   91   1HG2  THR  10          HG21      THR  10   8.151 -13.616  12.706
   92   2HG2  THR  10          HG22      THR  10   7.134 -12.240  13.129
   93   3HG2  THR  10          HG23      THR  10   8.729 -12.416  13.860
   94    H    SER  11           HN       SER  11   8.434  -8.450  10.665
   95    HA   SER  11           HA       SER  11  11.147  -8.269   9.452
   96   1HB   SER  11          HB2       SER  11   8.482  -7.801   8.098
   97   2HB   SER  11          HB1       SER  11  10.071  -7.685   7.347
   98    HG   SER  11           HG       SER  11   8.696  -9.951   8.316
   99    HA   PRO  12           HA       PRO  12  10.007  -4.092  11.176
  100   1HB   PRO  12          HB2       PRO  12  12.668  -3.900  12.284
  101   2HB   PRO  12          HB1       PRO  12  11.142  -4.067  13.171
  102   1HG   PRO  12          HG2       PRO  12  13.131  -5.994  13.056
  103   2HG   PRO  12          HG1       PRO  12  11.439  -6.299  13.484
  104   1HD   PRO  12          HD2       PRO  12  12.848  -6.806  10.887
  105   2HD   PRO  12          HD1       PRO  12  11.537  -7.715  11.660
  106    H    LEU  13           HN       LEU  13  10.122  -2.303  10.184
  107    HA   LEU  13           HA       LEU  13  12.238  -1.968   8.142
  108   1HB   LEU  13          HB2       LEU  13   9.620  -0.463   8.356
  109   2HB   LEU  13          HB1       LEU  13  10.701  -0.557   6.969
  110    HG   LEU  13           HG       LEU  13   9.049  -2.818   8.129
  111   1HD1  LEU  13          HD11      LEU  13   7.909  -2.791   5.994
  112   2HD1  LEU  13          HD12      LEU  13   9.023  -1.586   5.355
  113   3HD1  LEU  13          HD13      LEU  13   7.888  -1.148   6.634
  114   1HD2  LEU  13          HD21      LEU  13  10.011  -4.044   6.061
  115   2HD2  LEU  13          HD22      LEU  13  11.073  -3.863   7.453
  116   3HD2  LEU  13          HD23      LEU  13  11.258  -2.799   6.060
  117    HA   PRO  14           HA       PRO  14  14.153   1.130  10.565
  118   1HB   PRO  14          HB2       PRO  14  14.306   3.218   8.546
  119   2HB   PRO  14          HB1       PRO  14  15.595   2.130   9.084
  120   1HG   PRO  14          HG2       PRO  14  13.950   1.989   6.673
  121   2HG   PRO  14          HG1       PRO  14  15.456   1.142   7.049
  122   1HD   PRO  14          HD2       PRO  14  12.954  -0.070   6.926
  123   2HD   PRO  14          HD1       PRO  14  14.347  -0.735   7.800
  124    H    ALA  15           HN       ALA  15  13.780   2.938  11.723
  125    HA   ALA  15           HA       ALA  15  11.175   3.586  12.418
  126   1HB   ALA  15          HB1       ALA  15  13.639   5.268  12.849
  127   2HB   ALA  15          HB2       ALA  15  13.173   3.879  13.832
  128   3HB   ALA  15          HB3       ALA  15  12.150   5.317  13.795
  129    H    GLY  16           HN       GLY  16  11.036   4.022   9.662
  130   1HA   GLY  16          HA2       GLY  16   9.942   6.650   9.539
  131   2HA   GLY  16          HA1       GLY  16  11.484   6.627   8.733
  132    H    ALA  17           HN       ALA  17  10.926   3.686   8.147
  133    HA   ALA  17           HA       ALA  17  10.056   4.120   5.471
  134   1HB   ALA  17          HB1       ALA  17  10.868   1.734   7.077
  135   2HB   ALA  17          HB2       ALA  17  11.628   2.412   5.642
  136   3HB   ALA  17          HB3       ALA  17  10.126   1.499   5.493
  137    H    ILE  18           HN       ILE  18   8.270   2.776   8.211
  138    HA   ILE  18           HA       ILE  18   6.134   1.796   6.680
  139    HB   ILE  18           HB       ILE  18   6.262   2.920   9.483
  140   1HG1  ILE  18          HG12      ILE  18   7.420   0.685   8.684
  141   2HG1  ILE  18          HG11      ILE  18   6.521   0.710  10.194
  142   1HG2  ILE  18          HG21      ILE  18   3.987   3.212   8.949
  143   2HG2  ILE  18          HG22      ILE  18   4.030   1.626   9.720
  144   3HG2  ILE  18          HG23      ILE  18   3.935   1.750   7.963
  145   1HD1  ILE  18          HD11      ILE  18   4.726  -0.488   9.306
  146   2HD1  ILE  18          HD12      ILE  18   6.096  -1.224   8.476
  147   3HD1  ILE  18          HD13      ILE  18   5.104  -0.028   7.648
  148    H    ASP  19           HN       ASP  19   6.615   4.967   8.229
  149    HA   ASP  19           HA       ASP  19   4.217   6.128   7.230
  150   1HB   ASP  19          HB2       ASP  19   6.826   7.391   8.130
  151   2HB   ASP  19          HB1       ASP  19   5.401   8.323   7.676
  152    H    ALA  20           HN       ALA  20   7.468   5.861   5.848
  153    HA   ALA  20           HA       ALA  20   6.869   7.553   3.675
  154   1HB   ALA  20          HB1       ALA  20   8.938   6.943   2.774
  155   2HB   ALA  20          HB2       ALA  20   8.847   5.302   3.418
  156   3HB   ALA  20          HB3       ALA  20   9.182   6.654   4.496
  157    H    LEU  21           HN       LEU  21   6.556   4.071   4.142
  158    HA   LEU  21           HA       LEU  21   5.852   3.346   1.547
  159   1HB   LEU  21          HB2       LEU  21   6.550   1.692   3.137
  160   2HB   LEU  21          HB1       LEU  21   5.289   2.159   4.268
  161    HG   LEU  21           HG       LEU  21   3.587   1.341   2.696
  162   1HD1  LEU  21          HD11      LEU  21   4.676   1.627   0.558
  163   2HD1  LEU  21          HD12      LEU  21   4.406  -0.098   0.776
  164   3HD1  LEU  21          HD13      LEU  21   6.008   0.582   1.046
  165   1HD2  LEU  21          HD21      LEU  21   5.788  -0.633   3.354
  166   2HD2  LEU  21          HD22      LEU  21   4.144  -1.084   2.901
  167   3HD2  LEU  21          HD23      LEU  21   4.434  -0.191   4.393
  168    H    ALA  22           HN       ALA  22   3.827   4.176   4.332
  169    HA   ALA  22           HA       ALA  22   1.303   3.879   3.053
  170   1HB   ALA  22          HB1       ALA  22   1.346   4.011   5.449
  171   2HB   ALA  22          HB2       ALA  22   0.523   5.458   4.868
  172   3HB   ALA  22          HB3       ALA  22   2.200   5.554   5.407
  173    H    GLY  23           HN       GLY  23   3.499   6.667   3.224
  174   1HA   GLY  23          HA2       GLY  23   1.688   8.475   1.925
  175   2HA   GLY  23          HA1       GLY  23   3.449   8.640   2.118
  176    H    GLU  24           HN       GLU  24   4.323   6.383   0.659
  177    HA   GLU  24           HA       GLU  24   3.985   7.355  -1.975
  178   1HB   GLU  24          HB2       GLU  24   6.020   6.129  -1.156
  179   2HB   GLU  24          HB1       GLU  24   5.075   4.641  -1.160
  180   1HG   GLU  24          HG2       GLU  24   6.295   4.768  -3.252
  181   2HG   GLU  24          HG1       GLU  24   4.588   5.032  -3.598
  182    H    LEU  25           HN       LEU  25   2.555   4.598  -0.267
  183    HA   LEU  25           HA       LEU  25   1.238   3.516  -2.508
  184   1HB   LEU  25          HB2       LEU  25   0.578   3.373   0.433
  185   2HB   LEU  25          HB1       LEU  25  -0.335   2.497  -0.790
  186    HG   LEU  25           HG       LEU  25   2.661   2.243  -0.405
  187   1HD1  LEU  25          HD11      LEU  25   2.074   0.029   0.626
  188   2HD1  LEU  25          HD12      LEU  25   0.378   0.512   0.596
  189   3HD1  LEU  25          HD13      LEU  25   1.531   1.406   1.582
  190   1HD2  LEU  25          HD21      LEU  25   1.998  -0.016  -1.658
  191   2HD2  LEU  25          HD22      LEU  25   2.280   1.456  -2.574
  192   3HD2  LEU  25          HD23      LEU  25   0.631   0.946  -2.216
  193    H    SER  26           HN       SER  26   0.178   5.939  -0.157
  194    HA   SER  26           HA       SER  26  -2.485   6.138  -1.046
  195   1HB   SER  26          HB2       SER  26  -2.512   8.321   0.047
  196   2HB   SER  26          HB1       SER  26  -1.677   7.145   1.056
  197    HG   SER  26           HG       SER  26  -0.140   8.585   1.006
  198    H    ARG  27           HN       ARG  27   0.428   7.958  -2.084
  199    HA   ARG  27           HA       ARG  27  -0.922   9.653  -3.900
  200   1HB   ARG  27          HB2       ARG  27   1.927   8.618  -3.882
  201   2HB   ARG  27          HB1       ARG  27   1.335   9.828  -5.022
  202   1HG   ARG  27          HG2       ARG  27   0.672  11.283  -3.142
  203   2HG   ARG  27          HG1       ARG  27   1.267  10.077  -2.002
  204   1HD   ARG  27          HD2       ARG  27   2.944  11.518  -4.075
  205   2HD   ARG  27          HD1       ARG  27   2.929  11.860  -2.349
  206    HE   ARG  27           HE       ARG  27   3.552   9.113  -2.872
  207   1HH1  ARG  27          HH11      ARG  27   4.795  11.229  -0.922
  208   2HH1  ARG  27          HH12      ARG  27   6.431  11.241  -1.491
  209   1HH2  ARG  27          HH21      ARG  27   5.690   9.612  -4.461
  210   2HH2  ARG  27          HH22      ARG  27   6.937  10.326  -3.494
  211    H    ARG  28           HN       ARG  28   0.464   6.416  -4.315
  212    HA   ARG  28           HA       ARG  28   0.031   6.210  -7.100
  213   1HB   ARG  28          HB2       ARG  28   0.143   4.064  -4.970
  214   2HB   ARG  28          HB1       ARG  28   0.187   3.762  -6.703
  215   1HG   ARG  28          HG2       ARG  28   2.169   5.636  -5.413
  216   2HG   ARG  28          HG1       ARG  28   2.449   3.897  -5.431
  217   1HD   ARG  28          HD2       ARG  28   2.137   3.959  -7.942
  218   2HD   ARG  28          HD1       ARG  28   2.115   5.714  -7.835
  219    HE   ARG  28           HE       ARG  28   4.425   5.030  -6.556
  220   1HH1  ARG  28          HH11      ARG  28   3.890   2.728  -8.708
  221   2HH1  ARG  28          HH12      ARG  28   5.005   3.237  -9.932
  222   1HH2  ARG  28          HH21      ARG  28   5.502   6.377  -8.549
  223   2HH2  ARG  28          HH22      ARG  28   5.919   5.302  -9.841
  224    H    ILE  29           HN       ILE  29  -2.004   5.441  -4.326
  225    HA   ILE  29           HA       ILE  29  -4.098   4.192  -5.780
  226    HB   ILE  29           HB       ILE  29  -4.032   5.516  -3.069
  227   1HG1  ILE  29          HG12      ILE  29  -2.753   3.427  -3.235
  228   2HG1  ILE  29          HG11      ILE  29  -4.192   3.170  -2.265
  229   1HG2  ILE  29          HG21      ILE  29  -6.236   4.230  -2.746
  230   2HG2  ILE  29          HG22      ILE  29  -6.307   4.150  -4.506
  231   3HG2  ILE  29          HG23      ILE  29  -6.306   5.715  -3.695
  232   1HD1  ILE  29          HD11      ILE  29  -3.500   2.111  -4.972
  233   2HD1  ILE  29          HD12      ILE  29  -5.200   2.443  -4.645
  234   3HD1  ILE  29          HD13      ILE  29  -4.309   1.314  -3.631
  235    H    GLN  30           HN       GLN  30  -3.682   7.517  -4.679
  236    HA   GLN  30           HA       GLN  30  -6.200   8.474  -5.626
  237   1HB   GLN  30          HB2       GLN  30  -4.896   9.807  -4.051
  238   2HB   GLN  30          HB1       GLN  30  -3.568   9.923  -5.205
  239   1HG   GLN  30          HG2       GLN  30  -4.907  11.234  -6.728
  240   2HG   GLN  30          HG1       GLN  30  -6.364  10.948  -5.778
  241   1HE2  GLN  30          HE21      GLN  30  -4.003  11.326  -3.495
  242   2HE2  GLN  30          HE22      GLN  30  -4.112  13.002  -3.248
  243    H    TYR  31           HN       TYR  31  -3.032   8.208  -7.276
  244    HA   TYR  31           HA       TYR  31  -3.953   9.548  -9.584
  245   1HB   TYR  31          HB2       TYR  31  -1.549   9.246  -9.139
  246   2HB   TYR  31          HB1       TYR  31  -1.736   7.497  -9.289
  247    HD1  TYR  31           HD1      TYR  31  -2.148   6.446 -11.444
  248    HD2  TYR  31           HD2      TYR  31  -1.696  10.703 -11.103
  249    HE1  TYR  31           HE1      TYR  31  -1.887   6.613 -13.903
  250    HE2  TYR  31           HE2      TYR  31  -1.434  10.872 -13.564
  251    HH   TYR  31           HH       TYR  31  -0.772   8.280 -15.523
  252    H    ALA  32           HN       ALA  32  -3.961   6.141  -8.631
  253    HA   ALA  32           HA       ALA  32  -4.905   5.175 -11.138
  254   1HB   ALA  32          HB1       ALA  32  -5.443   3.105  -9.815
  255   2HB   ALA  32          HB2       ALA  32  -4.904   3.969  -8.375
  256   3HB   ALA  32          HB3       ALA  32  -3.773   3.656  -9.691
  257    H    PHE  33           HN       PHE  33  -6.483   6.179  -8.155
  258    HA   PHE  33           HA       PHE  33  -9.155   5.786  -9.412
  259   1HB   PHE  33          HB2       PHE  33  -8.359   5.668  -6.499
  260   2HB   PHE  33          HB1       PHE  33 -10.008   5.540  -7.112
  261    HD1  PHE  33           HD1      PHE  33  -6.724   3.891  -6.901
  262    HD2  PHE  33           HD2      PHE  33 -10.752   3.575  -8.360
  263    HE1  PHE  33           HE1      PHE  33  -6.373   1.478  -7.349
  264    HE2  PHE  33           HE2      PHE  33 -10.401   1.160  -8.805
  265    HZ   PHE  33           HZ       PHE  33  -8.211   0.112  -8.300
  266    HA   PRO  34           HA       PRO  34  -8.645  10.317  -8.734
  267   1HB   PRO  34          HB2       PRO  34 -10.243  10.769 -11.115
  268   2HB   PRO  34          HB1       PRO  34  -8.530  11.124 -10.848
  269   1HG   PRO  34          HG2       PRO  34  -9.538   9.146 -12.528
  270   2HG   PRO  34          HG1       PRO  34  -7.874   9.253 -11.934
  271   1HD   PRO  34          HD2       PRO  34 -10.069   7.449 -11.047
  272   2HD   PRO  34          HD1       PRO  34  -8.308   7.222 -10.972
  273    H    ASP  35           HN       ASP  35 -11.510   8.471  -9.550
  274    HA   ASP  35           HA       ASP  35 -13.343  10.518  -8.574
  275   1HB   ASP  35          HB2       ASP  35 -13.751   9.197 -10.655
  276   2HB   ASP  35          HB1       ASP  35 -14.018   7.783  -9.636
  277    H    ASN  36           HN       ASN  36 -11.738   7.867  -7.038
  278    HA   ASN  36           HA       ASN  36 -13.959   7.697  -5.059
  279   1HB   ASN  36          HB2       ASN  36 -12.042   5.584  -5.999
  280   2HB   ASN  36          HB1       ASN  36 -13.047   5.411  -4.564
  281   1HD2  ASN  36          HD21      ASN  36 -13.328   3.737  -6.918
  282   2HD2  ASN  36          HD22      ASN  36 -14.861   4.046  -7.579
  283    H    GLU  37           HN       GLU  37 -13.355   8.312  -2.889
  284    HA   GLU  37           HA       GLU  37 -10.815   9.261  -2.227
  285   1HB   GLU  37          HB2       GLU  37 -13.039   9.683  -1.144
  286   2HB   GLU  37          HB1       GLU  37 -12.899   8.091  -0.401
  287   1HG   GLU  37          HG2       GLU  37 -12.036   9.682   1.184
  288   2HG   GLU  37          HG1       GLU  37 -10.647   8.829   0.510
  289    H    GLY  38           HN       GLY  38  -8.997   8.042  -1.839
  290   1HA   GLY  38          HA2       GLY  38  -9.295   5.159  -1.092
  291   2HA   GLY  38          HA1       GLY  38  -7.953   5.706  -1.849
  292    H    HIS  39           HN       HIS  39  -8.789   4.720   1.171
  293    HA   HIS  39           HA       HIS  39  -6.924   6.619   2.456
  294   1HB   HIS  39          HB2       HIS  39  -9.181   4.959   3.614
  295   2HB   HIS  39          HB1       HIS  39  -8.004   5.826   4.600
  296    HD1  HIS  39           HD1      HIS  39  -7.780   8.510   3.751
  297    HD2  HIS  39           HD2      HIS  39 -11.388   6.523   3.109
  298    HE1  HIS  39           HE1      HIS  39  -9.535  10.304   3.418
  299    H    VAL  40           HN       VAL  40  -4.970   5.672   2.969
  300    HA   VAL  40           HA       VAL  40  -4.838   2.739   3.020
  301    HB   VAL  40           HB       VAL  40  -2.734   4.770   2.295
  302   1HG1  VAL  40          HG11      VAL  40  -1.555   2.928   3.161
  303   2HG1  VAL  40          HG12      VAL  40  -1.647   2.562   1.439
  304   3HG1  VAL  40          HG13      VAL  40  -2.741   1.765   2.568
  305   1HG2  VAL  40          HG21      VAL  40  -4.688   4.435   0.693
  306   2HG2  VAL  40          HG22      VAL  40  -4.190   2.747   0.564
  307   3HG2  VAL  40          HG23      VAL  40  -3.106   4.027   0.024
  308    H    SER  41           HN       SER  41  -4.173   1.792   4.810
  309    HA   SER  41           HA       SER  41  -2.695   3.361   6.854
  310   1HB   SER  41          HB2       SER  41  -4.920   1.366   7.361
  311   2HB   SER  41          HB1       SER  41  -3.883   2.039   8.616
  312    HG   SER  41           HG       SER  41  -5.413   3.596   6.799
  313    H    VAL  42           HN       VAL  42  -1.024   2.376   7.865
  314    HA   VAL  42           HA       VAL  42  -0.462  -0.439   7.148
  315    HB   VAL  42           HB       VAL  42   1.566   1.828   7.173
  316   1HG1  VAL  42          HG11      VAL  42   1.848  -1.138   6.619
  317   2HG1  VAL  42          HG12      VAL  42   2.568  -0.236   7.954
  318   3HG1  VAL  42          HG13      VAL  42   3.107   0.055   6.302
  319   1HG2  VAL  42          HG21      VAL  42   0.856   0.145   4.770
  320   2HG2  VAL  42          HG22      VAL  42   1.629   1.729   4.825
  321   3HG2  VAL  42          HG23      VAL  42  -0.093   1.578   5.166
  322    H    ARG  43           HN       ARG  43  -0.022  -1.675   8.820
  323    HA   ARG  43           HA       ARG  43   1.158  -0.507  11.219
  324   1HB   ARG  43          HB2       ARG  43  -0.624  -1.430  12.680
  325   2HB   ARG  43          HB1       ARG  43  -1.238  -0.199  11.576
  326   1HG   ARG  43          HG2       ARG  43  -1.985  -1.995  10.025
  327   2HG   ARG  43          HG1       ARG  43  -1.440  -3.201  11.191
  328   1HD   ARG  43          HD2       ARG  43  -3.859  -2.787  11.422
  329   2HD   ARG  43          HD1       ARG  43  -2.991  -2.286  12.872
  330    HE   ARG  43           HE       ARG  43  -3.302  -0.136  10.990
  331   1HH1  ARG  43          HH11      ARG  43  -5.665  -2.025  12.426
  332   2HH1  ARG  43          HH12      ARG  43  -6.403  -0.749  13.335
  333   1HH2  ARG  43          HH21      ARG  43  -3.907   1.553  12.626
  334   2HH2  ARG  43          HH22      ARG  43  -5.406   1.278  13.449
  335    H    TYR  44           HN       TYR  44   1.825  -2.159  12.794
  336    HA   TYR  44           HA       TYR  44   2.746  -4.592  11.453
  337   1HB   TYR  44          HB2       TYR  44   3.197  -3.504  14.248
  338   2HB   TYR  44          HB1       TYR  44   3.863  -5.022  13.663
  339    HD1  TYR  44           HD1      TYR  44   5.110  -4.822  11.287
  340    HD2  TYR  44           HD2      TYR  44   4.549  -1.605  14.082
  341    HE1  TYR  44           HE1      TYR  44   7.038  -3.618  10.293
  342    HE2  TYR  44           HE2      TYR  44   6.470  -0.404  13.088
  343    HH   TYR  44           HH       TYR  44   7.878  -1.324  10.116
  344    H    ALA  45           HN       ALA  45   2.035  -6.592  11.767
  345    HA   ALA  45           HA       ALA  45   0.023  -7.124  13.845
  346   1HB   ALA  45          HB1       ALA  45  -0.378  -8.020  10.986
  347   2HB   ALA  45          HB2       ALA  45  -1.100  -6.539  11.618
  348   3HB   ALA  45          HB3       ALA  45  -1.525  -8.099  12.323
  349    H    ALA  46           HN       ALA  46  -0.364  -9.576  13.950
  350    HA   ALA  46           HA       ALA  46   2.146 -10.836  14.220
  351   1HB   ALA  46          HB1       ALA  46   0.057 -11.499  15.472
  352   2HB   ALA  46          HB2       ALA  46   0.929 -12.856  14.758
  353   3HB   ALA  46          HB3       ALA  46  -0.530 -12.239  13.982
  354    H    ALA  47           HN       ALA  47  -0.037 -10.610  11.478
  355    HA   ALA  47           HA       ALA  47   1.966 -12.121   9.916
  356   1HB   ALA  47          HB1       ALA  47  -1.008 -12.639   9.990
  357   2HB   ALA  47          HB2       ALA  47   0.297 -13.768  10.356
  358   3HB   ALA  47          HB3       ALA  47   0.040 -13.225   8.698
  359    H    ASN  48           HN       ASN  48   2.044 -11.704   7.685
  360    HA   ASN  48           HA       ASN  48   1.364  -9.009   6.900
  361   1HB   ASN  48          HB2       ASN  48   3.365 -10.284   6.044
  362   2HB   ASN  48          HB1       ASN  48   2.251 -11.305   5.136
  363   1HD2  ASN  48          HD21      ASN  48   2.239 -10.619   2.991
  364   2HD2  ASN  48          HD22      ASN  48   2.224  -8.998   2.489
  365    H    ASN  49           HN       ASN  49  -0.554  -8.370   6.040
  366    HA   ASN  49           HA       ASN  49  -2.170 -10.231   4.468
  367   1HB   ASN  49          HB2       ASN  49  -3.249  -8.901   6.966
  368   2HB   ASN  49          HB1       ASN  49  -4.194  -9.815   5.797
  369   1HD2  ASN  49          HD21      ASN  49  -2.758 -12.090   5.324
  370   2HD2  ASN  49          HD22      ASN  49  -2.460 -12.938   6.764
  371    H    LEU  50           HN       LEU  50  -3.668  -9.172   3.117
  372    HA   LEU  50           HA       LEU  50  -3.573  -6.208   3.078
  373   1HB   LEU  50          HB2       LEU  50  -2.226  -7.196   1.207
  374   2HB   LEU  50          HB1       LEU  50  -3.639  -8.115   0.706
  375    HG   LEU  50           HG       LEU  50  -4.850  -5.842   0.492
  376   1HD1  LEU  50          HD11      LEU  50  -3.367  -4.394   1.690
  377   2HD1  LEU  50          HD12      LEU  50  -3.255  -3.949  -0.010
  378   3HD1  LEU  50          HD13      LEU  50  -1.984  -4.919   0.729
  379   1HD2  LEU  50          HD21      LEU  50  -3.890  -5.425  -1.745
  380   2HD2  LEU  50          HD22      LEU  50  -4.106  -7.151  -1.467
  381   3HD2  LEU  50          HD23      LEU  50  -2.501  -6.430  -1.338
  382    H    SER  51           HN       SER  51  -5.644  -5.424   3.420
  383    HA   SER  51           HA       SER  51  -7.917  -7.154   2.608
  384   1HB   SER  51          HB2       SER  51  -7.642  -7.011   5.065
  385   2HB   SER  51          HB1       SER  51  -7.744  -5.256   4.960
  386    HG   SER  51           HG       SER  51  -9.714  -7.175   4.263
  387    H    VAL  52           HN       VAL  52  -9.325  -6.183   1.208
  388    HA   VAL  52           HA       VAL  52  -9.270  -3.237   0.966
  389    HB   VAL  52           HB       VAL  52  -9.657  -5.261  -1.261
  390   1HG1  VAL  52          HG11      VAL  52 -11.001  -3.241  -1.616
  391   2HG1  VAL  52          HG12      VAL  52  -9.632  -3.250  -2.724
  392   3HG1  VAL  52          HG13      VAL  52  -9.595  -2.228  -1.288
  393   1HG2  VAL  52          HG21      VAL  52  -7.322  -5.141  -0.613
  394   2HG2  VAL  52          HG22      VAL  52  -7.379  -3.379  -0.584
  395   3HG2  VAL  52          HG23      VAL  52  -7.523  -4.240  -2.116
  396    H    ILE  53           HN       ILE  53 -11.221  -2.313   1.373
  397    HA   ILE  53           HA       ILE  53 -13.650  -4.003   1.142
  398    HB   ILE  53           HB       ILE  53 -13.030  -1.786   3.105
  399   1HG1  ILE  53          HG12      ILE  53 -12.034  -4.257   3.324
  400   2HG1  ILE  53          HG11      ILE  53 -12.653  -3.403   4.731
  401   1HG2  ILE  53          HG21      ILE  53 -15.348  -1.650   2.630
  402   2HG2  ILE  53          HG22      ILE  53 -15.239  -2.588   4.120
  403   3HG2  ILE  53          HG23      ILE  53 -15.525  -3.405   2.583
  404   1HD1  ILE  53          HD11      ILE  53 -14.602  -4.687   4.825
  405   2HD1  ILE  53          HD12      ILE  53 -13.418  -5.873   4.282
  406   3HD1  ILE  53          HD13      ILE  53 -14.519  -5.136   3.123
  407    H    GLY  54           HN       GLY  54 -15.213  -3.267  -0.170
  408   1HA   GLY  54          HA2       GLY  54 -16.634  -1.638  -1.118
  409   2HA   GLY  54          HA1       GLY  54 -15.460  -0.396  -0.690
  410    H    ALA  55           HN       ALA  55 -14.097  -3.151  -2.259
  411    HA   ALA  55           HA       ALA  55 -14.039  -1.647  -4.825
  412   1HB   ALA  55          HB1       ALA  55 -11.762  -2.096  -5.102
  413   2HB   ALA  55          HB2       ALA  55 -11.775  -3.412  -3.929
  414   3HB   ALA  55          HB3       ALA  55 -11.883  -1.741  -3.379
  415    H    THR  56           HN       THR  56 -13.548  -2.881  -6.712
  416    HA   THR  56           HA       THR  56 -14.991  -5.458  -6.936
  417    HB   THR  56           HB       THR  56 -14.840  -4.980  -9.289
  418    HG1  THR  56           HG1      THR  56 -12.740  -3.871  -8.979
  419   1HG2  THR  56          HG21      THR  56 -15.605  -2.414  -7.881
  420   2HG2  THR  56          HG22      THR  56 -16.605  -3.866  -7.843
  421   3HG2  THR  56          HG23      THR  56 -16.276  -3.063  -9.378
  422    H    LYS  57           HN       LYS  57 -14.053  -7.156  -8.068
  423    HA   LYS  57           HA       LYS  57 -11.557  -7.936  -7.150
  424   1HB   LYS  57          HB2       LYS  57 -13.035  -8.927  -9.607
  425   2HB   LYS  57          HB1       LYS  57 -11.719  -9.772  -8.801
  426   1HG   LYS  57          HG2       LYS  57 -13.091  -9.939  -6.733
  427   2HG   LYS  57          HG1       LYS  57 -14.404  -9.086  -7.548
  428   1HD   LYS  57          HD2       LYS  57 -14.530 -10.887  -9.225
  429   2HD   LYS  57          HD1       LYS  57 -13.212 -11.735  -8.414
  430   1HE   LYS  57          HE2       LYS  57 -15.451 -12.612  -7.754
  431   2HE   LYS  57          HE1       LYS  57 -14.554 -11.956  -6.384
  432   1HZ   LYS  57          HZ1       LYS  57 -15.787  -9.918  -6.552
  433   2HZ   LYS  57          HZ2       LYS  57 -16.879 -11.215  -6.446
  434   3HZ   LYS  57          HZ3       LYS  57 -16.593 -10.462  -7.942
  435    H    GLU  58           HN       GLU  58 -12.336  -6.383 -10.319
  436    HA   GLU  58           HA       GLU  58  -9.712  -6.720 -11.360
  437   1HB   GLU  58          HB2       GLU  58 -12.025  -4.896 -12.023
  438   2HB   GLU  58          HB1       GLU  58 -10.481  -4.758 -12.858
  439   1HG   GLU  58          HG2       GLU  58 -12.137  -7.304 -12.712
  440   2HG   GLU  58          HG1       GLU  58 -12.114  -6.196 -14.079
  441    H    ASP  59           HN       ASP  59 -11.258  -4.163  -9.435
  442    HA   ASP  59           HA       ASP  59  -9.157  -2.282  -9.633
  443   1HB   ASP  59          HB2       ASP  59 -11.244  -2.746  -7.491
  444   2HB   ASP  59          HB1       ASP  59 -10.105  -1.402  -7.451
  445    H    LYS  60           HN       LYS  60  -9.902  -4.871  -7.388
  446    HA   LYS  60           HA       LYS  60  -7.708  -4.464  -5.637
  447   1HB   LYS  60          HB2       LYS  60  -9.679  -5.838  -5.020
  448   2HB   LYS  60          HB1       LYS  60  -9.212  -7.032  -6.229
  449   1HG   LYS  60          HG2       LYS  60  -7.076  -7.408  -5.038
  450   2HG   LYS  60          HG1       LYS  60  -7.546  -6.212  -3.829
  451   1HD   LYS  60          HD2       LYS  60  -9.413  -7.557  -3.117
  452   2HD   LYS  60          HD1       LYS  60  -9.189  -8.674  -4.464
  453   1HE   LYS  60          HE2       LYS  60  -7.096  -9.458  -3.568
  454   2HE   LYS  60          HE1       LYS  60  -7.089  -8.197  -2.334
  455   1HZ   LYS  60          HZ1       LYS  60  -7.849 -10.160  -1.301
  456   2HZ   LYS  60          HZ2       LYS  60  -8.937 -10.503  -2.560
  457   3HZ   LYS  60          HZ3       LYS  60  -9.221  -9.189  -1.522
  458    H    GLN  61           HN       GLN  61  -7.899  -6.453  -8.621
  459    HA   GLN  61           HA       GLN  61  -5.313  -7.592  -8.233
  460   1HB   GLN  61          HB2       GLN  61  -6.942  -7.064 -10.736
  461   2HB   GLN  61          HB1       GLN  61  -5.395  -7.912 -10.744
  462   1HG   GLN  61          HG2       GLN  61  -6.264  -9.666  -9.340
  463   2HG   GLN  61          HG1       GLN  61  -7.754  -8.769  -9.051
  464   1HE2  GLN  61          HE21      GLN  61  -7.769 -11.418 -10.189
  465   2HE2  GLN  61          HE22      GLN  61  -8.328 -11.295 -11.787
  466    H    ARG  62           HN       ARG  62  -6.477  -4.621  -9.874
  467    HA   ARG  62           HA       ARG  62  -3.972  -3.853 -10.862
  468   1HB   ARG  62          HB2       ARG  62  -6.063  -2.795 -11.621
  469   2HB   ARG  62          HB1       ARG  62  -6.300  -2.099 -10.021
  470   1HG   ARG  62          HG2       ARG  62  -5.343  -0.437 -11.565
  471   2HG   ARG  62          HG1       ARG  62  -4.211  -0.808 -10.270
  472   1HD   ARG  62          HD2       ARG  62  -2.821  -2.087 -11.694
  473   2HD   ARG  62          HD1       ARG  62  -4.083  -2.263 -12.913
  474    HE   ARG  62           HE       ARG  62  -3.471  -0.179 -13.758
  475   1HH1  ARG  62          HH11      ARG  62  -0.811  -1.024 -12.239
  476   2HH1  ARG  62          HH12      ARG  62  -0.362   0.517 -11.587
  477   1HH2  ARG  62          HH21      ARG  62  -3.442   1.980 -12.217
  478   2HH2  ARG  62          HH22      ARG  62  -1.852   2.216 -11.575
  479    H    ILE  63           HN       ILE  63  -5.577  -3.159  -7.786
  480    HA   ILE  63           HA       ILE  63  -3.520  -1.523  -6.772
  481    HB   ILE  63           HB       ILE  63  -5.560  -3.199  -5.338
  482   1HG1  ILE  63          HG12      ILE  63  -5.335  -0.191  -5.553
  483   2HG1  ILE  63          HG11      ILE  63  -6.256  -1.159  -6.703
  484   1HG2  ILE  63          HG21      ILE  63  -3.391  -1.407  -4.257
  485   2HG2  ILE  63          HG22      ILE  63  -3.856  -3.019  -3.717
  486   3HG2  ILE  63          HG23      ILE  63  -4.893  -1.640  -3.361
  487   1HD1  ILE  63          HD11      ILE  63  -6.716  -1.017  -3.708
  488   2HD1  ILE  63          HD12      ILE  63  -7.590  -2.082  -4.809
  489   3HD1  ILE  63          HD13      ILE  63  -7.754  -0.332  -4.958
  490    H    SER  64           HN       SER  64  -3.921  -5.033  -6.564
  491    HA   SER  64           HA       SER  64  -1.625  -5.451  -4.937
  492   1HB   SER  64          HB2       SER  64  -2.812  -7.252  -7.071
  493   2HB   SER  64          HB1       SER  64  -1.578  -7.742  -5.913
  494    HG   SER  64           HG       SER  64  -3.024  -7.437  -4.266
  495    H    GLU  65           HN       GLU  65  -2.045  -5.098  -8.510
  496    HA   GLU  65           HA       GLU  65   0.652  -5.605  -9.158
  497   1HB   GLU  65          HB2       GLU  65  -1.479  -3.974 -10.563
  498   2HB   GLU  65          HB1       GLU  65   0.118  -4.278 -11.250
  499   1HG   GLU  65          HG2       GLU  65  -0.263  -6.691 -11.147
  500   2HG   GLU  65          HG1       GLU  65  -1.831  -6.432 -10.384
  501    H    ILE  66           HN       ILE  66  -1.052  -2.617  -8.342
  502    HA   ILE  66           HA       ILE  66   1.089  -0.853  -8.773
  503    HB   ILE  66           HB       ILE  66  -1.288  -0.741  -6.909
  504   1HG1  ILE  66          HG12      ILE  66  -0.632   0.738  -9.476
  505   2HG1  ILE  66          HG11      ILE  66  -1.639  -0.705  -9.393
  506   1HG2  ILE  66          HG21      ILE  66  -0.794   1.683  -6.692
  507   2HG2  ILE  66          HG22      ILE  66   0.744   1.432  -7.515
  508   3HG2  ILE  66          HG23      ILE  66   0.450   0.694  -5.940
  509   1HD1  ILE  66          HD11      ILE  66  -3.240   0.456  -7.953
  510   2HD1  ILE  66          HD12      ILE  66  -2.985   1.393  -9.423
  511   3HD1  ILE  66          HD13      ILE  66  -2.209   1.884  -7.918
  512    H    LEU  67           HN       LEU  67   0.108  -2.641  -5.874
  513    HA   LEU  67           HA       LEU  67   2.108  -1.647  -4.165
  514   1HB   LEU  67          HB2       LEU  67   0.286  -2.866  -3.168
  515   2HB   LEU  67          HB1       LEU  67   0.563  -4.255  -4.208
  516    HG   LEU  67           HG       LEU  67   2.803  -4.586  -3.053
  517   1HD1  LEU  67          HD11      LEU  67   1.703  -2.311  -1.388
  518   2HD1  LEU  67          HD12      LEU  67   3.311  -2.470  -2.097
  519   3HD1  LEU  67          HD13      LEU  67   2.855  -3.465  -0.719
  520   1HD2  LEU  67          HD21      LEU  67   0.802  -5.882  -2.434
  521   2HD2  LEU  67          HD22      LEU  67   0.319  -4.613  -1.308
  522   3HD2  LEU  67          HD23      LEU  67   1.789  -5.541  -1.013
  523    H    GLN  68           HN       GLN  68   2.067  -4.392  -6.389
  524    HA   GLN  68           HA       GLN  68   4.652  -5.374  -5.735
  525   1HB   GLN  68          HB2       GLN  68   3.045  -5.491  -8.300
  526   2HB   GLN  68          HB1       GLN  68   4.583  -6.322  -8.073
  527   1HG   GLN  68          HG2       GLN  68   3.689  -7.659  -6.288
  528   2HG   GLN  68          HG1       GLN  68   2.208  -6.705  -6.237
  529   1HE2  GLN  68          HE21      GLN  68   3.878  -9.287  -7.940
  530   2HE2  GLN  68          HE22      GLN  68   2.600  -9.670  -8.990
  531    H    GLU  69           HN       GLU  69   3.650  -3.083  -8.337
  532    HA   GLU  69           HA       GLU  69   6.254  -2.656  -9.251
  533   1HB   GLU  69          HB2       GLU  69   3.758  -0.975  -9.433
  534   2HB   GLU  69          HB1       GLU  69   5.265  -0.548 -10.244
  535   1HG   GLU  69          HG2       GLU  69   5.270  -2.726 -11.399
  536   2HG   GLU  69          HG1       GLU  69   3.765  -3.160 -10.593
  537    H    THR  70           HN       THR  70   4.417  -0.745  -6.849
  538    HA   THR  70           HA       THR  70   6.331   1.289  -6.509
  539    HB   THR  70           HB       THR  70   4.417   0.114  -4.523
  540    HG1  THR  70           HG1      THR  70   2.996   1.427  -5.370
  541   1HG2  THR  70          HG21      THR  70   4.650   2.356  -3.406
  542   2HG2  THR  70          HG22      THR  70   6.017   2.672  -4.474
  543   3HG2  THR  70          HG23      THR  70   6.092   1.347  -3.312
  544    H    TRP  71           HN       TRP  71   5.814  -1.725  -4.852
  545    HA   TRP  71           HA       TRP  71   7.883  -1.619  -3.032
  546   1HB   TRP  71          HB2       TRP  71   5.933  -3.123  -3.002
  547   2HB   TRP  71          HB1       TRP  71   6.617  -3.994  -4.362
  548    HD1  TRP  71           HD1      TRP  71   7.474  -6.205  -3.514
  549    HE1  TRP  71           HE1      TRP  71   8.870  -7.023  -1.518
  550    HE3  TRP  71           HE3      TRP  71   7.927  -1.834  -0.836
  551    HZ2  TRP  71           HZ2      TRP  71  10.005  -6.002   0.882
  552    HZ3  TRP  71           HZ3      TRP  71   9.162  -1.817   1.299
  553    HH2  TRP  71           HH2      TRP  71  10.196  -3.892   2.167
  554    H    GLU  72           HN       GLU  72   7.865  -2.805  -6.339
  555    HA   GLU  72           HA       GLU  72  10.572  -3.720  -6.237
  556   1HB   GLU  72          HB2       GLU  72   8.667  -3.302  -8.544
  557   2HB   GLU  72          HB1       GLU  72  10.320  -3.877  -8.768
  558   1HG   GLU  72          HG2       GLU  72   9.878  -5.771  -7.257
  559   2HG   GLU  72          HG1       GLU  72   8.232  -5.200  -7.009
  560    H    SER  73           HN       SER  73   9.224  -0.562  -6.689
  561    HA   SER  73           HA       SER  73  11.759   0.349  -7.931
  562   1HB   SER  73          HB2       SER  73  10.567   2.327  -8.630
  563   2HB   SER  73          HB1       SER  73   9.599   0.926  -9.075
  564    HG   SER  73           HG       SER  73   8.340   2.523  -8.044
  565    H    ALA  74           HN       ALA  74  11.174  -0.289  -5.013
  566    HA   ALA  74           HA       ALA  74  10.952   1.850  -3.392
  567   1HB   ALA  74          HB1       ALA  74  12.800  -0.482  -2.975
  568   2HB   ALA  74          HB2       ALA  74  11.053  -0.511  -2.723
  569   3HB   ALA  74          HB3       ALA  74  12.072   0.530  -1.726
  570    H    ASP  75           HN       ASP  75  13.971   0.938  -5.021
  571    HA   ASP  75           HA       ASP  75  15.668   2.576  -3.441
  572   1HB   ASP  75          HB2       ASP  75  17.291   2.281  -5.262
  573   2HB   ASP  75          HB1       ASP  75  16.522   0.758  -4.817
  574    H    ASP  76           HN       ASP  76  13.458   3.429  -5.982
  575    HA   ASP  76           HA       ASP  76  14.848   5.962  -6.578
  576   1HB   ASP  76          HB2       ASP  76  12.426   4.601  -7.740
  577   2HB   ASP  76          HB1       ASP  76  12.936   6.225  -8.200
  578    H    TRP  77           HN       TRP  77  11.653   4.972  -5.270
  579    HA   TRP  77           HA       TRP  77  11.068   7.794  -4.694
  580   1HB   TRP  77          HB2       TRP  77   8.865   7.144  -4.233
  581   2HB   TRP  77          HB1       TRP  77   9.365   6.234  -5.643
  582    HD1  TRP  77           HD1      TRP  77   9.359   3.607  -5.464
  583    HE1  TRP  77           HE1      TRP  77   8.760   1.952  -3.608
  584    HE3  TRP  77           HE3      TRP  77   8.970   6.802  -1.394
  585    HZ2  TRP  77           HZ2      TRP  77   8.210   1.929  -0.829
  586    HZ3  TRP  77           HZ3      TRP  77   8.406   5.881   0.800
  587    HH2  TRP  77           HH2      TRP  77   8.039   3.471   1.093
  588    H    PHE  78           HN       PHE  78  12.302   5.089  -2.875
  589    HA   PHE  78           HA       PHE  78  11.452   6.310  -0.335
  590   1HB   PHE  78          HB2       PHE  78  11.416   3.874  -0.413
  591   2HB   PHE  78          HB1       PHE  78  13.112   3.849  -0.872
  592    HD1  PHE  78           HD1      PHE  78  11.042   5.562   1.781
  593    HD2  PHE  78           HD2      PHE  78  14.602   3.300   0.875
  594    HE1  PHE  78           HE1      PHE  78  11.724   5.661   4.151
  595    HE2  PHE  78           HE2      PHE  78  15.259   3.402   3.253
  596    HZ   PHE  78           HZ       PHE  78  13.825   4.581   4.893
  597    H    VAL  79           HN       VAL  79  12.575   7.607   0.842
  598    HA   VAL  79           HA       VAL  79  15.443   8.032   0.243
  599    HB   VAL  79           HB       VAL  79  13.693  10.182   1.431
  600   1HG1  VAL  79          HG11      VAL  79  15.245  11.652   0.296
  601   2HG1  VAL  79          HG12      VAL  79  15.955  10.300  -0.585
  602   3HG1  VAL  79          HG13      VAL  79  16.181  10.432   1.159
  603   1HG2  VAL  79          HG21      VAL  79  13.229  10.927  -0.964
  604   2HG2  VAL  79          HG22      VAL  79  12.321   9.508  -0.426
  605   3HG2  VAL  79          HG23      VAL  79  13.728   9.314  -1.474
  606    H    SER  80           HN       SER  80  16.829   8.041   2.122
  607    HA   SER  80           HA       SER  80  15.467   7.696   4.744
  608   1HB   SER  80          HB2       SER  80  17.289   6.182   5.368
  609   2HB   SER  80          HB1       SER  80  16.520   5.581   3.897
  610    HG   SER  80           HG       SER  80  18.696   5.558   3.540
  611    H    GLU  81           HN       GLU  81  16.232   8.840   6.413
  612    HA   GLU  81           HA       GLU  81  17.732  11.195   5.905
  613   1HB   GLU  81          HB2       GLU  81  16.926   9.837   8.484
  614   2HB   GLU  81          HB1       GLU  81  17.710  11.415   8.412
  615   1HG   GLU  81          HG2       GLU  81  15.145  10.764   6.940
  616   2HG   GLU  81          HG1       GLU  81  15.182  11.494   8.544
  Start of MODEL    2
    1   1H    MET   1          HT1       MET   1 -14.754   3.873  -1.202
    2   2H    MET   1          HT2       MET   1 -13.310   4.761  -1.094
    3   3H    MET   1          HT3       MET   1 -14.128   4.289   0.319
    4    HA   MET   1           HA       MET   1 -13.771   1.928  -0.390
    5   1HB   MET   1          HB2       MET   1 -13.274   2.514  -2.754
    6   2HB   MET   1          HB1       MET   1 -11.792   3.306  -2.227
    7   1HG   MET   1          HG2       MET   1 -10.801   1.265  -1.557
    8   2HG   MET   1          HG1       MET   1 -12.351   0.423  -1.538
    9   1HE   MET   1          HE1       MET   1 -10.005   2.515  -3.478
   10   2HE   MET   1          HE2       MET   1  -9.983   1.917  -5.133
   11   3HE   MET   1          HE3       MET   1  -9.144   1.022  -3.870
   12    H    ARG   2           HN       ARG   2 -12.236   0.949   0.973
   13    HA   ARG   2           HA       ARG   2 -10.180   2.735   2.163
   14   1HB   ARG   2          HB2       ARG   2 -12.003   0.754   3.536
   15   2HB   ARG   2          HB1       ARG   2 -10.569   1.440   4.300
   16   1HG   ARG   2          HG2       ARG   2 -11.462   3.712   3.946
   17   2HG   ARG   2          HG1       ARG   2 -12.901   3.027   3.187
   18   1HD   ARG   2          HD2       ARG   2 -11.997   2.508   6.030
   19   2HD   ARG   2          HD1       ARG   2 -13.323   3.566   5.555
   20    HE   ARG   2           HE       ARG   2 -13.716   0.965   4.476
   21   1HH1  ARG   2          HH21      ARG   2 -13.301   2.282   7.608
   22   2HH1  ARG   2          HH22      ARG   2 -14.679   1.490   8.295
   23   1HH2  ARG   2          HH11      ARG   2 -15.724   0.126   5.281
   24   2HH2  ARG   2          HH12      ARG   2 -16.053   0.267   6.976
   25    H    ILE   3           HN       ILE   3  -8.177   1.934   2.275
   26    HA   ILE   3           HA       ILE   3  -7.736  -0.925   1.547
   27    HB   ILE   3           HB       ILE   3  -5.972   1.473   1.004
   28   1HG1  ILE   3          HG12      ILE   3  -6.501   0.589  -1.432
   29   2HG1  ILE   3          HG11      ILE   3  -7.906  -0.147  -0.669
   30   1HG2  ILE   3          HG21      ILE   3  -4.586  -0.440   1.375
   31   2HG2  ILE   3          HG22      ILE   3  -4.735  -0.276  -0.375
   32   3HG2  ILE   3          HG23      ILE   3  -5.685  -1.491   0.481
   33   1HD1  ILE   3          HD11      ILE   3  -8.103   2.249  -1.715
   34   2HD1  ILE   3          HD12      ILE   3  -7.336   2.782  -0.225
   35   3HD1  ILE   3          HD13      ILE   3  -8.875   1.923  -0.169
   36    H    GLU   4           HN       GLU   4  -6.796  -2.101   3.152
   37    HA   GLU   4           HA       GLU   4  -5.124  -0.679   5.164
   38   1HB   GLU   4          HB2       GLU   4  -7.016  -3.007   5.629
   39   2HB   GLU   4          HB1       GLU   4  -5.917  -2.342   6.838
   40   1HG   GLU   4          HG2       GLU   4  -7.015  -0.145   6.641
   41   2HG   GLU   4          HG1       GLU   4  -8.112  -0.798   5.425
   42    H    VAL   5           HN       VAL   5  -3.134  -1.369   5.421
   43    HA   VAL   5           HA       VAL   5  -2.384  -4.038   4.328
   44    HB   VAL   5           HB       VAL   5  -0.613  -1.598   4.495
   45   1HG1  VAL   5          HG11      VAL   5   0.813  -2.834   2.966
   46   2HG1  VAL   5          HG12      VAL   5  -0.378  -4.129   2.848
   47   3HG1  VAL   5          HG13      VAL   5   0.467  -3.845   4.369
   48   1HG2  VAL   5          HG21      VAL   5  -1.040  -1.645   1.907
   49   2HG2  VAL   5          HG22      VAL   5  -2.229  -0.879   2.957
   50   3HG2  VAL   5          HG23      VAL   5  -2.516  -2.501   2.343
   51    H    THR   6           HN       THR   6  -1.339  -5.420   5.630
   52    HA   THR   6           HA       THR   6  -0.303  -4.423   8.235
   53    HB   THR   6           HB       THR   6  -1.049  -6.400   9.293
   54    HG1  THR   6           HG1      THR   6  -0.807  -8.110   8.110
   55   1HG2  THR   6          HG21      THR   6  -3.458  -6.445   8.837
   56   2HG2  THR   6          HG22      THR   6  -3.194  -5.655   7.283
   57   3HG2  THR   6          HG23      THR   6  -2.865  -4.785   8.781
   58    H    ILE   7           HN       ILE   7   1.684  -4.899   8.714
   59    HA   ILE   7           HA       ILE   7   3.211  -6.747   6.974
   60    HB   ILE   7           HB       ILE   7   3.893  -4.168   8.367
   61   1HG1  ILE   7          HG12      ILE   7   4.304  -5.065   5.499
   62   2HG1  ILE   7          HG11      ILE   7   2.875  -4.197   6.058
   63   1HG2  ILE   7          HG21      ILE   7   5.718  -6.363   7.347
   64   2HG2  ILE   7          HG22      ILE   7   5.816  -5.471   8.864
   65   3HG2  ILE   7          HG23      ILE   7   6.256  -4.682   7.351
   66   1HD1  ILE   7          HD11      ILE   7   4.752  -2.771   5.049
   67   2HD1  ILE   7          HD12      ILE   7   5.665  -3.138   6.510
   68   3HD1  ILE   7          HD13      ILE   7   4.139  -2.265   6.622
   69    H    ALA   8           HN       ALA   8   4.219  -8.431   7.954
   70    HA   ALA   8           HA       ALA   8   3.674  -9.072  10.645
   71   1HB   ALA   8          HB1       ALA   8   4.124 -10.817   9.032
   72   2HB   ALA   8          HB2       ALA   8   5.374 -10.881  10.274
   73   3HB   ALA   8          HB3       ALA   8   5.726 -10.156   8.704
   74    H    LYS   9           HN       LYS   9   4.628  -8.630  12.382
   75    HA   LYS   9           HA       LYS   9   6.554  -6.630  12.661
   76   1HB   LYS   9          HB2       LYS   9   4.908  -7.213  14.438
   77   2HB   LYS   9          HB1       LYS   9   5.724  -8.748  14.681
   78   1HG   LYS   9          HG2       LYS   9   7.818  -7.440  15.289
   79   2HG   LYS   9          HG1       LYS   9   6.832  -5.979  15.267
   80   1HD   LYS   9          HD2       LYS   9   6.177  -8.414  16.947
   81   2HD   LYS   9          HD1       LYS   9   7.100  -7.038  17.546
   82   1HE   LYS   9          HE2       LYS   9   5.094  -5.601  16.731
   83   2HE   LYS   9          HE1       LYS   9   4.212  -7.127  16.683
   84   1HZ   LYS   9          HZ1       LYS   9   4.015  -5.919  18.813
   85   2HZ   LYS   9          HZ2       LYS   9   5.683  -6.128  19.057
   86   3HZ   LYS   9          HZ3       LYS   9   4.656  -7.480  18.982
   87    H    THR  10           HN       THR  10   6.965 -10.017  12.171
   88    HA   THR  10           HA       THR  10   9.574 -10.346  13.217
   89    HB   THR  10           HB       THR  10   9.673 -12.205  11.484
   90    HG1  THR  10           HG1      THR  10   7.967 -12.490  10.209
   91   1HG2  THR  10          HG21      THR  10   8.027 -13.566  12.680
   92   2HG2  THR  10          HG22      THR  10   7.244 -12.112  13.297
   93   3HG2  THR  10          HG23      THR  10   8.878 -12.521  13.816
   94    H    SER  11           HN       SER  11   8.432  -8.412  10.675
   95    HA   SER  11           HA       SER  11  11.154  -8.250   9.477
   96   1HB   SER  11          HB2       SER  11   9.937  -7.465   7.405
   97   2HB   SER  11          HB1       SER  11   9.706  -9.164   7.811
   98    HG   SER  11           HG       SER  11   7.840  -7.441   7.406
   99    HA   PRO  12           HA       PRO  12  10.062  -4.071  11.206
  100   1HB   PRO  12          HB2       PRO  12  12.737  -3.902  12.291
  101   2HB   PRO  12          HB1       PRO  12  11.220  -4.056  13.193
  102   1HG   PRO  12          HG2       PRO  12  13.197  -6.002  13.042
  103   2HG   PRO  12          HG1       PRO  12  11.516  -6.283  13.522
  104   1HD   PRO  12          HD2       PRO  12  12.849  -6.857  10.903
  105   2HD   PRO  12          HD1       PRO  12  11.515  -7.704  11.706
  106    H    LEU  13           HN       LEU  13  10.190  -2.294  10.207
  107    HA   LEU  13           HA       LEU  13  12.338  -1.970   8.195
  108   1HB   LEU  13          HB2       LEU  13   9.744  -0.430   8.264
  109   2HB   LEU  13          HB1       LEU  13  10.828  -0.704   6.900
  110    HG   LEU  13           HG       LEU  13   9.160  -2.835   8.277
  111   1HD1  LEU  13          HD11      LEU  13   8.898  -1.554   5.536
  112   2HD1  LEU  13          HD12      LEU  13   7.784  -1.351   6.889
  113   3HD1  LEU  13          HD13      LEU  13   7.953  -2.924   6.115
  114   1HD2  LEU  13          HD21      LEU  13  11.190  -3.845   7.452
  115   2HD2  LEU  13          HD22      LEU  13  11.093  -2.944   5.939
  116   3HD2  LEU  13          HD23      LEU  13   9.922  -4.214   6.286
  117    HA   PRO  14           HA       PRO  14  14.160   1.171  10.623
  118   1HB   PRO  14          HB2       PRO  14  14.312   3.243   8.590
  119   2HB   PRO  14          HB1       PRO  14  15.609   2.182   9.160
  120   1HG   PRO  14          HG2       PRO  14  13.990   1.982   6.729
  121   2HG   PRO  14          HG1       PRO  14  15.519   1.185   7.126
  122   1HD   PRO  14          HD2       PRO  14  13.076  -0.117   6.986
  123   2HD   PRO  14          HD1       PRO  14  14.466  -0.709   7.920
  124    H    ALA  15           HN       ALA  15  13.751   3.005  11.746
  125    HA   ALA  15           HA       ALA  15  11.114   3.609  12.386
  126   1HB   ALA  15          HB1       ALA  15  11.996   5.251  13.843
  127   2HB   ALA  15          HB2       ALA  15  13.453   5.435  12.865
  128   3HB   ALA  15          HB3       ALA  15  13.181   3.947  13.771
  129    H    GLY  16           HN       GLY  16  10.965   4.000   9.658
  130   1HA   GLY  16          HA2       GLY  16   9.904   6.635   9.445
  131   2HA   GLY  16          HA1       GLY  16  11.446   6.558   8.634
  132    H    ALA  17           HN       ALA  17  10.816   3.597   8.188
  133    HA   ALA  17           HA       ALA  17   9.941   3.917   5.491
  134   1HB   ALA  17          HB1       ALA  17  11.514   2.214   5.792
  135   2HB   ALA  17          HB2       ALA  17  10.001   1.327   5.604
  136   3HB   ALA  17          HB3       ALA  17  10.686   1.584   7.211
  137    H    ILE  18           HN       ILE  18   8.142   2.661   8.285
  138    HA   ILE  18           HA       ILE  18   5.990   1.684   6.774
  139    HB   ILE  18           HB       ILE  18   6.114   2.869   9.553
  140   1HG1  ILE  18          HG12      ILE  18   7.296   0.627   8.825
  141   2HG1  ILE  18          HG11      ILE  18   6.379   0.679  10.325
  142   1HG2  ILE  18          HG21      ILE  18   3.839   3.130   8.983
  143   2HG2  ILE  18          HG22      ILE  18   3.893   1.578   9.820
  144   3HG2  ILE  18          HG23      ILE  18   3.807   1.627   8.059
  145   1HD1  ILE  18          HD11      ILE  18   4.985  -0.127   7.787
  146   2HD1  ILE  18          HD12      ILE  18   4.613  -0.567   9.451
  147   3HD1  ILE  18          HD13      ILE  18   5.995  -1.297   8.635
  148    H    ASP  19           HN       ASP  19   6.498   4.869   8.285
  149    HA   ASP  19           HA       ASP  19   4.106   6.030   7.279
  150   1HB   ASP  19          HB2       ASP  19   5.289   8.230   7.731
  151   2HB   ASP  19          HB1       ASP  19   5.180   7.152   9.120
  152    H    ALA  20           HN       ALA  20   7.346   5.754   5.879
  153    HA   ALA  20           HA       ALA  20   6.746   7.471   3.714
  154   1HB   ALA  20          HB1       ALA  20   8.798   6.824   2.782
  155   2HB   ALA  20          HB2       ALA  20   8.707   5.202   3.471
  156   3HB   ALA  20          HB3       ALA  20   9.059   6.582   4.510
  157    H    LEU  21           HN       LEU  21   6.442   3.978   4.154
  158    HA   LEU  21           HA       LEU  21   5.741   3.275   1.556
  159   1HB   LEU  21          HB2       LEU  21   6.396   1.600   3.134
  160   2HB   LEU  21          HB1       LEU  21   5.131   2.074   4.261
  161    HG   LEU  21           HG       LEU  21   3.431   1.317   2.658
  162   1HD1  LEU  21          HD11      LEU  21   4.283  -0.122   0.724
  163   2HD1  LEU  21          HD12      LEU  21   5.862   0.604   1.009
  164   3HD1  LEU  21          HD13      LEU  21   4.501   1.615   0.533
  165   1HD2  LEU  21          HD21      LEU  21   3.758  -1.041   2.986
  166   2HD2  LEU  21          HD22      LEU  21   4.471  -0.218   4.373
  167   3HD2  LEU  21          HD23      LEU  21   5.506  -0.836   3.086
  168    H    ALA  22           HN       ALA  22   3.714   4.117   4.335
  169    HA   ALA  22           HA       ALA  22   1.191   3.843   3.049
  170   1HB   ALA  22          HB1       ALA  22   1.774   5.838   5.230
  171   2HB   ALA  22          HB2       ALA  22   1.683   4.110   5.569
  172   3HB   ALA  22          HB3       ALA  22   0.279   4.956   4.918
  173    H    GLY  23           HN       GLY  23   3.454   6.565   3.177
  174   1HA   GLY  23          HA2       GLY  23   1.654   8.404   1.902
  175   2HA   GLY  23          HA1       GLY  23   3.416   8.561   2.099
  176    H    GLU  24           HN       GLU  24   4.292   6.306   0.615
  177    HA   GLU  24           HA       GLU  24   3.975   7.326  -2.001
  178   1HB   GLU  24          HB2       GLU  24   5.971   5.972  -1.182
  179   2HB   GLU  24          HB1       GLU  24   4.953   4.537  -1.288
  180   1HG   GLU  24          HG2       GLU  24   6.177   4.680  -3.357
  181   2HG   GLU  24          HG1       GLU  24   4.513   5.142  -3.712
  182    H    LEU  25           HN       LEU  25   2.470   4.607  -0.328
  183    HA   LEU  25           HA       LEU  25   1.139   3.558  -2.576
  184   1HB   LEU  25          HB2       LEU  25   0.469   3.406   0.362
  185   2HB   LEU  25          HB1       LEU  25  -0.445   2.546  -0.873
  186    HG   LEU  25           HG       LEU  25   2.545   2.274  -0.484
  187   1HD1  LEU  25          HD11      LEU  25   0.260   0.542   0.500
  188   2HD1  LEU  25          HD12      LEU  25   1.412   1.431   1.492
  189   3HD1  LEU  25          HD13      LEU  25   1.955   0.057   0.532
  190   1HD2  LEU  25          HD21      LEU  25   0.532   1.046  -2.348
  191   2HD2  LEU  25          HD22      LEU  25   1.829   0.011  -1.753
  192   3HD2  LEU  25          HD23      LEU  25   2.215   1.481  -2.641
  193    H    SER  26           HN       SER  26   0.091   5.981  -0.209
  194    HA   SER  26           HA       SER  26  -2.578   6.219  -1.079
  195   1HB   SER  26          HB2       SER  26  -0.765   8.306   0.144
  196   2HB   SER  26          HB1       SER  26  -2.511   8.463  -0.028
  197    HG   SER  26           HG       SER  26  -1.247   7.379   1.952
  198    H    ARG  27           HN       ARG  27   0.345   8.021  -2.087
  199    HA   ARG  27           HA       ARG  27  -0.976   9.752  -3.890
  200   1HB   ARG  27          HB2       ARG  27   1.845   8.633  -3.879
  201   2HB   ARG  27          HB1       ARG  27   1.302   9.890  -4.986
  202   1HG   ARG  27          HG2       ARG  27   0.982  10.202  -1.997
  203   2HG   ARG  27          HG1       ARG  27   2.497  10.619  -2.791
  204   1HD   ARG  27          HD2       ARG  27   1.124  12.102  -4.353
  205   2HD   ARG  27          HD1       ARG  27  -0.233  11.835  -3.264
  206    HE   ARG  27           HE       ARG  27   1.753  12.686  -1.600
  207   1HH1  ARG  27          HH21      ARG  27  -0.556  14.001  -3.640
  208   2HH1  ARG  27          HH22      ARG  27   0.119  15.595  -3.693
  209   1HH2  ARG  27          HH11      ARG  27   3.044  14.698  -2.061
  210   2HH2  ARG  27          HH12      ARG  27   2.158  15.990  -2.800
  211    H    ARG  28           HN       ARG  28   0.377   6.501  -4.279
  212    HA   ARG  28           HA       ARG  28  -0.078   6.270  -7.054
  213   1HB   ARG  28          HB2       ARG  28   0.095   4.206  -4.862
  214   2HB   ARG  28          HB1       ARG  28  -0.076   3.788  -6.560
  215   1HG   ARG  28          HG2       ARG  28   2.121   5.641  -5.651
  216   2HG   ARG  28          HG1       ARG  28   2.324   3.896  -5.551
  217   1HD   ARG  28          HD2       ARG  28   1.725   3.788  -8.019
  218   2HD   ARG  28          HD1       ARG  28   1.820   5.544  -8.049
  219    HE   ARG  28           HE       ARG  28   4.203   4.693  -6.934
  220   1HH1  ARG  28          HH21      ARG  28   4.004   6.219  -9.542
  221   2HH1  ARG  28          HH22      ARG  28   4.738   5.118 -10.659
  222   1HH2  ARG  28          HH11      ARG  28   4.498   2.387  -8.539
  223   2HH2  ARG  28          HH12      ARG  28   5.015   2.951 -10.093
  224    H    ILE  29           HN       ILE  29  -2.121   5.586  -4.270
  225    HA   ILE  29           HA       ILE  29  -4.233   4.334  -5.674
  226    HB   ILE  29           HB       ILE  29  -4.124   5.749  -3.013
  227   1HG1  ILE  29          HG12      ILE  29  -2.869   3.495  -3.571
  228   2HG1  ILE  29          HG11      ILE  29  -3.774   3.636  -2.069
  229   1HG2  ILE  29          HG21      ILE  29  -6.415   5.880  -3.608
  230   2HG2  ILE  29          HG22      ILE  29  -6.294   4.440  -2.599
  231   3HG2  ILE  29          HG23      ILE  29  -6.399   4.281  -4.353
  232   1HD1  ILE  29          HD11      ILE  29  -5.103   2.543  -4.549
  233   2HD1  ILE  29          HD12      ILE  29  -5.542   2.301  -2.862
  234   3HD1  ILE  29          HD13      ILE  29  -4.116   1.505  -3.523
  235    H    GLN  30           HN       GLN  30  -3.785   7.689  -4.640
  236    HA   GLN  30           HA       GLN  30  -6.315   8.645  -5.587
  237   1HB   GLN  30          HB2       GLN  30  -3.703  10.042  -4.985
  238   2HB   GLN  30          HB1       GLN  30  -5.119  10.908  -5.574
  239   1HG   GLN  30          HG2       GLN  30  -6.415  10.259  -3.643
  240   2HG   GLN  30          HG1       GLN  30  -5.155   9.154  -3.094
  241   1HE2  GLN  30          HE21      GLN  30  -3.671  10.010  -1.632
  242   2HE2  GLN  30          HE22      GLN  30  -3.441  11.668  -1.352
  243    H    TYR  31           HN       TYR  31  -3.155   8.420  -7.248
  244    HA   TYR  31           HA       TYR  31  -4.093   9.796  -9.541
  245   1HB   TYR  31          HB2       TYR  31  -1.773   7.955  -8.981
  246   2HB   TYR  31          HB1       TYR  31  -2.135   8.435 -10.638
  247    HD1  TYR  31           HD1      TYR  31  -2.138  10.194  -7.301
  248    HD2  TYR  31           HD2      TYR  31  -0.770  10.188 -11.374
  249    HE1  TYR  31           HE1      TYR  31  -0.983  12.343  -6.912
  250    HE2  TYR  31           HE2      TYR  31   0.384  12.348 -10.982
  251    HH   TYR  31           HH       TYR  31  -0.225  14.308  -8.356
  252    H    ALA  32           HN       ALA  32  -4.127   6.420  -8.536
  253    HA   ALA  32           HA       ALA  32  -5.062   5.409 -11.022
  254   1HB   ALA  32          HB1       ALA  32  -5.000   4.275  -8.232
  255   2HB   ALA  32          HB2       ALA  32  -3.955   3.881  -9.597
  256   3HB   ALA  32          HB3       ALA  32  -5.644   3.371  -9.603
  257    H    PHE  33           HN       PHE  33  -6.643   6.466  -8.051
  258    HA   PHE  33           HA       PHE  33  -9.317   6.079  -9.308
  259   1HB   PHE  33          HB2       PHE  33  -8.534   5.971  -6.389
  260   2HB   PHE  33          HB1       PHE  33 -10.182   5.856  -7.007
  261    HD1  PHE  33           HD1      PHE  33 -10.904   3.905  -8.339
  262    HD2  PHE  33           HD2      PHE  33  -6.951   4.145  -6.675
  263    HE1  PHE  33           HE1      PHE  33 -10.578   1.483  -8.759
  264    HE2  PHE  33           HE2      PHE  33  -6.626   1.726  -7.098
  265    HZ   PHE  33           HZ       PHE  33  -8.440   0.394  -8.140
  266    HA   PRO  34           HA       PRO  34  -8.757  10.612  -8.658
  267   1HB   PRO  34          HB2       PRO  34 -10.334  11.054 -11.056
  268   2HB   PRO  34          HB1       PRO  34  -8.622  11.407 -10.775
  269   1HG   PRO  34          HG2       PRO  34  -9.614   9.419 -12.451
  270   2HG   PRO  34          HG1       PRO  34  -7.959   9.521 -11.833
  271   1HD   PRO  34          HD2       PRO  34 -10.177   7.738 -10.964
  272   2HD   PRO  34          HD1       PRO  34  -8.420   7.500 -10.863
  273    H    ASP  35           HN       ASP  35 -11.628   8.767  -9.433
  274    HA   ASP  35           HA       ASP  35 -13.438  10.843  -8.444
  275   1HB   ASP  35          HB2       ASP  35 -13.888   8.213  -9.838
  276   2HB   ASP  35          HB1       ASP  35 -15.207   9.201  -9.212
  277    H    ASN  36           HN       ASN  36 -11.833   8.188  -6.960
  278    HA   ASN  36           HA       ASN  36 -14.049   7.979  -4.986
  279   1HB   ASN  36          HB2       ASN  36 -13.681   5.952  -6.373
  280   2HB   ASN  36          HB1       ASN  36 -12.083   5.805  -5.642
  281   1HD2  ASN  36          HD21      ASN  36 -15.570   5.945  -4.789
  282   2HD2  ASN  36          HD22      ASN  36 -15.406   5.069  -3.346
  283    H    GLU  37           HN       GLU  37 -13.407   8.548  -2.806
  284    HA   GLU  37           HA       GLU  37 -10.843   9.450  -2.155
  285   1HB   GLU  37          HB2       GLU  37 -13.132   8.412  -0.516
  286   2HB   GLU  37          HB1       GLU  37 -11.703   9.204   0.145
  287   1HG   GLU  37          HG2       GLU  37 -13.466  10.458  -1.974
  288   2HG   GLU  37          HG1       GLU  37 -13.678  10.740  -0.248
  289    H    GLY  38           HN       GLY  38  -9.035   8.228  -1.760
  290   1HA   GLY  38          HA2       GLY  38  -9.335   5.346  -1.019
  291   2HA   GLY  38          HA1       GLY  38  -7.994   5.891  -1.776
  292    H    HIS  39           HN       HIS  39  -8.805   4.885   1.239
  293    HA   HIS  39           HA       HIS  39  -6.922   6.767   2.525
  294   1HB   HIS  39          HB2       HIS  39  -9.229   5.167   3.655
  295   2HB   HIS  39          HB1       HIS  39  -8.017   5.950   4.668
  296    HD1  HIS  39           HD1      HIS  39 -10.865   6.707   2.329
  297    HD2  HIS  39           HD2      HIS  39  -8.190   8.783   4.760
  298    HE1  HIS  39           HE1      HIS  39 -11.727   9.085   2.479
  299    H    VAL  40           HN       VAL  40  -4.972   5.778   3.043
  300    HA   VAL  40           HA       VAL  40  -4.875   2.836   3.081
  301    HB   VAL  40           HB       VAL  40  -2.724   4.836   2.403
  302   1HG1  VAL  40          HG11      VAL  40  -1.562   2.723   1.620
  303   2HG1  VAL  40          HG12      VAL  40  -2.809   1.811   2.470
  304   3HG1  VAL  40          HG13      VAL  40  -1.725   2.872   3.370
  305   1HG2  VAL  40          HG21      VAL  40  -4.129   2.844   0.602
  306   2HG2  VAL  40          HG22      VAL  40  -3.070   4.168   0.123
  307   3HG2  VAL  40          HG23      VAL  40  -4.679   4.514   0.765
  308    H    SER  41           HN       SER  41  -4.222   1.849   4.869
  309    HA   SER  41           HA       SER  41  -2.748   3.393   6.931
  310   1HB   SER  41          HB2       SER  41  -5.064   3.075   7.710
  311   2HB   SER  41          HB1       SER  41  -4.926   1.340   7.448
  312    HG   SER  41           HG       SER  41  -3.236   2.856   9.154
  313    H    VAL  42           HN       VAL  42  -1.067   2.406   7.933
  314    HA   VAL  42           HA       VAL  42  -0.512  -0.412   7.217
  315    HB   VAL  42           HB       VAL  42   1.560   1.810   7.264
  316   1HG1  VAL  42          HG11      VAL  42   1.720  -1.144   6.603
  317   2HG1  VAL  42          HG12      VAL  42   2.497  -0.316   7.953
  318   3HG1  VAL  42          HG13      VAL  42   3.021   0.009   6.300
  319   1HG2  VAL  42          HG21      VAL  42   1.593   1.782   4.910
  320   2HG2  VAL  42          HG22      VAL  42  -0.128   1.709   5.277
  321   3HG2  VAL  42          HG23      VAL  42   0.740   0.246   4.817
  322    H    ARG  43           HN       ARG  43  -0.042  -1.657   8.887
  323    HA   ARG  43           HA       ARG  43   1.163  -0.493  11.281
  324   1HB   ARG  43          HB2       ARG  43  -0.564  -1.379  12.779
  325   2HB   ARG  43          HB1       ARG  43  -1.258  -0.219  11.643
  326   1HG   ARG  43          HG2       ARG  43  -1.893  -2.172  10.172
  327   2HG   ARG  43          HG1       ARG  43  -1.392  -3.241  11.482
  328   1HD   ARG  43          HD2       ARG  43  -3.011  -2.138  12.991
  329   2HD   ARG  43          HD1       ARG  43  -3.528  -1.097  11.668
  330    HE   ARG  43           HE       ARG  43  -4.175  -3.916  12.021
  331   1HH1  ARG  43          HH11      ARG  43  -4.072  -1.141   9.951
  332   2HH1  ARG  43          HH12      ARG  43  -5.217  -1.777   8.817
  333   1HH2  ARG  43          HH21      ARG  43  -5.648  -4.765  10.521
  334   2HH2  ARG  43          HH22      ARG  43  -6.108  -3.827   9.140
  335    H    TYR  44           HN       TYR  44   1.837  -2.142  12.847
  336    HA   TYR  44           HA       TYR  44   2.775  -4.579  11.514
  337   1HB   TYR  44          HB2       TYR  44   3.167  -3.500  14.328
  338   2HB   TYR  44          HB1       TYR  44   3.880  -4.991  13.729
  339    HD1  TYR  44           HD1      TYR  44   5.123  -4.688  11.342
  340    HD2  TYR  44           HD2      TYR  44   4.523  -1.598  14.269
  341    HE1  TYR  44           HE1      TYR  44   7.039  -3.422  10.402
  342    HE2  TYR  44           HE2      TYR  44   6.433  -0.333  13.327
  343    HH   TYR  44           HH       TYR  44   8.015  -0.276  11.782
  344    H    ALA  45           HN       ALA  45   2.070  -6.584  11.815
  345    HA   ALA  45           HA       ALA  45   0.017  -7.127  13.853
  346   1HB   ALA  45          HB1       ALA  45  -1.080  -6.540  11.637
  347   2HB   ALA  45          HB2       ALA  45  -1.464  -8.143  12.261
  348   3HB   ALA  45          HB3       ALA  45  -0.287  -7.963  10.959
  349    H    ALA  46           HN       ALA  46  -0.334  -9.577  14.003
  350    HA   ALA  46           HA       ALA  46   2.179 -10.831  14.292
  351   1HB   ALA  46          HB1       ALA  46   1.024 -12.728  15.048
  352   2HB   ALA  46          HB2       ALA  46  -0.342 -12.448  13.968
  353   3HB   ALA  46          HB3       ALA  46  -0.124 -11.436  15.397
  354    H    ALA  47           HN       ALA  47   0.026 -10.631  11.543
  355    HA   ALA  47           HA       ALA  47   2.044 -12.135   9.993
  356   1HB   ALA  47          HB1       ALA  47  -0.941 -12.626   9.914
  357   2HB   ALA  47          HB2       ALA  47   0.295 -13.746  10.488
  358   3HB   ALA  47          HB3       ALA  47   0.224 -13.310   8.781
  359    H    ASN  48           HN       ASN  48   2.154 -11.662   7.773
  360    HA   ASN  48           HA       ASN  48   1.454  -8.962   7.037
  361   1HB   ASN  48          HB2       ASN  48   3.454 -10.053   6.119
  362   2HB   ASN  48          HB1       ASN  48   2.444 -11.276   5.348
  363   1HD2  ASN  48          HD21      ASN  48   3.095  -7.741   5.362
  364   2HD2  ASN  48          HD22      ASN  48   2.552  -7.485   3.775
  365    H    ASN  49           HN       ASN  49  -0.460  -8.309   6.180
  366    HA   ASN  49           HA       ASN  49  -2.088 -10.150   4.608
  367   1HB   ASN  49          HB2       ASN  49  -2.878 -10.590   6.882
  368   2HB   ASN  49          HB1       ASN  49  -3.149  -8.868   7.136
  369   1HD2  ASN  49          HD21      ASN  49  -4.207 -11.612   5.076
  370   2HD2  ASN  49          HD22      ASN  49  -5.734 -10.954   4.731
  371    H    LEU  50           HN       LEU  50  -3.575  -9.098   3.274
  372    HA   LEU  50           HA       LEU  50  -3.474  -6.139   3.233
  373   1HB   LEU  50          HB2       LEU  50  -2.084  -7.118   1.415
  374   2HB   LEU  50          HB1       LEU  50  -3.469  -8.062   0.879
  375    HG   LEU  50           HG       LEU  50  -4.721  -5.941   0.462
  376   1HD1  LEU  50          HD11      LEU  50  -3.167  -3.865   0.300
  377   2HD1  LEU  50          HD12      LEU  50  -2.146  -4.740   1.440
  378   3HD1  LEU  50          HD13      LEU  50  -3.808  -4.333   1.871
  379   1HD2  LEU  50          HD21      LEU  50  -2.050  -6.323  -0.924
  380   2HD2  LEU  50          HD22      LEU  50  -3.272  -5.193  -1.499
  381   3HD2  LEU  50          HD23      LEU  50  -3.626  -6.919  -1.447
  382    H    SER  51           HN       SER  51  -5.547  -5.349   3.520
  383    HA   SER  51           HA       SER  51  -7.814  -7.074   2.672
  384   1HB   SER  51          HB2       SER  51  -7.605  -5.222   5.055
  385   2HB   SER  51          HB1       SER  51  -9.075  -6.043   4.536
  386    HG   SER  51           HG       SER  51  -6.689  -7.106   5.591
  387    H    VAL  52           HN       VAL  52  -9.187  -6.120   1.252
  388    HA   VAL  52           HA       VAL  52  -9.128  -3.186   0.982
  389    HB   VAL  52           HB       VAL  52  -9.413  -5.271  -1.201
  390   1HG1  VAL  52          HG11      VAL  52  -9.365  -3.189  -2.681
  391   2HG1  VAL  52          HG12      VAL  52  -9.684  -2.259  -1.218
  392   3HG1  VAL  52          HG13      VAL  52 -10.855  -3.455  -1.775
  393   1HG2  VAL  52          HG21      VAL  52  -7.310  -4.401  -2.031
  394   2HG2  VAL  52          HG22      VAL  52  -7.094  -4.829  -0.333
  395   3HG2  VAL  52          HG23      VAL  52  -7.295  -3.140  -0.798
  396    H    ILE  53           HN       ILE  53 -11.088  -2.272   1.380
  397    HA   ILE  53           HA       ILE  53 -13.507  -3.977   1.118
  398    HB   ILE  53           HB       ILE  53 -12.969  -1.749   3.095
  399   1HG1  ILE  53          HG12      ILE  53 -11.947  -4.215   3.353
  400   2HG1  ILE  53          HG11      ILE  53 -12.603  -3.352   4.736
  401   1HG2  ILE  53          HG21      ILE  53 -15.195  -2.594   4.041
  402   2HG2  ILE  53          HG22      ILE  53 -15.414  -3.421   2.499
  403   3HG2  ILE  53          HG23      ILE  53 -15.275  -1.663   2.545
  404   1HD1  ILE  53          HD11      ILE  53 -14.394  -5.139   3.093
  405   2HD1  ILE  53          HD12      ILE  53 -14.569  -4.635   4.771
  406   3HD1  ILE  53          HD13      ILE  53 -13.344  -5.823   4.332
  407    H    GLY  54           HN       GLY  54 -14.975  -3.292  -0.293
  408   1HA   GLY  54          HA2       GLY  54 -16.429  -1.662  -1.229
  409   2HA   GLY  54          HA1       GLY  54 -15.261  -0.413  -0.807
  410    H    ALA  55           HN       ALA  55 -13.921  -3.223  -2.352
  411    HA   ALA  55           HA       ALA  55 -13.835  -1.724  -4.916
  412   1HB   ALA  55          HB1       ALA  55 -11.580  -3.546  -4.145
  413   2HB   ALA  55          HB2       ALA  55 -11.678  -1.962  -3.382
  414   3HB   ALA  55          HB3       ALA  55 -11.557  -2.085  -5.136
  415    H    THR  56           HN       THR  56 -13.355  -2.951  -6.799
  416    HA   THR  56           HA       THR  56 -14.844  -5.496  -7.049
  417    HB   THR  56           HB       THR  56 -14.693  -4.972  -9.399
  418    HG1  THR  56           HG1      THR  56 -13.699  -2.555  -9.416
  419   1HG2  THR  56          HG21      THR  56 -16.431  -3.842  -7.955
  420   2HG2  THR  56          HG22      THR  56 -16.045  -2.979  -9.443
  421   3HG2  THR  56          HG23      THR  56 -15.377  -2.430  -7.906
  422    H    LYS  57           HN       LYS  57 -13.943  -7.214  -8.173
  423    HA   LYS  57           HA       LYS  57 -11.455  -8.029  -7.265
  424   1HB   LYS  57          HB2       LYS  57 -13.152  -9.632  -8.029
  425   2HB   LYS  57          HB1       LYS  57 -12.977  -9.058  -9.687
  426   1HG   LYS  57          HG2       LYS  57 -10.623  -9.835  -9.707
  427   2HG   LYS  57          HG1       LYS  57 -10.794 -10.415  -8.049
  428   1HD   LYS  57          HD2       LYS  57 -12.455 -12.023  -8.702
  429   2HD   LYS  57          HD1       LYS  57 -12.558 -11.338 -10.325
  430   1HE   LYS  57          HE2       LYS  57 -10.259 -12.002 -10.796
  431   2HE   LYS  57          HE1       LYS  57 -10.062 -12.591  -9.146
  432   1HZ   LYS  57          HZ1       LYS  57 -10.906 -14.060 -11.270
  433   2HZ   LYS  57          HZ2       LYS  57 -12.354 -13.698 -10.457
  434   3HZ   LYS  57          HZ3       LYS  57 -11.090 -14.484  -9.638
  435    H    GLU  58           HN       GLU  58 -12.218  -6.546 -10.473
  436    HA   GLU  58           HA       GLU  58  -9.610  -6.911 -11.530
  437   1HB   GLU  58          HB2       GLU  58 -11.647  -6.358 -12.879
  438   2HB   GLU  58          HB1       GLU  58 -11.656  -4.757 -12.141
  439   1HG   GLU  58          HG2       GLU  58  -9.407  -4.318 -13.058
  440   2HG   GLU  58          HG1       GLU  58  -9.398  -5.919 -13.796
  441    H    ASP  59           HN       ASP  59 -11.117  -4.388  -9.575
  442    HA   ASP  59           HA       ASP  59  -9.011  -2.513  -9.748
  443   1HB   ASP  59          HB2       ASP  59 -11.126  -3.003  -7.640
  444   2HB   ASP  59          HB1       ASP  59  -9.995  -1.653  -7.578
  445    H    LYS  60           HN       LYS  60  -9.789  -5.117  -7.510
  446    HA   LYS  60           HA       LYS  60  -7.604  -4.733  -5.740
  447   1HB   LYS  60          HB2       LYS  60  -9.250  -7.197  -6.388
  448   2HB   LYS  60          HB1       LYS  60  -8.027  -7.149  -5.116
  449   1HG   LYS  60          HG2       LYS  60  -9.229  -5.301  -4.022
  450   2HG   LYS  60          HG1       LYS  60 -10.454  -5.343  -5.289
  451   1HD   LYS  60          HD2       LYS  60 -10.875  -7.757  -4.680
  452   2HD   LYS  60          HD1       LYS  60  -9.809  -7.527  -3.294
  453   1HE   LYS  60          HE2       LYS  60 -11.270  -5.648  -2.536
  454   2HE   LYS  60          HE1       LYS  60 -12.368  -6.005  -3.867
  455   1HZ   LYS  60          HZ1       LYS  60 -12.070  -8.418  -2.754
  456   2HZ   LYS  60          HZ2       LYS  60 -13.330  -7.343  -2.372
  457   3HZ   LYS  60          HZ3       LYS  60 -11.951  -7.426  -1.384
  458    H    GLN  61           HN       GLN  61  -7.808  -6.655  -8.748
  459    HA   GLN  61           HA       GLN  61  -5.236  -7.829  -8.383
  460   1HB   GLN  61          HB2       GLN  61  -6.900  -7.262 -10.854
  461   2HB   GLN  61          HB1       GLN  61  -5.365  -8.132 -10.899
  462   1HG   GLN  61          HG2       GLN  61  -6.253  -9.819  -9.350
  463   2HG   GLN  61          HG1       GLN  61  -7.777  -8.939  -9.245
  464   1HE2  GLN  61          HE21      GLN  61  -7.427 -11.696 -10.254
  465   2HE2  GLN  61          HE22      GLN  61  -7.952 -11.682 -11.868
  466    H    ARG  62           HN       ARG  62  -6.386  -4.830  -9.981
  467    HA   ARG  62           HA       ARG  62  -3.883  -4.065 -10.976
  468   1HB   ARG  62          HB2       ARG  62  -5.956  -2.963 -11.718
  469   2HB   ARG  62          HB1       ARG  62  -6.204  -2.309 -10.100
  470   1HG   ARG  62          HG2       ARG  62  -4.225  -0.944 -10.267
  471   2HG   ARG  62          HG1       ARG  62  -3.740  -1.721 -11.773
  472   1HD   ARG  62          HD2       ARG  62  -5.684  -0.810 -12.919
  473   2HD   ARG  62          HD1       ARG  62  -6.291  -0.127 -11.412
  474    HE   ARG  62           HE       ARG  62  -4.719   1.593 -11.601
  475   1HH1  ARG  62          HH21      ARG  62  -5.146   0.828 -14.624
  476   2HH1  ARG  62          HH22      ARG  62  -3.514   0.943 -15.191
  477   1HH2  ARG  62          HH11      ARG  62  -2.134   0.979 -12.010
  478   2HH2  ARG  62          HH12      ARG  62  -1.808   1.028 -13.711
  479    H    ILE  63           HN       ILE  63  -5.445  -3.320  -7.890
  480    HA   ILE  63           HA       ILE  63  -3.364  -1.693  -6.907
  481    HB   ILE  63           HB       ILE  63  -5.375  -3.351  -5.420
  482   1HG1  ILE  63          HG12      ILE  63  -5.187  -0.347  -5.678
  483   2HG1  ILE  63          HG11      ILE  63  -6.062  -1.326  -6.856
  484   1HG2  ILE  63          HG21      ILE  63  -3.208  -1.498  -4.434
  485   2HG2  ILE  63          HG22      ILE  63  -3.628  -3.104  -3.841
  486   3HG2  ILE  63          HG23      ILE  63  -4.685  -1.735  -3.500
  487   1HD1  ILE  63          HD11      ILE  63  -7.541  -0.440  -5.050
  488   2HD1  ILE  63          HD12      ILE  63  -6.598  -1.353  -3.873
  489   3HD1  ILE  63          HD13      ILE  63  -7.520  -2.203  -5.113
  490    H    SER  64           HN       SER  64  -3.782  -5.189  -6.694
  491    HA   SER  64           HA       SER  64  -1.505  -5.649  -5.057
  492   1HB   SER  64          HB2       SER  64  -1.551  -7.927  -5.908
  493   2HB   SER  64          HB1       SER  64  -3.212  -7.401  -5.652
  494    HG   SER  64           HG       SER  64  -1.756  -7.645  -8.063
  495    H    GLU  65           HN       GLU  65  -1.921  -5.347  -8.633
  496    HA   GLU  65           HA       GLU  65   0.771  -5.819  -9.260
  497   1HB   GLU  65          HB2       GLU  65  -1.364  -4.215 -10.689
  498   2HB   GLU  65          HB1       GLU  65   0.242  -4.502 -11.362
  499   1HG   GLU  65          HG2       GLU  65  -0.099  -6.902 -11.306
  500   2HG   GLU  65          HG1       GLU  65  -1.636  -6.706 -10.465
  501    H    ILE  66           HN       ILE  66  -0.947  -2.819  -8.451
  502    HA   ILE  66           HA       ILE  66   1.202  -1.062  -8.876
  503    HB   ILE  66           HB       ILE  66  -1.162  -0.901  -6.998
  504   1HG1  ILE  66          HG12      ILE  66  -0.510   0.572  -9.570
  505   2HG1  ILE  66          HG11      ILE  66  -1.512  -0.875  -9.498
  506   1HG2  ILE  66          HG21      ILE  66   0.492   0.521  -6.002
  507   2HG2  ILE  66          HG22      ILE  66  -0.553   1.575  -6.948
  508   3HG2  ILE  66          HG23      ILE  66   1.026   1.112  -7.576
  509   1HD1  ILE  66          HD11      ILE  66  -2.169   1.522  -7.787
  510   2HD1  ILE  66          HD12      ILE  66  -3.231   0.222  -8.320
  511   3HD1  ILE  66          HD13      ILE  66  -2.692   1.446  -9.468
  512    H    LEU  67           HN       LEU  67   0.203  -2.811  -5.961
  513    HA   LEU  67           HA       LEU  67   2.200  -1.788  -4.257
  514   1HB   LEU  67          HB2       LEU  67   0.379  -3.003  -3.246
  515   2HB   LEU  67          HB1       LEU  67   0.680  -4.413  -4.253
  516    HG   LEU  67           HG       LEU  67   2.917  -4.687  -3.094
  517   1HD1  LEU  67          HD11      LEU  67   1.838  -2.326  -1.550
  518   2HD1  LEU  67          HD12      LEU  67   3.468  -2.593  -2.174
  519   3HD1  LEU  67          HD13      LEU  67   2.911  -3.484  -0.764
  520   1HD2  LEU  67          HD21      LEU  67   1.958  -5.695  -1.111
  521   2HD2  LEU  67          HD22      LEU  67   0.821  -5.911  -2.444
  522   3HD2  LEU  67          HD23      LEU  67   0.528  -4.668  -1.226
  523    H    GLN  68           HN       GLN  68   2.159  -4.536  -6.470
  524    HA   GLN  68           HA       GLN  68   4.743  -5.489  -5.793
  525   1HB   GLN  68          HB2       GLN  68   3.116  -5.701  -8.335
  526   2HB   GLN  68          HB1       GLN  68   4.682  -6.484  -8.123
  527   1HG   GLN  68          HG2       GLN  68   3.833  -7.708  -6.173
  528   2HG   GLN  68          HG1       GLN  68   2.277  -6.898  -6.321
  529   1HE2  GLN  68          HE21      GLN  68   2.584  -9.777  -6.492
  530   2HE2  GLN  68          HE22      GLN  68   2.157 -10.244  -8.066
  531    H    GLU  69           HN       GLU  69   3.726  -3.230  -8.422
  532    HA   GLU  69           HA       GLU  69   6.327  -2.790  -9.333
  533   1HB   GLU  69          HB2       GLU  69   3.867  -1.051  -9.519
  534   2HB   GLU  69          HB1       GLU  69   5.356  -0.772 -10.426
  535   1HG   GLU  69          HG2       GLU  69   5.175  -3.022 -11.421
  536   2HG   GLU  69          HG1       GLU  69   3.689  -3.304 -10.520
  537    H    THR  70           HN       THR  70   4.449  -0.851  -6.957
  538    HA   THR  70           HA       THR  70   6.382   1.171  -6.638
  539    HB   THR  70           HB       THR  70   4.477   0.094  -4.585
  540    HG1  THR  70           HG1      THR  70   3.666   2.371  -5.496
  541   1HG2  THR  70          HG21      THR  70   6.211   2.549  -4.719
  542   2HG2  THR  70          HG22      THR  70   6.030   1.400  -3.392
  543   3HG2  THR  70          HG23      THR  70   4.732   2.535  -3.758
  544    H    TRP  71           HN       TRP  71   5.817  -1.815  -4.932
  545    HA   TRP  71           HA       TRP  71   7.879  -1.704  -3.097
  546   1HB   TRP  71          HB2       TRP  71   5.945  -3.224  -3.047
  547   2HB   TRP  71          HB1       TRP  71   6.608  -4.086  -4.424
  548    HD1  TRP  71           HD1      TRP  71   7.587  -6.281  -3.639
  549    HE1  TRP  71           HE1      TRP  71   8.993  -7.088  -1.640
  550    HE3  TRP  71           HE3      TRP  71   7.818  -1.959  -0.880
  551    HZ2  TRP  71           HZ2      TRP  71  10.054  -6.062   0.800
  552    HZ3  TRP  71           HZ3      TRP  71   9.021  -1.923   1.274
  553    HH2  TRP  71           HH2      TRP  71  10.134  -3.966   2.123
  554    H    GLU  72           HN       GLU  72   7.875  -2.887  -6.402
  555    HA   GLU  72           HA       GLU  72  10.584  -3.795  -6.289
  556   1HB   GLU  72          HB2       GLU  72   8.692  -3.371  -8.603
  557   2HB   GLU  72          HB1       GLU  72  10.356  -3.909  -8.830
  558   1HG   GLU  72          HG2       GLU  72   9.956  -5.842  -7.377
  559   2HG   GLU  72          HG1       GLU  72   8.306  -5.304  -7.084
  560    H    SER  73           HN       SER  73   9.236  -0.628  -6.719
  561    HA   SER  73           HA       SER  73  11.777   0.289  -7.944
  562   1HB   SER  73          HB2       SER  73  10.524   2.366  -8.478
  563   2HB   SER  73          HB1       SER  73   9.780   0.936  -9.190
  564    HG   SER  73           HG       SER  73   8.088   1.252  -7.983
  565    H    ALA  74           HN       ALA  74  11.148  -0.341  -5.024
  566    HA   ALA  74           HA       ALA  74  10.909   1.808  -3.410
  567   1HB   ALA  74          HB1       ALA  74  10.929  -0.387  -2.534
  568   2HB   ALA  74          HB2       ALA  74  12.286   0.465  -1.793
  569   3HB   ALA  74          HB3       ALA  74  12.571  -0.676  -3.108
  570    H    ASP  75           HN       ASP  75  13.928   0.900  -5.056
  571    HA   ASP  75           HA       ASP  75  15.626   2.539  -3.468
  572   1HB   ASP  75          HB2       ASP  75  15.913   1.401  -6.245
  573   2HB   ASP  75          HB1       ASP  75  17.194   2.305  -5.439
  574    H    ASP  76           HN       ASP  76  13.430   3.360  -6.042
  575    HA   ASP  76           HA       ASP  76  14.827   5.880  -6.653
  576   1HB   ASP  76          HB2       ASP  76  12.370   4.545  -7.788
  577   2HB   ASP  76          HB1       ASP  76  12.921   6.146  -8.276
  578    H    TRP  77           HN       TRP  77  11.648   4.894  -5.322
  579    HA   TRP  77           HA       TRP  77  11.082   7.716  -4.727
  580   1HB   TRP  77          HB2       TRP  77   8.876   7.095  -4.277
  581   2HB   TRP  77          HB1       TRP  77   9.365   6.182  -5.687
  582    HD1  TRP  77           HD1      TRP  77   9.258   3.564  -5.534
  583    HE1  TRP  77           HE1      TRP  77   8.606   1.911  -3.691
  584    HE3  TRP  77           HE3      TRP  77   9.006   6.728  -1.423
  585    HZ2  TRP  77           HZ2      TRP  77   8.059   1.883  -0.910
  586    HZ3  TRP  77           HZ3      TRP  77   8.416   5.808   0.757
  587    HH2  TRP  77           HH2      TRP  77   7.949   3.413   1.031
  588    H    PHE  78           HN       PHE  78  12.317   4.992  -2.933
  589    HA   PHE  78           HA       PHE  78  11.497   6.220  -0.382
  590   1HB   PHE  78          HB2       PHE  78  11.478   3.768  -0.475
  591   2HB   PHE  78          HB1       PHE  78  13.189   3.769  -0.884
  592    HD1  PHE  78           HD1      PHE  78  10.920   5.315   1.692
  593    HD2  PHE  78           HD2      PHE  78  14.729   3.462   0.884
  594    HE1  PHE  78           HE1      PHE  78  11.524   5.484   4.085
  595    HE2  PHE  78           HE2      PHE  78  15.311   3.632   3.279
  596    HZ   PHE  78           HZ       PHE  78  13.714   4.642   4.880
  597    H    VAL  79           HN       VAL  79  12.653   7.560   0.732
  598    HA   VAL  79           HA       VAL  79  15.523   7.917   0.097
  599    HB   VAL  79           HB       VAL  79  13.824  10.166   1.163
  600   1HG1  VAL  79          HG11      VAL  79  15.970  10.220  -0.964
  601   2HG1  VAL  79          HG12      VAL  79  16.366  10.237   0.755
  602   3HG1  VAL  79          HG13      VAL  79  15.408  11.543   0.057
  603   1HG2  VAL  79          HG21      VAL  79  12.434   9.325  -0.653
  604   2HG2  VAL  79          HG22      VAL  79  13.842   9.183  -1.711
  605   3HG2  VAL  79          HG23      VAL  79  13.269  10.775  -1.218
  606    H    SER  80           HN       SER  80  16.899   8.399   2.006
  607    HA   SER  80           HA       SER  80  15.547   8.202   4.628
  608   1HB   SER  80          HB2       SER  80  16.377   5.910   3.927
  609   2HB   SER  80          HB1       SER  80  18.011   6.573   3.940
  610    HG   SER  80           HG       SER  80  16.282   5.997   6.030
  611    H    GLU  81           HN       GLU  81  16.415   9.474   6.157
  612    HA   GLU  81           HA       GLU  81  18.026  11.637   5.523
  613   1HB   GLU  81          HB2       GLU  81  17.641  10.278   8.201
  614   2HB   GLU  81          HB1       GLU  81  18.402  11.855   7.985
  615   1HG   GLU  81          HG2       GLU  81  16.343  12.710   6.929
  616   2HG   GLU  81          HG1       GLU  81  15.579  11.136   7.144
  Start of MODEL    3
    1   1H    MET   1          HT1       MET   1 -14.611   4.155   0.208
    2   2H    MET   1          HT2       MET   1 -14.262   4.325  -1.446
    3   3H    MET   1          HT3       MET   1 -13.220   4.992  -0.282
    4    HA   MET   1           HA       MET   1 -13.745   2.109  -0.234
    5   1HB   MET   1          HB2       MET   1 -12.093   3.638  -2.243
    6   2HB   MET   1          HB1       MET   1 -11.585   2.025  -1.745
    7   1HG   MET   1          HG2       MET   1 -13.564   1.024  -2.574
    8   2HG   MET   1          HG1       MET   1 -14.399   2.573  -2.695
    9   1HE   MET   1          HE1       MET   1 -10.857   1.177  -5.262
   10   2HE   MET   1          HE2       MET   1 -11.323   0.623  -3.656
   11   3HE   MET   1          HE3       MET   1 -10.561   2.201  -3.851
   12    H    ARG   2           HN       ARG   2 -12.264   1.109   1.153
   13    HA   ARG   2           HA       ARG   2 -10.198   2.860   2.356
   14   1HB   ARG   2          HB2       ARG   2 -12.068   2.528   3.934
   15   2HB   ARG   2          HB1       ARG   2 -11.883   0.781   3.786
   16   1HG   ARG   2          HG2       ARG   2  -9.593   0.929   4.685
   17   2HG   ARG   2          HG1       ARG   2  -9.745   2.682   4.801
   18   1HD   ARG   2          HD2       ARG   2 -11.639   2.400   6.368
   19   2HD   ARG   2          HD1       ARG   2 -11.451   0.651   6.268
   20    HE   ARG   2           HE       ARG   2  -8.971   1.564   7.024
   21   1HH1  ARG   2          HH21      ARG   2 -12.187   1.402   8.246
   22   2HH1  ARG   2          HH22      ARG   2 -11.742   1.780   9.877
   23   1HH2  ARG   2          HH11      ARG   2  -8.395   2.286   9.128
   24   2HH2  ARG   2          HH12      ARG   2  -9.596   2.280  10.376
   25    H    ILE   3           HN       ILE   3  -8.214   2.047   2.396
   26    HA   ILE   3           HA       ILE   3  -7.789  -0.811   1.641
   27    HB   ILE   3           HB       ILE   3  -6.118   1.644   1.048
   28   1HG1  ILE   3          HG12      ILE   3  -6.591   0.430  -1.358
   29   2HG1  ILE   3          HG11      ILE   3  -8.063  -0.032  -0.515
   30   1HG2  ILE   3          HG21      ILE   3  -5.583  -1.309   0.719
   31   2HG2  ILE   3          HG22      ILE   3  -4.561  -0.085   1.473
   32   3HG2  ILE   3          HG23      ILE   3  -4.769  -0.104  -0.279
   33   1HD1  ILE   3          HD11      ILE   3  -8.250   2.118  -1.799
   34   2HD1  ILE   3          HD12      ILE   3  -7.054   2.823  -0.715
   35   3HD1  ILE   3          HD13      ILE   3  -8.613   2.291  -0.085
   36    H    GLU   4           HN       GLU   4  -6.790  -2.005   3.190
   37    HA   GLU   4           HA       GLU   4  -5.088  -0.602   5.185
   38   1HB   GLU   4          HB2       GLU   4  -6.963  -2.933   5.684
   39   2HB   GLU   4          HB1       GLU   4  -5.864  -2.236   6.875
   40   1HG   GLU   4          HG2       GLU   4  -6.988  -0.053   6.644
   41   2HG   GLU   4          HG1       GLU   4  -8.090  -0.743   5.454
   42    H    VAL   5           HN       VAL   5  -3.101  -1.303   5.417
   43    HA   VAL   5           HA       VAL   5  -2.362  -3.968   4.307
   44    HB   VAL   5           HB       VAL   5  -0.595  -1.518   4.457
   45   1HG1  VAL   5          HG11      VAL   5   0.617  -3.632   4.408
   46   2HG1  VAL   5          HG12      VAL   5   0.775  -2.838   2.841
   47   3HG1  VAL   5          HG13      VAL   5  -0.345  -4.186   3.038
   48   1HG2  VAL   5          HG21      VAL   5  -2.406  -2.538   2.267
   49   2HG2  VAL   5          HG22      VAL   5  -0.968  -1.598   1.884
   50   3HG2  VAL   5          HG23      VAL   5  -2.242  -0.895   2.878
   51    H    THR   6           HN       THR   6  -1.318  -5.361   5.608
   52    HA   THR   6           HA       THR   6  -0.252  -4.350   8.195
   53    HB   THR   6           HB       THR   6  -0.997  -6.297   9.293
   54    HG1  THR   6           HG1      THR   6  -1.799  -7.372   6.806
   55   1HG2  THR   6          HG21      THR   6  -3.255  -5.859   7.342
   56   2HG2  THR   6          HG22      THR   6  -2.799  -4.615   8.507
   57   3HG2  THR   6          HG23      THR   6  -3.346  -6.193   9.070
   58    H    ILE   7           HN       ILE   7   1.736  -4.859   8.674
   59    HA   ILE   7           HA       ILE   7   3.241  -6.726   6.930
   60    HB   ILE   7           HB       ILE   7   3.944  -4.130   8.277
   61   1HG1  ILE   7          HG12      ILE   7   4.398  -5.084   5.433
   62   2HG1  ILE   7          HG11      ILE   7   2.942  -4.231   5.944
   63   1HG2  ILE   7          HG21      ILE   7   6.302  -4.652   7.326
   64   2HG2  ILE   7          HG22      ILE   7   5.765  -6.332   7.252
   65   3HG2  ILE   7          HG23      ILE   7   5.837  -5.496   8.803
   66   1HD1  ILE   7          HD11      ILE   7   5.668  -3.079   6.510
   67   2HD1  ILE   7          HD12      ILE   7   4.115  -2.248   6.409
   68   3HD1  ILE   7          HD13      ILE   7   4.897  -2.839   4.943
   69    H    ALA   8           HN       ALA   8   4.266  -8.398   7.924
   70    HA   ALA   8           HA       ALA   8   3.724  -9.029  10.619
   71   1HB   ALA   8          HB1       ALA   8   5.720 -10.113   8.631
   72   2HB   ALA   8          HB2       ALA   8   4.159 -10.804   9.077
   73   3HB   ALA   8          HB3       ALA   8   5.489 -10.808  10.236
   74    H    LYS   9           HN       LYS   9   4.678  -8.582  12.365
   75    HA   LYS   9           HA       LYS   9   6.608  -6.588  12.633
   76   1HB   LYS   9          HB2       LYS   9   4.997  -7.121  14.434
   77   2HB   LYS   9          HB1       LYS   9   5.765  -8.683  14.668
   78   1HG   LYS   9          HG2       LYS   9   7.867  -7.559  15.347
   79   2HG   LYS   9          HG1       LYS   9   7.103  -5.984  15.119
   80   1HD   LYS   9          HD2       LYS   9   5.517  -6.409  16.873
   81   2HD   LYS   9          HD1       LYS   9   6.023  -8.095  16.999
   82   1HE   LYS   9          HE2       LYS   9   7.941  -5.803  17.457
   83   2HE   LYS   9          HE1       LYS   9   6.974  -6.493  18.760
   84   1HZ   LYS   9          HZ1       LYS   9   8.131  -8.598  17.341
   85   2HZ   LYS   9          HZ2       LYS   9   8.448  -8.113  18.938
   86   3HZ   LYS   9          HZ3       LYS   9   9.359  -7.472  17.655
   87    H    THR  10           HN       THR  10   7.006  -9.984  12.164
   88    HA   THR  10           HA       THR  10   9.619 -10.326  13.201
   89    HB   THR  10           HB       THR  10   9.718 -12.189  11.489
   90    HG1  THR  10           HG1      THR  10   7.063 -11.328  11.005
   91   1HG2  THR  10          HG21      THR  10   8.095 -13.555  12.653
   92   2HG2  THR  10          HG22      THR  10   7.193 -12.129  13.163
   93   3HG2  THR  10          HG23      THR  10   8.801 -12.436  13.818
   94    H    SER  11           HN       SER  11   8.438  -8.401  10.678
   95    HA   SER  11           HA       SER  11  11.142  -8.186   9.451
   96   1HB   SER  11          HB2       SER  11   9.718  -9.074   7.768
   97   2HB   SER  11          HB1       SER  11   8.395  -7.998   8.210
   98    HG   SER  11           HG       SER  11  10.797  -6.786   7.542
   99    HA   PRO  12           HA       PRO  12  10.014  -4.027  11.215
  100   1HB   PRO  12          HB2       PRO  12  12.686  -3.838  12.298
  101   2HB   PRO  12          HB1       PRO  12  11.173  -4.021  13.204
  102   1HG   PRO  12          HG2       PRO  12  13.169  -5.938  13.047
  103   2HG   PRO  12          HG1       PRO  12  11.484  -6.255  13.491
  104   1HD   PRO  12          HD2       PRO  12  12.864  -6.727  10.870
  105   2HD   PRO  12          HD1       PRO  12  11.569  -7.654  11.653
  106    H    LEU  13           HN       LEU  13  10.105  -2.231  10.224
  107    HA   LEU  13           HA       LEU  13  12.224  -1.878   8.188
  108   1HB   LEU  13          HB2       LEU  13   9.590  -0.401   8.356
  109   2HB   LEU  13          HB1       LEU  13  10.682  -0.514   6.980
  110    HG   LEU  13           HG       LEU  13   9.041  -2.770   8.167
  111   1HD1  LEU  13          HD11      LEU  13   7.928  -2.785   5.987
  112   2HD1  LEU  13          HD12      LEU  13   8.970  -1.484   5.416
  113   3HD1  LEU  13          HD13      LEU  13   7.801  -1.178   6.702
  114   1HD2  LEU  13          HD21      LEU  13   9.975  -4.027   6.129
  115   2HD2  LEU  13          HD22      LEU  13  11.089  -3.778   7.470
  116   3HD2  LEU  13          HD23      LEU  13  11.195  -2.756   6.036
  117    HA   PRO  14           HA       PRO  14  14.053   1.276  10.608
  118   1HB   PRO  14          HB2       PRO  14  14.173   3.350   8.568
  119   2HB   PRO  14          HB1       PRO  14  15.486   2.300   9.127
  120   1HG   PRO  14          HG2       PRO  14  13.849   2.087   6.710
  121   2HG   PRO  14          HG1       PRO  14  15.383   1.294   7.096
  122   1HD   PRO  14          HD2       PRO  14  12.936  -0.010   6.979
  123   2HD   PRO  14          HD1       PRO  14  14.337  -0.605   7.890
  124    H    ALA  15           HN       ALA  15  13.654   3.088  11.748
  125    HA   ALA  15           HA       ALA  15  11.033   3.700  12.432
  126   1HB   ALA  15          HB1       ALA  15  13.421   5.485  12.862
  127   2HB   ALA  15          HB2       ALA  15  13.084   4.040  13.814
  128   3HB   ALA  15          HB3       ALA  15  11.957   5.398  13.841
  129    H    GLY  16           HN       GLY  16  10.846   4.090   9.716
  130   1HA   GLY  16          HA2       GLY  16   9.731   6.693   9.524
  131   2HA   GLY  16          HA1       GLY  16  11.273   6.684   8.728
  132    H    ALA  17           HN       ALA  17  10.747   3.694   8.233
  133    HA   ALA  17           HA       ALA  17   9.902   4.068   5.537
  134   1HB   ALA  17          HB1       ALA  17  10.882   1.799   7.185
  135   2HB   ALA  17          HB2       ALA  17  11.433   2.356   5.607
  136   3HB   ALA  17          HB3       ALA  17   9.964   1.388   5.734
  137    H    ILE  18           HN       ILE  18   8.118   2.719   8.285
  138    HA   ILE  18           HA       ILE  18   5.985   1.729   6.744
  139    HB   ILE  18           HB       ILE  18   6.078   2.841   9.555
  140   1HG1  ILE  18          HG12      ILE  18   7.277   0.626   8.791
  141   2HG1  ILE  18          HG11      ILE  18   6.329   0.630  10.270
  142   1HG2  ILE  18          HG21      ILE  18   3.861   1.574   9.792
  143   2HG2  ILE  18          HG22      ILE  18   3.794   1.585   8.030
  144   3HG2  ILE  18          HG23      ILE  18   3.806   3.107   8.920
  145   1HD1  ILE  18          HD11      ILE  18   4.994  -0.114   7.683
  146   2HD1  ILE  18          HD12      ILE  18   4.590  -0.601   9.326
  147   3HD1  ILE  18          HD13      ILE  18   5.994  -1.299   8.521
  148    H    ASP  19           HN       ASP  19   6.458   4.891   8.307
  149    HA   ASP  19           HA       ASP  19   4.064   6.065   7.313
  150   1HB   ASP  19          HB2       ASP  19   6.672   7.265   8.282
  151   2HB   ASP  19          HB1       ASP  19   5.335   8.264   7.713
  152    H    ALA  20           HN       ALA  20   7.300   5.806   5.891
  153    HA   ALA  20           HA       ALA  20   6.680   7.524   3.731
  154   1HB   ALA  20          HB1       ALA  20   8.996   6.631   4.536
  155   2HB   ALA  20          HB2       ALA  20   8.742   6.930   2.816
  156   3HB   ALA  20          HB3       ALA  20   8.662   5.285   3.448
  157    H    LEU  21           HN       LEU  21   6.405   4.011   4.133
  158    HA   LEU  21           HA       LEU  21   5.685   3.338   1.528
  159   1HB   LEU  21          HB2       LEU  21   6.387   1.678   3.138
  160   2HB   LEU  21          HB1       LEU  21   5.053   2.091   4.207
  161    HG   LEU  21           HG       LEU  21   3.468   1.322   2.463
  162   1HD1  LEU  21          HD11      LEU  21   6.025   0.578   1.034
  163   2HD1  LEU  21          HD12      LEU  21   4.701   1.569   0.418
  164   3HD1  LEU  21          HD13      LEU  21   4.476  -0.163   0.646
  165   1HD2  LEU  21          HD21      LEU  21   3.712  -0.986   2.949
  166   2HD2  LEU  21          HD22      LEU  21   4.469  -0.161   4.310
  167   3HD2  LEU  21          HD23      LEU  21   5.469  -0.859   3.036
  168    H    ALA  22           HN       ALA  22   3.687   4.127   4.350
  169    HA   ALA  22           HA       ALA  22   1.155   3.849   3.091
  170   1HB   ALA  22          HB1       ALA  22   0.259   4.946   4.981
  171   2HB   ALA  22          HB2       ALA  22   1.751   5.838   5.277
  172   3HB   ALA  22          HB3       ALA  22   1.677   4.108   5.613
  173    H    GLY  23           HN       GLY  23   3.427   6.551   3.228
  174   1HA   GLY  23          HA2       GLY  23   1.636   8.414   1.982
  175   2HA   GLY  23          HA1       GLY  23   3.402   8.552   2.167
  176    H    GLU  24           HN       GLU  24   4.255   6.317   0.680
  177    HA   GLU  24           HA       GLU  24   3.917   7.314  -1.943
  178   1HB   GLU  24          HB2       GLU  24   5.856   5.826  -0.890
  179   2HB   GLU  24          HB1       GLU  24   4.865   4.489  -1.469
  180   1HG   GLU  24          HG2       GLU  24   5.880   6.791  -3.167
  181   2HG   GLU  24          HG1       GLU  24   6.516   5.147  -3.178
  182    H    LEU  25           HN       LEU  25   2.437   4.592  -0.236
  183    HA   LEU  25           HA       LEU  25   1.093   3.532  -2.485
  184   1HB   LEU  25          HB2       LEU  25   0.492   3.337   0.460
  185   2HB   LEU  25          HB1       LEU  25  -0.448   2.488  -0.762
  186    HG   LEU  25           HG       LEU  25   2.563   2.220  -0.468
  187   1HD1  LEU  25          HD11      LEU  25   1.327   1.421   1.547
  188   2HD1  LEU  25          HD12      LEU  25   2.117   0.108   0.678
  189   3HD1  LEU  25          HD13      LEU  25   0.379   0.356   0.513
  190   1HD2  LEU  25          HD21      LEU  25   2.075   1.450  -2.633
  191   2HD2  LEU  25          HD22      LEU  25   0.458   0.906  -2.189
  192   3HD2  LEU  25          HD23      LEU  25   1.870  -0.030  -1.704
  193    H    SER  26           HN       SER  26   0.064   5.968  -0.116
  194    HA   SER  26           HA       SER  26  -2.616   6.172  -0.971
  195   1HB   SER  26          HB2       SER  26  -1.809   7.148   1.136
  196   2HB   SER  26          HB1       SER  26  -0.848   8.313   0.232
  197    HG   SER  26           HG       SER  26  -2.609   9.395  -0.251
  198    H    ARG  27           HN       ARG  27   0.288   7.992  -2.023
  199    HA   ARG  27           HA       ARG  27  -1.098   9.700  -3.811
  200   1HB   ARG  27          HB2       ARG  27   1.743   8.646  -3.883
  201   2HB   ARG  27          HB1       ARG  27   1.119   9.854  -5.004
  202   1HG   ARG  27          HG2       ARG  27   0.578  11.338  -3.108
  203   2HG   ARG  27          HG1       ARG  27   1.209  10.131  -1.986
  204   1HD   ARG  27          HD2       ARG  27   3.418  10.268  -3.119
  205   2HD   ARG  27          HD1       ARG  27   2.779  11.528  -4.170
  206    HE   ARG  27           HE       ARG  27   2.426  12.206  -1.415
  207   1HH1  ARG  27          HH11      ARG  27   4.507  12.291  -4.165
  208   2HH1  ARG  27          HH12      ARG  27   5.626  13.412  -3.463
  209   1HH2  ARG  27          HH21      ARG  27   3.988  13.542  -0.408
  210   2HH2  ARG  27          HH22      ARG  27   5.336  14.115  -1.334
  211    H    ARG  28           HN       ARG  28   0.251   6.464  -4.192
  212    HA   ARG  28           HA       ARG  28  -0.218   6.201  -6.960
  213   1HB   ARG  28          HB2       ARG  28  -0.032   4.174  -4.735
  214   2HB   ARG  28          HB1       ARG  28  -0.187   3.729  -6.427
  215   1HG   ARG  28          HG2       ARG  28   1.991   5.610  -5.515
  216   2HG   ARG  28          HG1       ARG  28   2.202   3.865  -5.401
  217   1HD   ARG  28          HD2       ARG  28   1.623   3.741  -7.876
  218   2HD   ARG  28          HD1       ARG  28   1.727   5.497  -7.909
  219    HE   ARG  28           HE       ARG  28   4.082   4.477  -6.744
  220   1HH1  ARG  28          HH21      ARG  28   3.774   2.542  -9.040
  221   2HH1  ARG  28          HH22      ARG  28   4.601   3.365 -10.323
  222   1HH2  ARG  28          HH11      ARG  28   4.576   6.442  -8.724
  223   2HH2  ARG  28          HH12      ARG  28   5.056   5.570 -10.142
  224    H    ILE  29           HN       ILE  29  -2.230   5.498  -4.132
  225    HA   ILE  29           HA       ILE  29  -4.344   4.228  -5.506
  226    HB   ILE  29           HB       ILE  29  -4.242   5.670  -2.856
  227   1HG1  ILE  29          HG12      ILE  29  -2.995   3.423  -3.353
  228   2HG1  ILE  29          HG11      ILE  29  -3.965   3.550  -1.894
  229   1HG2  ILE  29          HG21      ILE  29  -6.430   4.408  -2.432
  230   2HG2  ILE  29          HG22      ILE  29  -6.527   4.189  -4.179
  231   3HG2  ILE  29          HG23      ILE  29  -6.536   5.813  -3.491
  232   1HD1  ILE  29          HD11      ILE  29  -5.559   2.079  -2.654
  233   2HD1  ILE  29          HD12      ILE  29  -4.187   1.469  -3.573
  234   3HD1  ILE  29          HD13      ILE  29  -5.354   2.538  -4.342
  235    H    GLN  30           HN       GLN  30  -3.881   7.576  -4.508
  236    HA   GLN  30           HA       GLN  30  -6.389   8.574  -5.439
  237   1HB   GLN  30          HB2       GLN  30  -4.845   9.753  -3.838
  238   2HB   GLN  30          HB1       GLN  30  -3.767  10.072  -5.194
  239   1HG   GLN  30          HG2       GLN  30  -5.140  12.025  -4.902
  240   2HG   GLN  30          HG1       GLN  30  -5.711  11.210  -6.354
  241   1HE2  GLN  30          HE21      GLN  30  -7.933  10.869  -6.427
  242   2HE2  GLN  30          HE22      GLN  30  -8.954  10.834  -5.072
  243    H    TYR  31           HN       TYR  31  -3.246   8.277  -7.139
  244    HA   TYR  31           HA       TYR  31  -4.186   9.656  -9.427
  245   1HB   TYR  31          HB2       TYR  31  -1.771   9.286  -8.944
  246   2HB   TYR  31          HB1       TYR  31  -1.998   7.564  -9.240
  247    HD1  TYR  31           HD1      TYR  31  -2.577   6.741 -11.513
  248    HD2  TYR  31           HD2      TYR  31  -1.700  10.877 -10.754
  249    HE1  TYR  31           HE1      TYR  31  -2.256   7.119 -13.944
  250    HE2  TYR  31           HE2      TYR  31  -1.382  11.256 -13.184
  251    HH   TYR  31           HH       TYR  31  -1.492  10.366 -15.210
  252    H    ALA  32           HN       ALA  32  -4.198   6.245  -8.492
  253    HA   ALA  32           HA       ALA  32  -5.154   5.277 -10.987
  254   1HB   ALA  32          HB1       ALA  32  -5.746   3.233  -9.584
  255   2HB   ALA  32          HB2       ALA  32  -5.089   4.120  -8.208
  256   3HB   ALA  32          HB3       ALA  32  -4.054   3.729  -9.581
  257    H    PHE  33           HN       PHE  33  -6.722   6.281  -7.992
  258    HA   PHE  33           HA       PHE  33  -9.403   5.945  -9.248
  259   1HB   PHE  33          HB2       PHE  33  -8.620   5.820  -6.330
  260   2HB   PHE  33          HB1       PHE  33 -10.262   5.710  -6.956
  261    HD1  PHE  33           HD1      PHE  33  -6.971   4.035  -6.822
  262    HD2  PHE  33           HD2      PHE  33 -11.066   3.718  -8.072
  263    HE1  PHE  33           HE1      PHE  33  -6.652   1.613  -7.240
  264    HE2  PHE  33           HE2      PHE  33 -10.748   1.292  -8.490
  265    HZ   PHE  33           HZ       PHE  33  -8.540   0.242  -8.075
  266    HA   PRO  34           HA       PRO  34  -8.794  10.473  -8.541
  267   1HB   PRO  34          HB2       PRO  34 -10.369  10.984 -10.920
  268   2HB   PRO  34          HB1       PRO  34  -8.644  11.277 -10.653
  269   1HG   PRO  34          HG2       PRO  34  -9.698   9.358 -12.356
  270   2HG   PRO  34          HG1       PRO  34  -8.046   9.367 -11.715
  271   1HD   PRO  34          HD2       PRO  34 -10.389   7.721 -10.861
  272   2HD   PRO  34          HD1       PRO  34  -8.653   7.340 -10.828
  273    H    ASP  35           HN       ASP  35 -11.678   8.661  -9.294
  274    HA   ASP  35           HA       ASP  35 -13.487  10.748  -8.331
  275   1HB   ASP  35          HB2       ASP  35 -15.258   9.274  -9.128
  276   2HB   ASP  35          HB1       ASP  35 -14.039   9.541 -10.372
  277    H    ASN  36           HN       ASN  36 -11.862   8.146  -6.779
  278    HA   ASN  36           HA       ASN  36 -14.070   7.970  -4.787
  279   1HB   ASN  36          HB2       ASN  36 -12.116   5.834  -5.596
  280   2HB   ASN  36          HB1       ASN  36 -13.315   5.691  -4.317
  281   1HD2  ASN  36          HD21      ASN  36 -12.896   4.642  -7.348
  282   2HD2  ASN  36          HD22      ASN  36 -14.485   4.719  -7.938
  283    H    GLU  37           HN       GLU  37 -13.454   8.578  -2.620
  284    HA   GLU  37           HA       GLU  37 -10.911   9.513  -1.954
  285   1HB   GLU  37          HB2       GLU  37 -13.074   9.998  -0.857
  286   2HB   GLU  37          HB1       GLU  37 -13.062   8.365  -0.195
  287   1HG   GLU  37          HG2       GLU  37 -12.157   9.828   1.489
  288   2HG   GLU  37          HG1       GLU  37 -10.813   8.896   0.838
  289    H    GLY  38           HN       GLY  38  -9.099   8.287  -1.576
  290   1HA   GLY  38          HA2       GLY  38  -9.411   5.407  -0.825
  291   2HA   GLY  38          HA1       GLY  38  -8.073   5.934  -1.601
  292    H    HIS  39           HN       HIS  39  -8.840   4.938   1.410
  293    HA   HIS  39           HA       HIS  39  -6.938   6.820   2.674
  294   1HB   HIS  39          HB2       HIS  39  -9.098   5.118   3.952
  295   2HB   HIS  39          HB1       HIS  39  -7.956   6.139   4.826
  296    HD1  HIS  39           HD1      HIS  39  -7.973   8.770   3.737
  297    HD2  HIS  39           HD2      HIS  39 -11.446   6.478   3.499
  298    HE1  HIS  39           HE1      HIS  39  -9.882  10.397   3.378
  299    H    VAL  40           HN       VAL  40  -4.977   5.847   3.122
  300    HA   VAL  40           HA       VAL  40  -4.863   2.911   3.147
  301    HB   VAL  40           HB       VAL  40  -2.752   4.940   2.426
  302   1HG1  VAL  40          HG11      VAL  40  -1.612   2.776   1.612
  303   2HG1  VAL  40          HG12      VAL  40  -2.756   1.924   2.647
  304   3HG1  VAL  40          HG13      VAL  40  -1.614   3.070   3.350
  305   1HG2  VAL  40          HG21      VAL  40  -4.725   4.541   0.835
  306   2HG2  VAL  40          HG22      VAL  40  -4.142   2.880   0.692
  307   3HG2  VAL  40          HG23      VAL  40  -3.122   4.218   0.171
  308    H    SER  41           HN       SER  41  -4.201   1.933   4.919
  309    HA   SER  41           HA       SER  41  -2.718   3.476   6.971
  310   1HB   SER  41          HB2       SER  41  -4.983   1.514   7.424
  311   2HB   SER  41          HB1       SER  41  -3.895   2.042   8.704
  312    HG   SER  41           HG       SER  41  -6.044   3.242   7.960
  313    H    VAL  42           HN       VAL  42  -1.043   2.486   7.953
  314    HA   VAL  42           HA       VAL  42  -0.479  -0.319   7.197
  315    HB   VAL  42           HB       VAL  42   1.595   1.901   7.292
  316   1HG1  VAL  42          HG11      VAL  42   1.719  -0.970   6.327
  317   2HG1  VAL  42          HG12      VAL  42   2.464  -0.335   7.795
  318   3HG1  VAL  42          HG13      VAL  42   3.034   0.199   6.214
  319   1HG2  VAL  42          HG21      VAL  42   0.044   2.228   5.397
  320   2HG2  VAL  42          HG22      VAL  42   0.336   0.571   4.875
  321   3HG2  VAL  42          HG23      VAL  42   1.645   1.749   4.837
  322    H    ARG  43           HN       ARG  43  -0.004  -1.570   8.849
  323    HA   ARG  43           HA       ARG  43   1.213  -0.418  11.238
  324   1HB   ARG  43          HB2       ARG  43  -0.526  -1.307  12.739
  325   2HB   ARG  43          HB1       ARG  43  -1.178  -0.103  11.627
  326   1HG   ARG  43          HG2       ARG  43  -1.985  -1.924  10.147
  327   2HG   ARG  43          HG1       ARG  43  -1.378  -3.113  11.303
  328   1HD   ARG  43          HD2       ARG  43  -2.869  -2.252  13.031
  329   2HD   ARG  43          HD1       ARG  43  -3.421  -0.970  11.957
  330    HE   ARG  43           HE       ARG  43  -4.836  -2.509  10.955
  331   1HH1  ARG  43          HH21      ARG  43  -2.607  -4.071  13.075
  332   2HH1  ARG  43          HH22      ARG  43  -3.163  -5.670  12.712
  333   1HH2  ARG  43          HH11      ARG  43  -5.457  -4.621  10.332
  334   2HH2  ARG  43          HH12      ARG  43  -4.776  -5.982  11.160
  335    H    TYR  44           HN       TYR  44   1.886  -2.076  12.796
  336    HA   TYR  44           HA       TYR  44   2.809  -4.507  11.448
  337   1HB   TYR  44          HB2       TYR  44   3.253  -3.394  14.238
  338   2HB   TYR  44          HB1       TYR  44   3.905  -4.931  13.690
  339    HD1  TYR  44           HD1      TYR  44   5.117  -4.730  11.251
  340    HD2  TYR  44           HD2      TYR  44   4.712  -1.573  14.142
  341    HE1  TYR  44           HE1      TYR  44   7.075  -3.575  10.270
  342    HE2  TYR  44           HE2      TYR  44   6.673  -0.423  13.161
  343    HH   TYR  44           HH       TYR  44   7.865  -0.358  10.979
  344    H    ALA  45           HN       ALA  45   2.142  -6.529  11.788
  345    HA   ALA  45           HA       ALA  45   0.129  -7.076  13.855
  346   1HB   ALA  45          HB1       ALA  45  -1.107  -6.502  11.768
  347   2HB   ALA  45          HB2       ALA  45  -1.338  -8.182  12.251
  348   3HB   ALA  45          HB3       ALA  45  -0.238  -7.788  10.931
  349    H    ALA  46           HN       ALA  46  -0.262  -9.539  13.935
  350    HA   ALA  46           HA       ALA  46   2.248 -10.806  14.207
  351   1HB   ALA  46          HB1       ALA  46   0.248 -11.528  15.496
  352   2HB   ALA  46          HB2       ALA  46   0.972 -12.878  14.622
  353   3HB   ALA  46          HB3       ALA  46  -0.490 -12.108  14.003
  354    H    ALA  47           HN       ALA  47   0.087 -10.569  11.457
  355    HA   ALA  47           HA       ALA  47   2.106 -12.060   9.894
  356   1HB   ALA  47          HB1       ALA  47  -0.851 -12.521   9.517
  357   2HB   ALA  47          HB2       ALA  47   0.149 -13.540  10.551
  358   3HB   ALA  47          HB3       ALA  47   0.492 -13.431   8.826
  359    H    ASN  48           HN       ASN  48   2.198 -11.598   7.665
  360    HA   ASN  48           HA       ASN  48   1.506  -8.894   6.923
  361   1HB   ASN  48          HB2       ASN  48   2.543  -9.412   4.826
  362   2HB   ASN  48          HB1       ASN  48   3.519 -10.159   6.087
  363   1HD2  ASN  48          HD21      ASN  48   3.251 -10.991   3.224
  364   2HD2  ASN  48          HD22      ASN  48   2.700 -12.596   3.267
  365    H    ASN  49           HN       ASN  49  -0.395  -8.228   6.015
  366    HA   ASN  49           HA       ASN  49  -2.014 -10.073   4.430
  367   1HB   ASN  49          HB2       ASN  49  -3.091  -8.758   6.932
  368   2HB   ASN  49          HB1       ASN  49  -4.049  -9.628   5.740
  369   1HD2  ASN  49          HD21      ASN  49  -2.550 -11.887   5.211
  370   2HD2  ASN  49          HD22      ASN  49  -2.318 -12.788   6.631
  371    H    LEU  50           HN       LEU  50  -3.506  -9.019   3.077
  372    HA   LEU  50           HA       LEU  50  -3.411  -6.060   3.027
  373   1HB   LEU  50          HB2       LEU  50  -2.047  -7.018   1.180
  374   2HB   LEU  50          HB1       LEU  50  -3.429  -7.983   0.672
  375    HG   LEU  50           HG       LEU  50  -4.722  -5.873   0.291
  376   1HD1  LEU  50          HD11      LEU  50  -2.151  -4.650   1.235
  377   2HD1  LEU  50          HD12      LEU  50  -3.816  -4.240   1.652
  378   3HD1  LEU  50          HD13      LEU  50  -3.168  -3.785   0.080
  379   1HD2  LEU  50          HD21      LEU  50  -3.655  -5.296  -1.793
  380   2HD2  LEU  50          HD22      LEU  50  -3.387  -7.018  -1.530
  381   3HD2  LEU  50          HD23      LEU  50  -2.091  -5.864  -1.214
  382    H    SER  51           HN       SER  51  -5.482  -5.265   3.324
  383    HA   SER  51           HA       SER  51  -7.754  -6.986   2.487
  384   1HB   SER  51          HB2       SER  51  -7.574  -6.871   4.927
  385   2HB   SER  51          HB1       SER  51  -7.561  -5.111   4.856
  386    HG   SER  51           HG       SER  51  -9.643  -6.856   4.710
  387    H    VAL  52           HN       VAL  52  -9.136  -6.020   1.069
  388    HA   VAL  52           HA       VAL  52  -9.090  -3.079   0.826
  389    HB   VAL  52           HB       VAL  52  -9.404  -5.091  -1.412
  390   1HG1  VAL  52          HG11      VAL  52  -9.562  -2.068  -1.299
  391   2HG1  VAL  52          HG12      VAL  52 -10.795  -3.187  -1.878
  392   3HG1  VAL  52          HG13      VAL  52  -9.312  -2.953  -2.802
  393   1HG2  VAL  52          HG21      VAL  52  -7.203  -3.120  -0.724
  394   2HG2  VAL  52          HG22      VAL  52  -7.290  -4.037  -2.228
  395   3HG2  VAL  52          HG23      VAL  52  -7.080  -4.879  -0.692
  396    H    ILE  53           HN       ILE  53 -11.066  -2.183   1.178
  397    HA   ILE  53           HA       ILE  53 -13.470  -3.917   0.915
  398    HB   ILE  53           HB       ILE  53 -12.961  -1.665   2.875
  399   1HG1  ILE  53          HG12      ILE  53 -13.400  -4.595   3.507
  400   2HG1  ILE  53          HG11      ILE  53 -11.783  -3.952   3.210
  401   1HG2  ILE  53          HG21      ILE  53 -15.337  -3.470   2.359
  402   2HG2  ILE  53          HG22      ILE  53 -15.294  -1.708   2.314
  403   3HG2  ILE  53          HG23      ILE  53 -15.135  -2.556   3.853
  404   1HD1  ILE  53          HD11      ILE  53 -12.462  -3.989   5.642
  405   2HD1  ILE  53          HD12      ILE  53 -13.689  -2.786   5.249
  406   3HD1  ILE  53          HD13      ILE  53 -11.981  -2.402   5.040
  407    H    GLY  54           HN       GLY  54 -14.974  -3.240  -0.490
  408   1HA   GLY  54          HA2       GLY  54 -16.422  -1.620  -1.451
  409   2HA   GLY  54          HA1       GLY  54 -15.256  -0.367  -1.036
  410    H    ALA  55           HN       ALA  55 -13.891  -3.161  -2.558
  411    HA   ALA  55           HA       ALA  55 -13.816  -1.687  -5.137
  412   1HB   ALA  55          HB1       ALA  55 -11.589  -3.433  -4.076
  413   2HB   ALA  55          HB2       ALA  55 -11.654  -1.692  -3.800
  414   3HB   ALA  55          HB3       ALA  55 -11.536  -2.322  -5.444
  415    H    THR  56           HN       THR  56 -13.370  -2.928  -7.015
  416    HA   THR  56           HA       THR  56 -14.850  -5.480  -7.226
  417    HB   THR  56           HB       THR  56 -14.710  -5.026  -9.569
  418    HG1  THR  56           HG1      THR  56 -12.921  -3.005  -8.732
  419   1HG2  THR  56          HG21      THR  56 -15.317  -2.487  -8.028
  420   2HG2  THR  56          HG22      THR  56 -16.449  -3.804  -8.337
  421   3HG2  THR  56          HG23      THR  56 -15.844  -2.827  -9.676
  422    H    LYS  57           HN       LYS  57 -13.952  -7.237  -8.274
  423    HA   LYS  57           HA       LYS  57 -11.477  -8.075  -7.335
  424   1HB   LYS  57          HB2       LYS  57 -12.971  -9.035  -9.799
  425   2HB   LYS  57          HB1       LYS  57 -11.700  -9.923  -8.968
  426   1HG   LYS  57          HG2       LYS  57 -13.115 -10.037  -6.925
  427   2HG   LYS  57          HG1       LYS  57 -14.384  -9.143  -7.768
  428   1HD   LYS  57          HD2       LYS  57 -14.530 -10.938  -9.450
  429   2HD   LYS  57          HD1       LYS  57 -13.258 -11.828  -8.612
  430   1HE   LYS  57          HE2       LYS  57 -14.669 -11.961  -6.596
  431   2HE   LYS  57          HE1       LYS  57 -15.941 -11.062  -7.422
  432   1HZ   LYS  57          HZ1       LYS  57 -16.612 -12.885  -8.469
  433   2HZ   LYS  57          HZ2       LYS  57 -15.604 -13.775  -7.431
  434   3HZ   LYS  57          HZ3       LYS  57 -15.039 -13.290  -8.957
  435    H    GLU  58           HN       GLU  58 -12.224  -6.570 -10.526
  436    HA   GLU  58           HA       GLU  58  -9.601  -6.962 -11.571
  437   1HB   GLU  58          HB2       GLU  58 -11.645  -6.417 -12.936
  438   2HB   GLU  58          HB1       GLU  58 -11.581  -4.784 -12.271
  439   1HG   GLU  58          HG2       GLU  58  -9.298  -4.504 -13.163
  440   2HG   GLU  58          HG1       GLU  58  -9.356  -6.135 -13.828
  441    H    ASP  59           HN       ASP  59 -11.129  -4.414  -9.654
  442    HA   ASP  59           HA       ASP  59  -9.019  -2.548  -9.857
  443   1HB   ASP  59          HB2       ASP  59 -11.161  -2.968  -7.767
  444   2HB   ASP  59          HB1       ASP  59 -10.016  -1.629  -7.717
  445    H    LYS  60           HN       LYS  60  -9.816  -5.118  -7.584
  446    HA   LYS  60           HA       LYS  60  -7.637  -4.708  -5.813
  447   1HB   LYS  60          HB2       LYS  60  -9.291  -7.171  -6.439
  448   2HB   LYS  60          HB1       LYS  60  -8.078  -7.119  -5.162
  449   1HG   LYS  60          HG2       LYS  60  -9.290  -5.257  -4.085
  450   2HG   LYS  60          HG1       LYS  60 -10.509  -5.316  -5.361
  451   1HD   LYS  60          HD2       LYS  60 -10.929  -7.718  -4.753
  452   2HD   LYS  60          HD1       LYS  60  -9.849  -7.506  -3.377
  453   1HE   LYS  60          HE2       LYS  60 -11.313  -5.631  -2.588
  454   2HE   LYS  60          HE1       LYS  60 -12.429  -6.006  -3.897
  455   1HZ   LYS  60          HZ1       LYS  60 -13.271  -7.666  -2.727
  456   2HZ   LYS  60          HZ2       LYS  60 -12.325  -7.179  -1.402
  457   3HZ   LYS  60          HZ3       LYS  60 -11.740  -8.354  -2.481
  458    H    GLN  61           HN       GLN  61  -7.849  -6.674  -8.788
  459    HA   GLN  61           HA       GLN  61  -5.281  -7.855  -8.421
  460   1HB   GLN  61          HB2       GLN  61  -6.942  -8.716 -10.062
  461   2HB   GLN  61          HB1       GLN  61  -6.766  -7.232 -10.997
  462   1HG   GLN  61          HG2       GLN  61  -4.390  -7.712 -11.362
  463   2HG   GLN  61          HG1       GLN  61  -4.516  -9.165 -10.372
  464   1HE2  GLN  61          HE21      GLN  61  -3.660  -9.465 -13.020
  465   2HE2  GLN  61          HE22      GLN  61  -4.884 -10.205 -13.934
  466    H    ARG  62           HN       ARG  62  -6.432  -4.872 -10.030
  467    HA   ARG  62           HA       ARG  62  -3.937  -4.095 -11.033
  468   1HB   ARG  62          HB2       ARG  62  -6.034  -3.021 -11.766
  469   2HB   ARG  62          HB1       ARG  62  -6.267  -2.355 -10.151
  470   1HG   ARG  62          HG2       ARG  62  -4.253  -1.005 -10.359
  471   2HG   ARG  62          HG1       ARG  62  -3.866  -1.751 -11.909
  472   1HD   ARG  62          HD2       ARG  62  -4.907   0.429 -12.274
  473   2HD   ARG  62          HD1       ARG  62  -5.970  -0.851 -12.853
  474    HE   ARG  62           HE       ARG  62  -6.521  -0.093 -10.129
  475   1HH1  ARG  62          HH11      ARG  62  -6.549   1.755 -12.928
  476   2HH1  ARG  62          HH12      ARG  62  -8.243   2.112 -12.903
  477   1HH2  ARG  62          HH21      ARG  62  -8.940  -0.099 -10.324
  478   2HH2  ARG  62          HH22      ARG  62  -9.597   1.064 -11.426
  479    H    ILE  63           HN       ILE  63  -5.506  -3.348  -7.954
  480    HA   ILE  63           HA       ILE  63  -3.445  -1.697  -6.967
  481    HB   ILE  63           HB       ILE  63  -5.468  -3.393  -5.528
  482   1HG1  ILE  63          HG12      ILE  63  -5.303  -0.385  -5.742
  483   2HG1  ILE  63          HG11      ILE  63  -6.183  -1.368  -6.912
  484   1HG2  ILE  63          HG21      ILE  63  -3.667  -3.145  -3.964
  485   2HG2  ILE  63          HG22      ILE  63  -4.878  -1.940  -3.528
  486   3HG2  ILE  63          HG23      ILE  63  -3.434  -1.455  -4.416
  487   1HD1  ILE  63          HD11      ILE  63  -7.542  -0.419  -4.945
  488   2HD1  ILE  63          HD12      ILE  63  -6.697  -1.599  -3.944
  489   3HD1  ILE  63          HD13      ILE  63  -7.717  -2.143  -5.274
  490    H    SER  64           HN       SER  64  -3.849  -5.201  -6.731
  491    HA   SER  64           HA       SER  64  -1.554  -5.637  -5.107
  492   1HB   SER  64          HB2       SER  64  -2.762  -7.434  -7.231
  493   2HB   SER  64          HB1       SER  64  -1.568  -7.938  -6.038
  494    HG   SER  64           HG       SER  64  -4.203  -7.801  -5.779
  495    H    GLU  65           HN       GLU  65  -1.962  -5.294  -8.688
  496    HA   GLU  65           HA       GLU  65   0.742  -5.857  -9.299
  497   1HB   GLU  65          HB2       GLU  65  -1.336  -4.208 -10.770
  498   2HB   GLU  65          HB1       GLU  65   0.265  -4.559 -11.419
  499   1HG   GLU  65          HG2       GLU  65  -0.186  -6.978 -11.238
  500   2HG   GLU  65          HG1       GLU  65  -1.787  -6.629 -10.592
  501    H    ILE  66           HN       ILE  66  -0.940  -2.845  -8.511
  502    HA   ILE  66           HA       ILE  66   1.211  -1.097  -8.954
  503    HB   ILE  66           HB       ILE  66  -1.155  -0.919  -7.083
  504   1HG1  ILE  66          HG12      ILE  66  -0.494   0.457  -9.710
  505   2HG1  ILE  66          HG11      ILE  66  -1.547  -0.947  -9.558
  506   1HG2  ILE  66          HG21      ILE  66  -0.552   1.561  -7.071
  507   2HG2  ILE  66          HG22      ILE  66   1.020   1.096  -7.711
  508   3HG2  ILE  66          HG23      ILE  66   0.508   0.527  -6.122
  509   1HD1  ILE  66          HD11      ILE  66  -2.003   1.731  -8.209
  510   2HD1  ILE  66          HD12      ILE  66  -3.070   0.331  -8.110
  511   3HD1  ILE  66          HD13      ILE  66  -2.846   1.161  -9.650
  512    H    LEU  67           HN       LEU  67   0.215  -2.812  -6.017
  513    HA   LEU  67           HA       LEU  67   2.205  -1.770  -4.310
  514   1HB   LEU  67          HB2       LEU  67   0.386  -2.973  -3.292
  515   2HB   LEU  67          HB1       LEU  67   0.662  -4.380  -4.306
  516    HG   LEU  67           HG       LEU  67   2.918  -4.667  -3.146
  517   1HD1  LEU  67          HD11      LEU  67   2.906  -3.547  -0.802
  518   2HD1  LEU  67          HD12      LEU  67   1.775  -2.396  -1.510
  519   3HD1  LEU  67          HD13      LEU  67   3.400  -2.563  -2.176
  520   1HD2  LEU  67          HD21      LEU  67   0.354  -4.789  -1.537
  521   2HD2  LEU  67          HD22      LEU  67   1.864  -5.555  -1.044
  522   3HD2  LEU  67          HD23      LEU  67   1.057  -6.070  -2.525
  523    H    GLN  68           HN       GLN  68   2.189  -4.553  -6.485
  524    HA   GLN  68           HA       GLN  68   4.772  -5.498  -5.770
  525   1HB   GLN  68          HB2       GLN  68   3.178  -5.742  -8.328
  526   2HB   GLN  68          HB1       GLN  68   4.729  -6.541  -8.067
  527   1HG   GLN  68          HG2       GLN  68   3.842  -7.749  -6.156
  528   2HG   GLN  68          HG1       GLN  68   2.320  -6.869  -6.260
  529   1HE2  GLN  68          HE21      GLN  68   2.788  -9.827  -6.539
  530   2HE2  GLN  68          HE22      GLN  68   2.177 -10.234  -8.069
  531    H    GLU  69           HN       GLU  69   3.788  -3.301  -8.456
  532    HA   GLU  69           HA       GLU  69   6.380  -2.887  -9.394
  533   1HB   GLU  69          HB2       GLU  69   3.904  -1.161  -9.516
  534   2HB   GLU  69          HB1       GLU  69   5.396  -0.774 -10.376
  535   1HG   GLU  69          HG2       GLU  69   5.301  -2.928 -11.551
  536   2HG   GLU  69          HG1       GLU  69   3.836  -3.358 -10.670
  537    H    THR  70           HN       THR  70   4.574  -0.953  -6.990
  538    HA   THR  70           HA       THR  70   6.511   1.052  -6.656
  539    HB   THR  70           HB       THR  70   4.590  -0.058  -4.639
  540    HG1  THR  70           HG1      THR  70   3.285   0.768  -6.078
  541   1HG2  THR  70          HG21      THR  70   6.130   2.539  -4.748
  542   2HG2  THR  70          HG22      THR  70   6.301   1.266  -3.539
  543   3HG2  THR  70          HG23      THR  70   4.816   2.213  -3.618
  544    H    TRP  71           HN       TRP  71   5.965  -1.943  -4.943
  545    HA   TRP  71           HA       TRP  71   8.035  -1.791  -3.120
  546   1HB   TRP  71          HB2       TRP  71   6.084  -3.301  -3.050
  547   2HB   TRP  71          HB1       TRP  71   6.781  -4.214  -4.376
  548    HD1  TRP  71           HD1      TRP  71   7.571  -6.404  -3.419
  549    HE1  TRP  71           HE1      TRP  71   8.956  -7.172  -1.394
  550    HE3  TRP  71           HE3      TRP  71   8.150  -1.935  -0.928
  551    HZ2  TRP  71           HZ2      TRP  71  10.129  -6.081   0.955
  552    HZ3  TRP  71           HZ3      TRP  71   9.396  -1.863   1.199
  553    HH2  TRP  71           HH2      TRP  71  10.380  -3.924   2.150
  554    H    GLU  72           HN       GLU  72   8.019  -3.037  -6.394
  555    HA   GLU  72           HA       GLU  72  10.722  -3.958  -6.303
  556   1HB   GLU  72          HB2       GLU  72   8.829  -3.474  -8.610
  557   2HB   GLU  72          HB1       GLU  72  10.467  -4.092  -8.830
  558   1HG   GLU  72          HG2       GLU  72   8.434  -5.384  -6.998
  559   2HG   GLU  72          HG1       GLU  72   8.677  -5.874  -8.674
  560    H    SER  73           HN       SER  73   9.375  -0.794  -6.746
  561    HA   SER  73           HA       SER  73  11.908   0.118  -7.988
  562   1HB   SER  73          HB2       SER  73   9.153   1.344  -7.912
  563   2HB   SER  73          HB1       SER  73  10.581   2.222  -8.457
  564    HG   SER  73           HG       SER  73   9.128   0.260  -9.686
  565    H    ALA  74           HN       ALA  74  11.291  -0.483  -5.062
  566    HA   ALA  74           HA       ALA  74  11.044   1.674  -3.453
  567   1HB   ALA  74          HB1       ALA  74  12.871  -0.676  -3.033
  568   2HB   ALA  74          HB2       ALA  74  11.133  -0.652  -2.731
  569   3HB   ALA  74          HB3       ALA  74  12.208   0.375  -1.782
  570    H    ASP  75           HN       ASP  75  14.074   0.696  -5.008
  571    HA   ASP  75           HA       ASP  75  15.778   2.339  -3.467
  572   1HB   ASP  75          HB2       ASP  75  17.386   2.034  -5.302
  573   2HB   ASP  75          HB1       ASP  75  16.613   0.515  -4.853
  574    H    ASP  76           HN       ASP  76  13.549   3.186  -5.990
  575    HA   ASP  76           HA       ASP  76  14.922   5.725  -6.585
  576   1HB   ASP  76          HB2       ASP  76  12.494   4.362  -7.738
  577   2HB   ASP  76          HB1       ASP  76  13.007   5.984  -8.199
  578    H    TRP  77           HN       TRP  77  11.744   4.701  -5.241
  579    HA   TRP  77           HA       TRP  77  11.155   7.520  -4.655
  580   1HB   TRP  77          HB2       TRP  77   8.955   6.889  -4.204
  581   2HB   TRP  77          HB1       TRP  77   9.446   5.925  -5.581
  582    HD1  TRP  77           HD1      TRP  77   9.442   3.314  -5.301
  583    HE1  TRP  77           HE1      TRP  77   8.778   1.722  -3.417
  584    HE3  TRP  77           HE3      TRP  77   9.007   6.637  -1.348
  585    HZ2  TRP  77           HZ2      TRP  77   8.158   1.791  -0.658
  586    HZ3  TRP  77           HZ3      TRP  77   8.375   5.787   0.855
  587    HH2  TRP  77           HH2      TRP  77   7.956   3.395   1.213
  588    H    PHE  78           HN       PHE  78  12.391   4.799  -2.864
  589    HA   PHE  78           HA       PHE  78  11.578   6.017  -0.312
  590   1HB   PHE  78          HB2       PHE  78  11.548   3.576  -0.392
  591   2HB   PHE  78          HB1       PHE  78  13.239   3.553  -0.876
  592    HD1  PHE  78           HD1      PHE  78  11.123   5.138   1.807
  593    HD2  PHE  78           HD2      PHE  78  14.827   3.154   0.838
  594    HE1  PHE  78           HE1      PHE  78  11.818   5.247   4.179
  595    HE2  PHE  78           HE2      PHE  78  15.500   3.267   3.212
  596    HZ   PHE  78           HZ       PHE  78  14.000   4.312   4.885
  597    H    VAL  79           HN       VAL  79  12.719   7.429   0.735
  598    HA   VAL  79           HA       VAL  79  15.590   7.770   0.091
  599    HB   VAL  79           HB       VAL  79  13.915   9.980   1.275
  600   1HG1  VAL  79          HG11      VAL  79  16.431  10.090   0.852
  601   2HG1  VAL  79          HG12      VAL  79  15.477  11.393   0.142
  602   3HG1  VAL  79          HG13      VAL  79  16.050  10.068  -0.870
  603   1HG2  VAL  79          HG21      VAL  79  13.306  10.695  -1.057
  604   2HG2  VAL  79          HG22      VAL  79  12.486   9.215  -0.546
  605   3HG2  VAL  79          HG23      VAL  79  13.869   9.130  -1.641
  606    H    SER  80           HN       SER  80  16.989   8.168   1.977
  607    HA   SER  80           HA       SER  80  15.673   7.815   4.602
  608   1HB   SER  80          HB2       SER  80  16.605   5.602   3.715
  609   2HB   SER  80          HB1       SER  80  18.203   6.332   3.852
  610    HG   SER  80           HG       SER  80  16.319   6.271   5.968
  611    H    GLU  81           HN       GLU  81  16.525   9.018   6.188
  612    HA   GLU  81           HA       GLU  81  18.283  11.154   5.503
  613   1HB   GLU  81          HB2       GLU  81  17.219  10.170   8.159
  614   2HB   GLU  81          HB1       GLU  81  18.198  11.625   7.978
  615   1HG   GLU  81          HG2       GLU  81  15.897  12.320   7.935
  616   2HG   GLU  81          HG1       GLU  81  16.502  12.442   6.285
  Start of MODEL    4
    1   1H    MET   1          HT1       MET   1 -12.984   4.591  -0.711
    2   2H    MET   1          HT2       MET   1 -14.425   3.827  -0.235
    3   3H    MET   1          HT3       MET   1 -13.953   3.816  -1.867
    4    HA   MET   1           HA       MET   1 -13.560   1.719  -0.427
    5   1HB   MET   1          HB2       MET   1 -11.411   2.952  -2.168
    6   2HB   MET   1          HB1       MET   1 -11.498   1.251  -1.726
    7   1HG   MET   1          HG2       MET   1 -13.868   1.303  -2.743
    8   2HG   MET   1          HG1       MET   1 -13.378   2.825  -3.483
    9   1HE   MET   1          HE1       MET   1 -10.177   1.845  -5.437
   10   2HE   MET   1          HE2       MET   1 -10.010   1.809  -3.682
   11   3HE   MET   1          HE3       MET   1 -10.981   3.069  -4.446
   12    H    ARG   2           HN       ARG   2 -12.196   0.826   1.110
   13    HA   ARG   2           HA       ARG   2 -10.220   2.645   2.371
   14   1HB   ARG   2          HB2       ARG   2 -12.105   0.662   3.680
   15   2HB   ARG   2          HB1       ARG   2 -10.726   1.382   4.514
   16   1HG   ARG   2          HG2       ARG   2 -11.622   3.635   4.063
   17   2HG   ARG   2          HG1       ARG   2 -13.005   2.920   3.232
   18   1HD   ARG   2          HD2       ARG   2 -13.645   1.751   5.307
   19   2HD   ARG   2          HD1       ARG   2 -12.269   2.471   6.138
   20    HE   ARG   2           HE       ARG   2 -13.587   4.645   5.194
   21   1HH1  ARG   2          HH11      ARG   2 -14.317   1.940   7.202
   22   2HH1  ARG   2          HH12      ARG   2 -15.714   2.666   7.922
   23   1HH2  ARG   2          HH21      ARG   2 -15.524   5.552   6.007
   24   2HH2  ARG   2          HH22      ARG   2 -16.399   4.712   7.244
   25    H    ILE   3           HN       ILE   3  -8.227   1.876   2.494
   26    HA   ILE   3           HA       ILE   3  -7.746  -0.975   1.789
   27    HB   ILE   3           HB       ILE   3  -6.108   1.495   1.192
   28   1HG1  ILE   3          HG12      ILE   3  -7.399  -0.361  -0.815
   29   2HG1  ILE   3          HG11      ILE   3  -8.339   0.939  -0.089
   30   1HG2  ILE   3          HG21      ILE   3  -5.634  -1.455   0.755
   31   2HG2  ILE   3          HG22      ILE   3  -4.544  -0.257   1.451
   32   3HG2  ILE   3          HG23      ILE   3  -4.878  -0.243  -0.281
   33   1HD1  ILE   3          HD11      ILE   3  -6.915   2.615  -0.975
   34   2HD1  ILE   3          HD12      ILE   3  -7.151   1.474  -2.298
   35   3HD1  ILE   3          HD13      ILE   3  -5.653   1.447  -1.364
   36    H    GLU   4           HN       GLU   4  -6.761  -2.106   3.374
   37    HA   GLU   4           HA       GLU   4  -5.065  -0.655   5.350
   38   1HB   GLU   4          HB2       GLU   4  -7.193  -1.359   6.379
   39   2HB   GLU   4          HB1       GLU   4  -6.888  -3.023   5.889
   40   1HG   GLU   4          HG2       GLU   4  -4.835  -3.058   7.264
   41   2HG   GLU   4          HG1       GLU   4  -5.126  -1.387   7.743
   42    H    VAL   5           HN       VAL   5  -3.074  -1.332   5.519
   43    HA   VAL   5           HA       VAL   5  -2.346  -4.012   4.436
   44    HB   VAL   5           HB       VAL   5  -0.571  -1.576   4.527
   45   1HG1  VAL   5          HG11      VAL   5   0.464  -3.873   4.421
   46   2HG1  VAL   5          HG12      VAL   5   0.837  -2.858   3.029
   47   3HG1  VAL   5          HG13      VAL   5  -0.385  -4.125   2.896
   48   1HG2  VAL   5          HG21      VAL   5  -1.046  -1.657   1.959
   49   2HG2  VAL   5          HG22      VAL   5  -2.250  -0.913   3.008
   50   3HG2  VAL   5          HG23      VAL   5  -2.495  -2.552   2.414
   51    H    THR   6           HN       THR   6  -1.237  -5.354   5.718
   52    HA   THR   6           HA       THR   6  -0.157  -4.284   8.269
   53    HB   THR   6           HB       THR   6  -0.703  -6.582   9.187
   54    HG1  THR   6           HG1      THR   6  -2.619  -7.388   7.879
   55   1HG2  THR   6          HG21      THR   6  -3.037  -5.965   9.631
   56   2HG2  THR   6          HG22      THR   6  -3.018  -4.853   8.261
   57   3HG2  THR   6          HG23      THR   6  -2.018  -4.525   9.677
   58    H    ILE   7           HN       ILE   7   1.819  -4.800   8.757
   59    HA   ILE   7           HA       ILE   7   3.329  -6.646   6.995
   60    HB   ILE   7           HB       ILE   7   4.033  -4.084   8.413
   61   1HG1  ILE   7          HG12      ILE   7   4.594  -4.895   5.550
   62   2HG1  ILE   7          HG11      ILE   7   3.044  -4.202   6.025
   63   1HG2  ILE   7          HG21      ILE   7   5.918  -5.464   8.913
   64   2HG2  ILE   7          HG22      ILE   7   6.395  -4.579   7.464
   65   3HG2  ILE   7          HG23      ILE   7   5.858  -6.257   7.339
   66   1HD1  ILE   7          HD11      ILE   7   4.909  -2.593   5.181
   67   2HD1  ILE   7          HD12      ILE   7   5.624  -2.830   6.775
   68   3HD1  ILE   7          HD13      ILE   7   4.005  -2.143   6.627
   69    H    ALA   8           HN       ALA   8   4.325  -8.351   7.963
   70    HA   ALA   8           HA       ALA   8   3.765  -8.999  10.649
   71   1HB   ALA   8          HB1       ALA   8   5.838 -10.098   8.742
   72   2HB   ALA   8          HB2       ALA   8   4.203 -10.713   8.979
   73   3HB   ALA   8          HB3       ALA   8   5.391 -10.844  10.277
   74    H    LYS   9           HN       LYS   9   4.740  -8.598  12.391
   75    HA   LYS   9           HA       LYS   9   6.710  -6.642  12.685
   76   1HB   LYS   9          HB2       LYS   9   5.090  -7.159  14.467
   77   2HB   LYS   9          HB1       LYS   9   5.808  -8.746  14.673
   78   1HG   LYS   9          HG2       LYS   9   6.669  -7.352  16.431
   79   2HG   LYS   9          HG1       LYS   9   7.983  -7.585  15.289
   80   1HD   LYS   9          HD2       LYS   9   7.653  -5.389  14.350
   81   2HD   LYS   9          HD1       LYS   9   6.148  -5.173  15.247
   82   1HE   LYS   9          HE2       LYS   9   8.038  -3.980  16.325
   83   2HE   LYS   9          HE1       LYS   9   7.393  -5.251  17.366
   84   1HZ   LYS   9          HZ1       LYS   9   9.979  -4.984  16.768
   85   2HZ   LYS   9          HZ2       LYS   9   9.500  -6.077  15.559
   86   3HZ   LYS   9          HZ3       LYS   9   9.258  -6.457  17.198
   87    H    THR  10           HN       THR  10   7.049 -10.041  12.146
   88    HA   THR  10           HA       THR  10   9.657 -10.419  13.161
   89    HB   THR  10           HB       THR  10   9.725 -12.234  11.364
   90    HG1  THR  10           HG1      THR  10   6.995 -11.895  11.068
   91   1HG2  THR  10          HG21      THR  10   9.082 -12.907  13.539
   92   2HG2  THR  10          HG22      THR  10   7.785 -13.495  12.499
   93   3HG2  THR  10          HG23      THR  10   7.555 -12.030  13.452
   94    H    SER  11           HN       SER  11   8.478  -8.462  10.640
   95    HA   SER  11           HA       SER  11  11.203  -8.219   9.468
   96   1HB   SER  11          HB2       SER  11   9.554  -9.263   7.910
   97   2HB   SER  11          HB1       SER  11   8.572  -7.804   8.028
   98    HG   SER  11           HG       SER  11  11.150  -7.189   7.536
   99    HA   PRO  12           HA       PRO  12   9.938  -4.047  11.139
  100   1HB   PRO  12          HB2       PRO  12  12.589  -3.803  12.250
  101   2HB   PRO  12          HB1       PRO  12  11.065  -3.987  13.136
  102   1HG   PRO  12          HG2       PRO  12  13.099  -5.877  13.033
  103   2HG   PRO  12          HG1       PRO  12  11.421  -6.199  13.501
  104   1HD   PRO  12          HD2       PRO  12  12.797  -6.781  10.910
  105   2HD   PRO  12          HD1       PRO  12  11.469  -7.642  11.708
  106    H    LEU  13           HN       LEU  13  10.041  -2.247  10.152
  107    HA   LEU  13           HA       LEU  13  12.152  -1.905   8.109
  108   1HB   LEU  13          HB2       LEU  13   9.570  -0.348   8.332
  109   2HB   LEU  13          HB1       LEU  13  10.627  -0.504   6.932
  110    HG   LEU  13           HG       LEU  13   8.923  -2.693   8.166
  111   1HD1  LEU  13          HD11      LEU  13   8.828  -1.310   5.463
  112   2HD1  LEU  13          HD12      LEU  13   7.645  -1.145   6.762
  113   3HD1  LEU  13          HD13      LEU  13   7.832  -2.687   5.929
  114   1HD2  LEU  13          HD21      LEU  13   9.752  -4.013   6.140
  115   2HD2  LEU  13          HD22      LEU  13  10.932  -3.767   7.424
  116   3HD2  LEU  13          HD23      LEU  13  11.003  -2.783   5.962
  117    HA   PRO  14           HA       PRO  14  14.052   1.189  10.564
  118   1HB   PRO  14          HB2       PRO  14  14.201   3.275   8.541
  119   2HB   PRO  14          HB1       PRO  14  15.499   2.205   9.095
  120   1HG   PRO  14          HG2       PRO  14  13.878   2.035   6.668
  121   2HG   PRO  14          HG1       PRO  14  15.387   1.202   7.066
  122   1HD   PRO  14          HD2       PRO  14  12.899  -0.033   6.922
  123   2HD   PRO  14          HD1       PRO  14  14.287  -0.679   7.819
  124    H    ALA  15           HN       ALA  15  13.647   2.970  11.743
  125    HA   ALA  15           HA       ALA  15  11.029   3.580  12.416
  126   1HB   ALA  15          HB1       ALA  15  11.940   5.209  13.889
  127   2HB   ALA  15          HB2       ALA  15  13.400   5.365  12.910
  128   3HB   ALA  15          HB3       ALA  15  13.090   3.875  13.800
  129    H    GLY  16           HN       GLY  16  10.856   4.068   9.689
  130   1HA   GLY  16          HA2       GLY  16   9.734   6.679   9.607
  131   2HA   GLY  16          HA1       GLY  16  11.279   6.711   8.822
  132    H    ALA  17           HN       ALA  17  10.781   3.764   8.143
  133    HA   ALA  17           HA       ALA  17   9.948   4.289   5.477
  134   1HB   ALA  17          HB1       ALA  17  11.492   2.574   5.491
  135   2HB   ALA  17          HB2       ALA  17  10.010   1.619   5.467
  136   3HB   ALA  17          HB3       ALA  17  10.865   1.886   6.986
  137    H    ILE  18           HN       ILE  18   8.151   2.792   8.129
  138    HA   ILE  18           HA       ILE  18   6.039   1.873   6.517
  139    HB   ILE  18           HB       ILE  18   6.089   2.771   9.396
  140   1HG1  ILE  18          HG12      ILE  18   5.878   0.045   8.079
  141   2HG1  ILE  18          HG11      ILE  18   7.384   0.745   8.667
  142   1HG2  ILE  18          HG21      ILE  18   3.806   3.060   8.739
  143   2HG2  ILE  18          HG22      ILE  18   3.869   1.448   9.448
  144   3HG2  ILE  18          HG23      ILE  18   3.851   1.639   7.697
  145   1HD1  ILE  18          HD11      ILE  18   6.645   0.712  10.913
  146   2HD1  ILE  18          HD12      ILE  18   6.169  -0.845  10.242
  147   3HD1  ILE  18          HD13      ILE  18   4.973   0.423  10.444
  148    H    ASP  19           HN       ASP  19   6.462   4.981   8.218
  149    HA   ASP  19           HA       ASP  19   4.042   6.139   7.241
  150   1HB   ASP  19          HB2       ASP  19   5.402   7.127   9.134
  151   2HB   ASP  19          HB1       ASP  19   6.610   7.605   7.943
  152    H    ALA  20           HN       ALA  20   7.287   5.918   5.874
  153    HA   ALA  20           HA       ALA  20   6.699   7.638   3.718
  154   1HB   ALA  20          HB1       ALA  20   8.780   7.050   2.849
  155   2HB   ALA  20          HB2       ALA  20   8.664   5.386   3.421
  156   3HB   ALA  20          HB3       ALA  20   9.003   6.685   4.560
  157    H    LEU  21           HN       LEU  21   6.381   4.156   4.167
  158    HA   LEU  21           HA       LEU  21   5.676   3.451   1.567
  159   1HB   LEU  21          HB2       LEU  21   6.385   1.797   3.155
  160   2HB   LEU  21          HB1       LEU  21   5.097   2.232   4.271
  161    HG   LEU  21           HG       LEU  21   3.441   1.444   2.619
  162   1HD1  LEU  21          HD11      LEU  21   5.933   0.709   1.073
  163   2HD1  LEU  21          HD12      LEU  21   4.582   1.699   0.521
  164   3HD1  LEU  21          HD13      LEU  21   4.368  -0.032   0.755
  165   1HD2  LEU  21          HD21      LEU  21   4.389  -0.033   4.404
  166   2HD2  LEU  21          HD22      LEU  21   5.547  -0.637   3.220
  167   3HD2  LEU  21          HD23      LEU  21   3.822  -0.916   2.989
  168    H    ALA  22           HN       ALA  22   3.657   4.252   4.374
  169    HA   ALA  22           HA       ALA  22   1.136   3.952   3.093
  170   1HB   ALA  22          HB1       ALA  22   1.169   4.108   5.496
  171   2HB   ALA  22          HB2       ALA  22   0.357   5.555   4.896
  172   3HB   ALA  22          HB3       ALA  22   2.032   5.646   5.439
  173    H    GLY  23           HN       GLY  23   3.388   6.674   3.241
  174   1HA   GLY  23          HA2       GLY  23   1.617   8.507   1.936
  175   2HA   GLY  23          HA1       GLY  23   3.379   8.650   2.137
  176    H    GLU  24           HN       GLU  24   4.261   6.407   0.690
  177    HA   GLU  24           HA       GLU  24   3.949   7.359  -1.951
  178   1HB   GLU  24          HB2       GLU  24   5.977   6.121  -1.167
  179   2HB   GLU  24          HB1       GLU  24   5.015   4.653  -1.036
  180   1HG   GLU  24          HG2       GLU  24   6.166   4.562  -3.148
  181   2HG   GLU  24          HG1       GLU  24   4.476   4.898  -3.504
  182    H    LEU  25           HN       LEU  25   2.444   4.688  -0.207
  183    HA   LEU  25           HA       LEU  25   1.120   3.608  -2.452
  184   1HB   LEU  25          HB2       LEU  25   0.513   3.421   0.488
  185   2HB   LEU  25          HB1       LEU  25  -0.448   2.588  -0.728
  186    HG   LEU  25           HG       LEU  25   2.556   2.288  -0.448
  187   1HD1  LEU  25          HD11      LEU  25   0.322   0.484   0.531
  188   2HD1  LEU  25          HD12      LEU  25   1.378   1.454   1.552
  189   3HD1  LEU  25          HD13      LEU  25   2.043   0.118   0.616
  190   1HD2  LEU  25          HD21      LEU  25   2.132   1.528  -2.607
  191   2HD2  LEU  25          HD22      LEU  25   0.461   1.096  -2.250
  192   3HD2  LEU  25          HD23      LEU  25   1.777   0.050  -1.722
  193    H    SER  26           HN       SER  26   0.043   6.052  -0.120
  194    HA   SER  26           HA       SER  26  -2.624   6.215  -1.024
  195   1HB   SER  26          HB2       SER  26  -1.780   7.206   1.096
  196   2HB   SER  26          HB1       SER  26  -0.948   8.441   0.156
  197    HG   SER  26           HG       SER  26  -2.840   9.387   0.485
  198    H    ARG  27           HN       ARG  27   0.270   8.075  -2.031
  199    HA   ARG  27           HA       ARG  27  -1.088   9.778  -3.842
  200   1HB   ARG  27          HB2       ARG  27   1.753   8.722  -3.842
  201   2HB   ARG  27          HB1       ARG  27   1.164   9.939  -4.973
  202   1HG   ARG  27          HG2       ARG  27   0.595  11.431  -3.111
  203   2HG   ARG  27          HG1       ARG  27   1.123  10.208  -1.953
  204   1HD   ARG  27          HD2       ARG  27   2.892  11.884  -2.320
  205   2HD   ARG  27          HD1       ARG  27   3.401  10.294  -2.884
  206    HE   ARG  27           HE       ARG  27   2.325  11.475  -5.111
  207   1HH1  ARG  27          HH21      ARG  27   4.730  12.314  -2.770
  208   2HH1  ARG  27          HH22      ARG  27   5.676  13.255  -3.874
  209   1HH2  ARG  27          HH11      ARG  27   3.562  12.706  -6.568
  210   2HH2  ARG  27          HH12      ARG  27   5.015  13.478  -6.023
  211    H    ARG  28           HN       ARG  28   0.291   6.544  -4.201
  212    HA   ARG  28           HA       ARG  28  -0.125   6.279  -6.984
  213   1HB   ARG  28          HB2       ARG  28   0.069   4.239  -4.765
  214   2HB   ARG  28          HB1       ARG  28   0.000   3.818  -6.473
  215   1HG   ARG  28          HG2       ARG  28   2.058   5.780  -5.462
  216   2HG   ARG  28          HG1       ARG  28   2.342   4.047  -5.346
  217   1HD   ARG  28          HD2       ARG  28   1.883   3.906  -7.839
  218   2HD   ARG  28          HD1       ARG  28   1.887   5.665  -7.871
  219    HE   ARG  28           HE       ARG  28   4.243   5.086  -6.656
  220   1HH1  ARG  28          HH11      ARG  28   2.711   3.750  -9.457
  221   2HH1  ARG  28          HH12      ARG  28   4.187   3.558 -10.341
  222   1HH2  ARG  28          HH21      ARG  28   6.171   4.934  -7.856
  223   2HH2  ARG  28          HH22      ARG  28   6.143   4.229  -9.436
  224    H    ILE  29           HN       ILE  29  -2.166   5.525  -4.199
  225    HA   ILE  29           HA       ILE  29  -4.252   4.244  -5.637
  226    HB   ILE  29           HB       ILE  29  -4.167   5.596  -2.941
  227   1HG1  ILE  29          HG12      ILE  29  -2.941   3.471  -3.119
  228   2HG1  ILE  29          HG11      ILE  29  -4.363   3.274  -2.106
  229   1HG2  ILE  29          HG21      ILE  29  -6.443   5.852  -3.552
  230   2HG2  ILE  29          HG22      ILE  29  -6.398   4.382  -2.579
  231   3HG2  ILE  29          HG23      ILE  29  -6.497   4.273  -4.337
  232   1HD1  ILE  29          HD11      ILE  29  -3.774   2.133  -4.801
  233   2HD1  ILE  29          HD12      ILE  29  -5.452   2.548  -4.463
  234   3HD1  ILE  29          HD13      ILE  29  -4.601   1.403  -3.432
  235    H    GLN  30           HN       GLN  30  -3.802   7.581  -4.628
  236    HA   GLN  30           HA       GLN  30  -6.323   8.541  -5.595
  237   1HB   GLN  30          HB2       GLN  30  -3.704   9.979  -5.092
  238   2HB   GLN  30          HB1       GLN  30  -5.180  10.797  -5.595
  239   1HG   GLN  30          HG2       GLN  30  -6.335   9.973  -3.569
  240   2HG   GLN  30          HG1       GLN  30  -4.867   9.150  -3.054
  241   1HE2  GLN  30          HE21      GLN  30  -6.081  11.198  -1.465
  242   2HE2  GLN  30          HE22      GLN  30  -5.030  12.530  -1.428
  243    H    TYR  31           HN       TYR  31  -3.153   8.258  -7.241
  244    HA   TYR  31           HA       TYR  31  -4.072   9.619  -9.545
  245   1HB   TYR  31          HB2       TYR  31  -1.663   9.275  -9.114
  246   2HB   TYR  31          HB1       TYR  31  -1.880   7.533  -9.298
  247    HD1  TYR  31           HD1      TYR  31  -2.169  10.792 -11.072
  248    HD2  TYR  31           HD2      TYR  31  -1.966   6.517 -11.455
  249    HE1  TYR  31           HE1      TYR  31  -1.931  11.024 -13.528
  250    HE2  TYR  31           HE2      TYR  31  -1.726   6.751 -13.913
  251    HH   TYR  31           HH       TYR  31  -1.942   8.203 -15.650
  252    H    ALA  32           HN       ALA  32  -4.114   6.212  -8.594
  253    HA   ALA  32           HA       ALA  32  -5.065   5.254 -11.095
  254   1HB   ALA  32          HB1       ALA  32  -5.648   3.200  -9.774
  255   2HB   ALA  32          HB2       ALA  32  -5.142   4.064  -8.321
  256   3HB   ALA  32          HB3       ALA  32  -3.975   3.731  -9.599
  257    H    PHE  33           HN       PHE  33  -6.637   6.322  -8.127
  258    HA   PHE  33           HA       PHE  33  -9.304   6.025  -9.413
  259   1HB   PHE  33          HB2       PHE  33  -8.543   5.831  -6.498
  260   2HB   PHE  33          HB1       PHE  33 -10.192   5.790  -7.125
  261    HD1  PHE  33           HD1      PHE  33  -6.999   3.978  -6.898
  262    HD2  PHE  33           HD2      PHE  33 -11.005   3.896  -8.442
  263    HE1  PHE  33           HE1      PHE  33  -6.754   1.562  -7.404
  264    HE2  PHE  33           HE2      PHE  33 -10.762   1.479  -8.944
  265    HZ   PHE  33           HZ       PHE  33  -8.637   0.312  -8.426
  266    HA   PRO  34           HA       PRO  34  -8.652  10.537  -8.662
  267   1HB   PRO  34          HB2       PRO  34 -10.211  11.061 -11.049
  268   2HB   PRO  34          HB1       PRO  34  -8.492  11.364 -10.760
  269   1HG   PRO  34          HG2       PRO  34  -9.527   9.445 -12.485
  270   2HG   PRO  34          HG1       PRO  34  -7.874   9.481 -11.852
  271   1HD   PRO  34          HD2       PRO  34 -10.160   7.757 -11.030
  272   2HD   PRO  34          HD1       PRO  34  -8.411   7.445 -10.948
  273    H    ASP  35           HN       ASP  35 -11.529   8.688  -9.339
  274    HA   ASP  35           HA       ASP  35 -13.321  10.804  -8.378
  275   1HB   ASP  35          HB2       ASP  35 -15.116   9.342  -9.199
  276   2HB   ASP  35          HB1       ASP  35 -13.920   9.704 -10.441
  277    H    ASN  36           HN       ASN  36 -11.728   8.192  -6.846
  278    HA   ASN  36           HA       ASN  36 -13.968   7.973  -4.888
  279   1HB   ASN  36          HB2       ASN  36 -13.671   5.932  -6.175
  280   2HB   ASN  36          HB1       ASN  36 -11.989   5.846  -5.665
  281   1HD2  ASN  36          HD21      ASN  36 -11.533   5.158  -3.494
  282   2HD2  ASN  36          HD22      ASN  36 -12.743   4.574  -2.457
  283    H    GLU  37           HN       GLU  37 -13.378   8.550  -2.690
  284    HA   GLU  37           HA       GLU  37 -10.825   9.457  -2.007
  285   1HB   GLU  37          HB2       GLU  37 -13.169   8.447  -0.420
  286   2HB   GLU  37          HB1       GLU  37 -11.734   9.180   0.300
  287   1HG   GLU  37          HG2       GLU  37 -13.400  10.538  -1.835
  288   2HG   GLU  37          HG1       GLU  37 -13.647  10.785  -0.107
  289    H    GLY  38           HN       GLY  38  -9.032   8.221  -1.610
  290   1HA   GLY  38          HA2       GLY  38  -9.367   5.344  -0.861
  291   2HA   GLY  38          HA1       GLY  38  -8.020   5.866  -1.627
  292    H    HIS  39           HN       HIS  39  -8.824   4.871   1.384
  293    HA   HIS  39           HA       HIS  39  -6.926   6.742   2.661
  294   1HB   HIS  39          HB2       HIS  39  -9.229   5.150   3.812
  295   2HB   HIS  39          HB1       HIS  39  -7.998   5.922   4.812
  296    HD1  HIS  39           HD1      HIS  39 -10.861   6.705   2.509
  297    HD2  HIS  39           HD2      HIS  39  -8.136   8.759   4.902
  298    HE1  HIS  39           HE1      HIS  39 -11.688   9.096   2.648
  299    H    VAL  40           HN       VAL  40  -4.982   5.753   3.139
  300    HA   VAL  40           HA       VAL  40  -4.887   2.814   3.169
  301    HB   VAL  40           HB       VAL  40  -2.679   4.781   2.558
  302   1HG1  VAL  40          HG11      VAL  40  -1.589   2.732   1.649
  303   2HG1  VAL  40          HG12      VAL  40  -2.934   1.776   2.271
  304   3HG1  VAL  40          HG13      VAL  40  -1.872   2.636   3.386
  305   1HG2  VAL  40          HG21      VAL  40  -4.283   3.056   0.639
  306   2HG2  VAL  40          HG22      VAL  40  -3.058   4.253   0.222
  307   3HG2  VAL  40          HG23      VAL  40  -4.603   4.773   0.895
  308    H    SER  41           HN       SER  41  -4.269   1.842   4.970
  309    HA   SER  41           HA       SER  41  -2.807   3.397   7.030
  310   1HB   SER  41          HB2       SER  41  -5.035   3.133   7.918
  311   2HB   SER  41          HB1       SER  41  -5.083   1.435   7.454
  312    HG   SER  41           HG       SER  41  -3.534   0.998   8.993
  313    H    VAL  42           HN       VAL  42  -1.128   2.429   8.031
  314    HA   VAL  42           HA       VAL  42  -0.555  -0.376   7.312
  315    HB   VAL  42           HB       VAL  42   1.541   1.811   7.385
  316   1HG1  VAL  42          HG11      VAL  42   2.842  -0.003   6.154
  317   2HG1  VAL  42          HG12      VAL  42   1.545  -1.110   6.595
  318   3HG1  VAL  42          HG13      VAL  42   2.501  -0.328   7.852
  319   1HG2  VAL  42          HG21      VAL  42  -0.114   2.061   5.484
  320   2HG2  VAL  42          HG22      VAL  42   0.388   0.469   4.927
  321   3HG2  VAL  42          HG23      VAL  42   1.550   1.789   4.971
  322    H    ARG  43           HN       ARG  43  -0.097  -1.622   8.984
  323    HA   ARG  43           HA       ARG  43   1.129  -0.461  11.371
  324   1HB   ARG  43          HB2       ARG  43  -1.452  -2.036  11.585
  325   2HB   ARG  43          HB1       ARG  43  -0.568  -1.253  12.895
  326   1HG   ARG  43          HG2       ARG  43  -0.924   0.945  11.695
  327   2HG   ARG  43          HG1       ARG  43  -2.001   0.086  10.592
  328   1HD   ARG  43          HD2       ARG  43  -3.374   1.072  12.306
  329   2HD   ARG  43          HD1       ARG  43  -3.324  -0.663  12.609
  330    HE   ARG  43           HE       ARG  43  -1.259   0.672  14.057
  331   1HH1  ARG  43          HH11      ARG  43  -4.283   1.864  14.241
  332   2HH1  ARG  43          HH12      ARG  43  -4.672   1.283  15.826
  333   1HH2  ARG  43          HH21      ARG  43  -1.935  -0.834  16.017
  334   2HH2  ARG  43          HH22      ARG  43  -3.344  -0.240  16.831
  335    H    TYR  44           HN       TYR  44   1.852  -2.145  12.914
  336    HA   TYR  44           HA       TYR  44   2.775  -4.565  11.524
  337   1HB   TYR  44          HB2       TYR  44   3.216  -3.483  14.328
  338   2HB   TYR  44          HB1       TYR  44   3.766  -5.074  13.838
  339    HD1  TYR  44           HD1      TYR  44   5.058  -4.957  11.383
  340    HD2  TYR  44           HD2      TYR  44   4.872  -1.851  14.356
  341    HE1  TYR  44           HE1      TYR  44   7.191  -4.018  10.545
  342    HE2  TYR  44           HE2      TYR  44   6.998  -0.913  13.506
  343    HH   TYR  44           HH       TYR  44   9.129  -2.472  11.779
  344    H    ALA  45           HN       ALA  45   2.103  -6.589  11.833
  345    HA   ALA  45           HA       ALA  45   0.033  -7.137  13.843
  346   1HB   ALA  45          HB1       ALA  45  -0.296  -8.027  10.977
  347   2HB   ALA  45          HB2       ALA  45  -0.983  -6.509  11.558
  348   3HB   ALA  45          HB3       ALA  45  -1.492  -8.038  12.274
  349    H    ALA  46           HN       ALA  46  -0.347  -9.572  13.959
  350    HA   ALA  46           HA       ALA  46   2.141 -10.870  14.251
  351   1HB   ALA  46          HB1       ALA  46   0.906 -12.840  14.840
  352   2HB   ALA  46          HB2       ALA  46  -0.513 -12.297  13.944
  353   3HB   ALA  46          HB3       ALA  46  -0.046 -11.480  15.435
  354    H    ALA  47           HN       ALA  47  -0.002 -10.630  11.490
  355    HA   ALA  47           HA       ALA  47   2.013 -12.149   9.951
  356   1HB   ALA  47          HB1       ALA  47   0.156 -13.288   8.723
  357   2HB   ALA  47          HB2       ALA  47  -0.974 -12.623   9.902
  358   3HB   ALA  47          HB3       ALA  47   0.270 -13.759  10.418
  359    H    ASN  48           HN       ASN  48   2.159 -11.690   7.749
  360    HA   ASN  48           HA       ASN  48   1.524  -8.984   6.975
  361   1HB   ASN  48          HB2       ASN  48   3.501 -10.439   6.179
  362   2HB   ASN  48          HB1       ASN  48   2.336 -11.224   5.115
  363   1HD2  ASN  48          HD21      ASN  48   3.484 -10.291   3.228
  364   2HD2  ASN  48          HD22      ASN  48   3.279  -8.652   2.832
  365    H    ASN  49           HN       ASN  49  -0.370  -8.306   6.057
  366    HA   ASN  49           HA       ASN  49  -1.980 -10.132   4.451
  367   1HB   ASN  49          HB2       ASN  49  -2.901  -9.037   7.102
  368   2HB   ASN  49          HB1       ASN  49  -4.037  -9.489   5.835
  369   1HD2  ASN  49          HD21      ASN  49  -3.462 -10.795   8.535
  370   2HD2  ASN  49          HD22      ASN  49  -3.112 -12.410   8.154
  371    H    LEU  50           HN       LEU  50  -3.480  -9.065   3.131
  372    HA   LEU  50           HA       LEU  50  -3.379  -6.102   3.093
  373   1HB   LEU  50          HB2       LEU  50  -1.989  -7.057   1.272
  374   2HB   LEU  50          HB1       LEU  50  -3.366  -8.013   0.733
  375    HG   LEU  50           HG       LEU  50  -4.638  -5.936   0.292
  376   1HD1  LEU  50          HD11      LEU  50  -2.174  -4.662   1.435
  377   2HD1  LEU  50          HD12      LEU  50  -3.874  -4.301   1.742
  378   3HD1  LEU  50          HD13      LEU  50  -3.129  -3.798   0.229
  379   1HD2  LEU  50          HD21      LEU  50  -3.273  -6.938  -1.520
  380   2HD2  LEU  50          HD22      LEU  50  -1.894  -5.960  -1.014
  381   3HD2  LEU  50          HD23      LEU  50  -3.335  -5.182  -1.666
  382    H    SER  51           HN       SER  51  -5.464  -5.298   3.348
  383    HA   SER  51           HA       SER  51  -7.728  -7.035   2.509
  384   1HB   SER  51          HB2       SER  51  -7.511  -5.178   4.885
  385   2HB   SER  51          HB1       SER  51  -8.989  -5.986   4.369
  386    HG   SER  51           HG       SER  51  -8.280  -7.762   5.236
  387    H    VAL  52           HN       VAL  52  -9.142  -6.086   1.098
  388    HA   VAL  52           HA       VAL  52  -9.116  -3.147   0.838
  389    HB   VAL  52           HB       VAL  52  -9.435  -5.174  -1.391
  390   1HG1  VAL  52          HG11      VAL  52  -9.330  -3.013  -2.781
  391   2HG1  VAL  52          HG12      VAL  52  -9.657  -2.158  -1.276
  392   3HG1  VAL  52          HG13      VAL  52 -10.832  -3.310  -1.907
  393   1HG2  VAL  52          HG21      VAL  52  -7.336  -4.061  -2.226
  394   2HG2  VAL  52          HG22      VAL  52  -7.109  -4.966  -0.730
  395   3HG2  VAL  52          HG23      VAL  52  -7.236  -3.207  -0.686
  396    H    ILE  53           HN       ILE  53 -11.097  -2.261   1.206
  397    HA   ILE  53           HA       ILE  53 -13.497  -4.000   0.944
  398    HB   ILE  53           HB       ILE  53 -12.972  -1.782   2.935
  399   1HG1  ILE  53          HG12      ILE  53 -13.471  -4.701   3.562
  400   2HG1  ILE  53          HG11      ILE  53 -11.841  -4.122   3.213
  401   1HG2  ILE  53          HG21      ILE  53 -15.162  -2.726   3.899
  402   2HG2  ILE  53          HG22      ILE  53 -15.386  -3.495   2.328
  403   3HG2  ILE  53          HG23      ILE  53 -15.292  -1.737   2.444
  404   1HD1  ILE  53          HD11      ILE  53 -11.872  -2.621   5.062
  405   2HD1  ILE  53          HD12      ILE  53 -12.521  -4.142   5.674
  406   3HD1  ILE  53          HD13      ILE  53 -13.611  -2.813   5.282
  407    H    GLY  54           HN       GLY  54 -15.003  -3.319  -0.461
  408   1HA   GLY  54          HA2       GLY  54 -16.481  -1.687  -1.378
  409   2HA   GLY  54          HA1       GLY  54 -15.316  -0.435  -0.946
  410    H    ALA  55           HN       ALA  55 -13.957  -3.194  -2.531
  411    HA   ALA  55           HA       ALA  55 -13.895  -1.669  -5.087
  412   1HB   ALA  55          HB1       ALA  55 -11.628  -2.239  -5.409
  413   2HB   ALA  55          HB2       ALA  55 -11.664  -3.454  -4.130
  414   3HB   ALA  55          HB3       ALA  55 -11.730  -1.740  -3.720
  415    H    THR  56           HN       THR  56 -13.407  -2.898  -6.986
  416    HA   THR  56           HA       THR  56 -14.904  -5.437  -7.230
  417    HB   THR  56           HB       THR  56 -14.668  -4.979  -9.591
  418    HG1  THR  56           HG1      THR  56 -12.557  -3.991  -9.318
  419   1HG2  THR  56          HG21      THR  56 -15.456  -2.493  -8.047
  420   2HG2  THR  56          HG22      THR  56 -16.514  -3.848  -8.435
  421   3HG2  THR  56          HG23      THR  56 -15.882  -2.824  -9.725
  422    H    LYS  57           HN       LYS  57 -14.003  -7.186  -8.298
  423    HA   LYS  57           HA       LYS  57 -11.530  -8.039  -7.374
  424   1HB   LYS  57          HB2       LYS  57 -13.021  -8.957  -9.857
  425   2HB   LYS  57          HB1       LYS  57 -11.743  -9.854  -9.048
  426   1HG   LYS  57          HG2       LYS  57 -13.152 -10.017  -7.003
  427   2HG   LYS  57          HG1       LYS  57 -14.428  -9.111  -7.823
  428   1HD   LYS  57          HD2       LYS  57 -14.614 -10.868  -9.517
  429   2HD   LYS  57          HD1       LYS  57 -13.287 -11.757  -8.770
  430   1HE   LYS  57          HE2       LYS  57 -15.845 -11.045  -7.311
  431   2HE   LYS  57          HE1       LYS  57 -15.593 -12.585  -8.136
  432   1HZ   LYS  57          HZ1       LYS  57 -15.005 -12.868  -5.867
  433   2HZ   LYS  57          HZ2       LYS  57 -14.025 -11.481  -5.873
  434   3HZ   LYS  57          HZ3       LYS  57 -13.561 -12.856  -6.757
  435    H    GLU  58           HN       GLU  58 -12.252  -6.465 -10.540
  436    HA   GLU  58           HA       GLU  58  -9.613  -6.839 -11.550
  437   1HB   GLU  58          HB2       GLU  58 -11.553  -6.316 -12.998
  438   2HB   GLU  58          HB1       GLU  58 -11.671  -4.727 -12.244
  439   1HG   GLU  58          HG2       GLU  58  -9.412  -4.161 -13.033
  440   2HG   GLU  58          HG1       GLU  58  -9.244  -5.765 -13.742
  441    H    ASP  59           HN       ASP  59 -11.150  -4.303  -9.611
  442    HA   ASP  59           HA       ASP  59  -9.024  -2.451  -9.782
  443   1HB   ASP  59          HB2       ASP  59 -11.201  -2.864  -7.733
  444   2HB   ASP  59          HB1       ASP  59 -10.011  -1.569  -7.606
  445    H    LYS  60           HN       LYS  60  -9.841  -5.015  -7.517
  446    HA   LYS  60           HA       LYS  60  -7.680  -4.650  -5.714
  447   1HB   LYS  60          HB2       LYS  60  -9.302  -7.108  -6.445
  448   2HB   LYS  60          HB1       LYS  60  -8.129  -7.071  -5.130
  449   1HG   LYS  60          HG2       LYS  60  -9.393  -5.258  -4.042
  450   2HG   LYS  60          HG1       LYS  60 -10.568  -5.284  -5.359
  451   1HD   LYS  60          HD2       LYS  60 -11.059  -7.669  -4.833
  452   2HD   LYS  60          HD1       LYS  60  -9.953  -7.571  -3.463
  453   1HE   LYS  60          HE2       LYS  60 -11.366  -5.611  -2.635
  454   2HE   LYS  60          HE1       LYS  60 -12.547  -6.069  -3.859
  455   1HZ   LYS  60          HZ1       LYS  60 -12.746  -7.045  -1.498
  456   2HZ   LYS  60          HZ2       LYS  60 -11.499  -8.089  -1.991
  457   3HZ   LYS  60          HZ3       LYS  60 -12.976  -8.070  -2.830
  458    H    GLN  61           HN       GLN  61  -7.863  -6.568  -8.735
  459    HA   GLN  61           HA       GLN  61  -5.295  -7.746  -8.351
  460   1HB   GLN  61          HB2       GLN  61  -6.927  -7.187 -10.843
  461   2HB   GLN  61          HB1       GLN  61  -5.392  -8.057 -10.861
  462   1HG   GLN  61          HG2       GLN  61  -6.308  -9.744  -9.333
  463   2HG   GLN  61          HG1       GLN  61  -7.835  -8.868  -9.257
  464   1HE2  GLN  61          HE21      GLN  61  -7.526 -11.613 -10.258
  465   2HE2  GLN  61          HE22      GLN  61  -7.985 -11.590 -11.894
  466    H    ARG  62           HN       ARG  62  -6.441  -4.756  -9.956
  467    HA   ARG  62           HA       ARG  62  -3.936  -3.988 -10.935
  468   1HB   ARG  62          HB2       ARG  62  -6.023  -2.901 -11.680
  469   2HB   ARG  62          HB1       ARG  62  -6.267  -2.241 -10.065
  470   1HG   ARG  62          HG2       ARG  62  -4.281  -0.873 -10.251
  471   2HG   ARG  62          HG1       ARG  62  -3.834  -1.640 -11.776
  472   1HD   ARG  62          HD2       ARG  62  -4.876   0.521 -12.224
  473   2HD   ARG  62          HD1       ARG  62  -5.920  -0.775 -12.802
  474    HE   ARG  62           HE       ARG  62  -6.670  -0.125 -10.162
  475   1HH1  ARG  62          HH11      ARG  62  -6.040   2.297 -12.302
  476   2HH1  ARG  62          HH12      ARG  62  -7.673   2.829 -12.521
  477   1HH2  ARG  62          HH21      ARG  62  -9.061   0.096 -10.899
  478   2HH2  ARG  62          HH22      ARG  62  -9.385   1.583 -11.727
  479    H    ILE  63           HN       ILE  63  -5.527  -3.271  -7.863
  480    HA   ILE  63           HA       ILE  63  -3.450  -1.652  -6.863
  481    HB   ILE  63           HB       ILE  63  -5.489  -3.305  -5.401
  482   1HG1  ILE  63          HG12      ILE  63  -5.315  -0.297  -5.623
  483   2HG1  ILE  63          HG11      ILE  63  -6.131  -1.256  -6.855
  484   1HG2  ILE  63          HG21      ILE  63  -4.841  -1.734  -3.463
  485   2HG2  ILE  63          HG22      ILE  63  -3.369  -1.414  -4.381
  486   3HG2  ILE  63          HG23      ILE  63  -3.724  -3.050  -3.827
  487   1HD1  ILE  63          HD11      ILE  63  -7.701  -0.423  -5.113
  488   2HD1  ILE  63          HD12      ILE  63  -6.797  -1.326  -3.898
  489   3HD1  ILE  63          HD13      ILE  63  -7.650  -2.184  -5.181
  490    H    SER  64           HN       SER  64  -3.878  -5.162  -6.668
  491    HA   SER  64           HA       SER  64  -1.589  -5.640  -5.047
  492   1HB   SER  64          HB2       SER  64  -2.814  -7.376  -7.212
  493   2HB   SER  64          HB1       SER  64  -1.588  -7.916  -6.068
  494    HG   SER  64           HG       SER  64  -4.030  -8.154  -5.636
  495    H    GLU  65           HN       GLU  65  -1.988  -5.252  -8.627
  496    HA   GLU  65           HA       GLU  65   0.715  -5.796  -9.235
  497   1HB   GLU  65          HB2       GLU  65  -1.378  -4.171 -10.703
  498   2HB   GLU  65          HB1       GLU  65   0.233  -4.489 -11.352
  499   1HG   GLU  65          HG2       GLU  65  -0.168  -6.914 -11.187
  500   2HG   GLU  65          HG1       GLU  65  -1.777  -6.608 -10.530
  501    H    ILE  66           HN       ILE  66  -0.966  -2.777  -8.452
  502    HA   ILE  66           HA       ILE  66   1.216  -1.061  -8.886
  503    HB   ILE  66           HB       ILE  66  -1.134  -0.827  -6.997
  504   1HG1  ILE  66          HG12      ILE  66  -0.494   0.533  -9.634
  505   2HG1  ILE  66          HG11      ILE  66  -1.532  -0.883  -9.483
  506   1HG2  ILE  66          HG21      ILE  66  -0.496   1.636  -7.015
  507   2HG2  ILE  66          HG22      ILE  66   1.050   1.155  -7.707
  508   3HG2  ILE  66          HG23      ILE  66   0.593   0.602  -6.095
  509   1HD1  ILE  66          HD11      ILE  66  -1.993   1.851  -8.262
  510   2HD1  ILE  66          HD12      ILE  66  -2.968   0.432  -7.887
  511   3HD1  ILE  66          HD13      ILE  66  -2.948   1.080  -9.528
  512    H    LEU  67           HN       LEU  67   0.181  -2.777  -5.969
  513    HA   LEU  67           HA       LEU  67   2.178  -1.773  -4.260
  514   1HB   LEU  67          HB2       LEU  67   0.327  -2.961  -3.268
  515   2HB   LEU  67          HB1       LEU  67   0.612  -4.370  -4.277
  516    HG   LEU  67           HG       LEU  67   2.832  -4.691  -3.088
  517   1HD1  LEU  67          HD11      LEU  67   1.752  -2.336  -1.530
  518   2HD1  LEU  67          HD12      LEU  67   3.391  -2.617  -2.123
  519   3HD1  LEU  67          HD13      LEU  67   2.791  -3.521  -0.739
  520   1HD2  LEU  67          HD21      LEU  67   0.264  -4.710  -1.472
  521   2HD2  LEU  67          HD22      LEU  67   1.745  -5.535  -0.984
  522   3HD2  LEU  67          HD23      LEU  67   0.906  -6.024  -2.457
  523    H    GLN  68           HN       GLN  68   2.109  -4.492  -6.511
  524    HA   GLN  68           HA       GLN  68   4.678  -5.508  -5.833
  525   1HB   GLN  68          HB2       GLN  68   3.023  -5.685  -8.355
  526   2HB   GLN  68          HB1       GLN  68   4.597  -6.459  -8.190
  527   1HG   GLN  68          HG2       GLN  68   3.827  -7.800  -6.343
  528   2HG   GLN  68          HG1       GLN  68   2.311  -6.904  -6.256
  529   1HE2  GLN  68          HE21      GLN  68   2.415  -9.770  -6.662
  530   2HE2  GLN  68          HE22      GLN  68   1.796 -10.092  -8.209
  531    H    GLU  69           HN       GLU  69   3.727  -3.277  -8.524
  532    HA   GLU  69           HA       GLU  69   6.336  -2.858  -9.419
  533   1HB   GLU  69          HB2       GLU  69   3.877  -1.114  -9.571
  534   2HB   GLU  69          HB1       GLU  69   5.389  -0.712 -10.386
  535   1HG   GLU  69          HG2       GLU  69   5.310  -2.828 -11.621
  536   2HG   GLU  69          HG1       GLU  69   3.829  -3.283 -10.779
  537    H    THR  70           HN       THR  70   4.512  -0.917  -7.025
  538    HA   THR  70           HA       THR  70   6.461   1.077  -6.690
  539    HB   THR  70           HB       THR  70   4.510  -0.014  -4.692
  540    HG1  THR  70           HG1      THR  70   4.211   2.410  -6.007
  541   1HG2  THR  70          HG21      THR  70   6.188   2.495  -4.716
  542   2HG2  THR  70          HG22      THR  70   6.195   1.213  -3.503
  543   3HG2  THR  70          HG23      THR  70   4.795   2.275  -3.658
  544    H    TRP  71           HN       TRP  71   5.884  -1.906  -4.991
  545    HA   TRP  71           HA       TRP  71   7.938  -1.806  -3.153
  546   1HB   TRP  71          HB2       TRP  71   5.970  -3.286  -3.148
  547   2HB   TRP  71          HB1       TRP  71   6.665  -4.177  -4.487
  548    HD1  TRP  71           HD1      TRP  71   7.443  -6.400  -3.595
  549    HE1  TRP  71           HE1      TRP  71   8.739  -7.245  -1.544
  550    HE3  TRP  71           HE3      TRP  71   7.942  -2.023  -0.944
  551    HZ2  TRP  71           HZ2      TRP  71   9.817  -6.239   0.887
  552    HZ3  TRP  71           HZ3      TRP  71   9.096  -2.026   1.237
  553    HH2  TRP  71           HH2      TRP  71  10.030  -4.125   2.160
  554    H    GLU  72           HN       GLU  72   7.926  -2.998  -6.461
  555    HA   GLU  72           HA       GLU  72  10.630  -3.925  -6.354
  556   1HB   GLU  72          HB2       GLU  72   8.772  -3.459  -8.691
  557   2HB   GLU  72          HB1       GLU  72  10.419  -4.055  -8.883
  558   1HG   GLU  72          HG2       GLU  72   9.898  -5.967  -7.412
  559   2HG   GLU  72          HG1       GLU  72   8.250  -5.371  -7.226
  560    H    SER  73           HN       SER  73   9.284  -0.762  -6.801
  561    HA   SER  73           HA       SER  73  11.829   0.144  -8.022
  562   1HB   SER  73          HB2       SER  73   9.061   1.338  -7.980
  563   2HB   SER  73          HB1       SER  73  10.480   2.282  -8.432
  564    HG   SER  73           HG       SER  73   9.350   0.015  -9.669
  565    H    ALA  74           HN       ALA  74  11.204  -0.468  -5.103
  566    HA   ALA  74           HA       ALA  74  10.964   1.686  -3.494
  567   1HB   ALA  74          HB1       ALA  74  12.136   0.382  -1.822
  568   2HB   ALA  74          HB2       ALA  74  12.775  -0.677  -3.078
  569   3HB   ALA  74          HB3       ALA  74  11.040  -0.633  -2.761
  570    H    ASP  75           HN       ASP  75  14.000   0.732  -5.063
  571    HA   ASP  75           HA       ASP  75  15.678   2.393  -3.495
  572   1HB   ASP  75          HB2       ASP  75  15.997   1.241  -6.260
  573   2HB   ASP  75          HB1       ASP  75  17.262   2.157  -5.443
  574    H    ASP  76           HN       ASP  76  13.477   3.212  -6.062
  575    HA   ASP  76           HA       ASP  76  14.872   5.732  -6.659
  576   1HB   ASP  76          HB2       ASP  76  12.410   4.399  -7.789
  577   2HB   ASP  76          HB1       ASP  76  12.898   6.032  -8.237
  578    H    TRP  77           HN       TRP  77  11.736   4.749  -5.227
  579    HA   TRP  77           HA       TRP  77  11.194   7.583  -4.619
  580   1HB   TRP  77          HB2       TRP  77   8.984   6.996  -4.166
  581   2HB   TRP  77          HB1       TRP  77   9.448   6.026  -5.549
  582    HD1  TRP  77           HD1      TRP  77   9.424   3.406  -5.269
  583    HE1  TRP  77           HE1      TRP  77   8.741   1.826  -3.380
  584    HE3  TRP  77           HE3      TRP  77   9.007   6.744  -1.321
  585    HZ2  TRP  77           HZ2      TRP  77   8.113   1.908  -0.624
  586    HZ3  TRP  77           HZ3      TRP  77   8.361   5.905   0.885
  587    HH2  TRP  77           HH2      TRP  77   7.923   3.512   1.243
  588    H    PHE  78           HN       PHE  78  12.400   4.835  -2.840
  589    HA   PHE  78           HA       PHE  78  11.577   6.040  -0.283
  590   1HB   PHE  78          HB2       PHE  78  11.485   3.627  -0.340
  591   2HB   PHE  78          HB1       PHE  78  13.145   3.535  -0.903
  592    HD1  PHE  78           HD1      PHE  78  11.295   5.266   1.892
  593    HD2  PHE  78           HD2      PHE  78  14.730   2.926   0.741
  594    HE1  PHE  78           HE1      PHE  78  12.108   5.283   4.230
  595    HE2  PHE  78           HE2      PHE  78  15.523   2.952   3.079
  596    HZ   PHE  78           HZ       PHE  78  14.218   4.128   4.824
  597    H    VAL  79           HN       VAL  79  12.728   7.377   0.843
  598    HA   VAL  79           HA       VAL  79  15.608   7.709   0.240
  599    HB   VAL  79           HB       VAL  79  13.858   9.931   1.301
  600   1HG1  VAL  79          HG11      VAL  79  16.176  10.051  -0.634
  601   2HG1  VAL  79          HG12      VAL  79  16.420  10.015   1.113
  602   3HG1  VAL  79          HG13      VAL  79  15.526  11.343   0.374
  603   1HG2  VAL  79          HG21      VAL  79  13.439  10.629  -1.057
  604   2HG2  VAL  79          HG22      VAL  79  12.644   9.099  -0.672
  605   3HG2  VAL  79          HG23      VAL  79  14.140   9.110  -1.612
  606    H    SER  80           HN       SER  80  16.991   7.758   2.124
  607    HA   SER  80           HA       SER  80  15.609   7.580   4.750
  608   1HB   SER  80          HB2       SER  80  17.373   6.024   5.442
  609   2HB   SER  80          HB1       SER  80  16.578   5.394   3.997
  610    HG   SER  80           HG       SER  80  18.663   5.275   3.474
  611    H    GLU  81           HN       GLU  81  16.410   8.772   6.365
  612    HA   GLU  81           HA       GLU  81  17.883  11.091   5.852
  613   1HB   GLU  81          HB2       GLU  81  16.390  10.758   7.806
  614   2HB   GLU  81          HB1       GLU  81  17.576   9.652   8.498
  615   1HG   GLU  81          HG2       GLU  81  19.254  11.462   8.525
  616   2HG   GLU  81          HG1       GLU  81  18.073  12.568   7.829
  Start of MODEL    5
    1   1H    MET   1          HT1       MET   1 -14.492   4.233   0.330
    2   2H    MET   1          HT2       MET   1 -14.843   3.956  -1.310
    3   3H    MET   1          HT3       MET   1 -13.455   4.831  -0.870
    4    HA   MET   1           HA       MET   1 -13.968   1.965  -0.316
    5   1HB   MET   1          HB2       MET   1 -13.462   2.441  -2.674
    6   2HB   MET   1          HB1       MET   1 -12.029   3.348  -2.197
    7   1HG   MET   1          HG2       MET   1 -11.000   1.359  -1.278
    8   2HG   MET   1          HG1       MET   1 -12.479   0.431  -1.515
    9   1HE   MET   1          HE1       MET   1  -9.370   1.955  -2.836
   10   2HE   MET   1          HE2       MET   1 -10.369   2.985  -3.857
   11   3HE   MET   1          HE3       MET   1  -9.367   1.737  -4.591
   12    H    ARG   2           HN       ARG   2 -12.452   1.005   1.066
   13    HA   ARG   2           HA       ARG   2 -10.386   2.788   2.244
   14   1HB   ARG   2          HB2       ARG   2 -12.202   0.825   3.650
   15   2HB   ARG   2          HB1       ARG   2 -10.752   1.507   4.389
   16   1HG   ARG   2          HG2       ARG   2 -11.625   3.777   4.064
   17   2HG   ARG   2          HG1       ARG   2 -13.062   3.125   3.274
   18   1HD   ARG   2          HD2       ARG   2 -13.613   3.601   5.584
   19   2HD   ARG   2          HD1       ARG   2 -13.570   1.854   5.368
   20    HE   ARG   2           HE       ARG   2 -11.029   2.513   6.195
   21   1HH1  ARG   2          HH11      ARG   2 -13.016   0.884   7.834
   22   2HH1  ARG   2          HH12      ARG   2 -13.111   1.814   9.293
   23   1HH2  ARG   2          HH21      ARG   2 -11.687   4.647   7.894
   24   2HH2  ARG   2          HH22      ARG   2 -12.358   3.942   9.327
   25    H    ILE   3           HN       ILE   3  -8.396   1.991   2.349
   26    HA   ILE   3           HA       ILE   3  -7.948  -0.867   1.632
   27    HB   ILE   3           HB       ILE   3  -6.230   1.556   1.093
   28   1HG1  ILE   3          HG12      ILE   3  -7.516  -0.232  -0.978
   29   2HG1  ILE   3          HG11      ILE   3  -8.429   1.103  -0.270
   30   1HG2  ILE   3          HG21      ILE   3  -5.862  -1.401   0.611
   31   2HG2  ILE   3          HG22      ILE   3  -4.760  -0.275   1.401
   32   3HG2  ILE   3          HG23      ILE   3  -5.001  -0.193  -0.343
   33   1HD1  ILE   3          HD11      ILE   3  -5.664   1.622  -1.330
   34   2HD1  ILE   3          HD12      ILE   3  -7.032   2.725  -1.187
   35   3HD1  ILE   3          HD13      ILE   3  -7.016   1.501  -2.455
   36    H    GLU   4           HN       GLU   4  -6.993  -2.022   3.226
   37    HA   GLU   4           HA       GLU   4  -5.290  -0.599   5.208
   38   1HB   GLU   4          HB2       GLU   4  -7.139  -2.947   5.722
   39   2HB   GLU   4          HB1       GLU   4  -6.041  -2.239   6.904
   40   1HG   GLU   4          HG2       GLU   4  -7.202  -0.075   6.689
   41   2HG   GLU   4          HG1       GLU   4  -8.305  -0.782   5.508
   42    H    VAL   5           HN       VAL   5  -3.297  -1.283   5.403
   43    HA   VAL   5           HA       VAL   5  -2.566  -3.950   4.294
   44    HB   VAL   5           HB       VAL   5  -0.847  -1.467   4.394
   45   1HG1  VAL   5          HG11      VAL   5  -0.553  -4.194   3.117
   46   2HG1  VAL   5          HG12      VAL   5   0.501  -3.448   4.318
   47   3HG1  VAL   5          HG13      VAL   5   0.453  -2.816   2.672
   48   1HG2  VAL   5          HG21      VAL   5  -2.623  -2.596   2.224
   49   2HG2  VAL   5          HG22      VAL   5  -1.261  -1.542   1.853
   50   3HG2  VAL   5          HG23      VAL   5  -2.587  -0.951   2.855
   51    H    THR   6           HN       THR   6  -1.467  -5.321   5.567
   52    HA   THR   6           HA       THR   6  -0.367  -4.292   8.130
   53    HB   THR   6           HB       THR   6  -0.884  -6.611   9.010
   54    HG1  THR   6           HG1      THR   6  -1.255  -7.329   6.735
   55   1HG2  THR   6          HG21      THR   6  -3.099  -4.737   8.149
   56   2HG2  THR   6          HG22      THR   6  -2.251  -4.755   9.696
   57   3HG2  THR   6          HG23      THR   6  -3.345  -6.073   9.274
   58    H    ILE   7           HN       ILE   7   1.631  -4.796   8.584
   59    HA   ILE   7           HA       ILE   7   3.126  -6.633   6.799
   60    HB   ILE   7           HB       ILE   7   3.808  -4.042   8.167
   61   1HG1  ILE   7          HG12      ILE   7   4.299  -4.977   5.320
   62   2HG1  ILE   7          HG11      ILE   7   2.821  -4.158   5.826
   63   1HG2  ILE   7          HG21      ILE   7   6.185  -4.569   7.163
   64   2HG2  ILE   7          HG22      ILE   7   5.662  -6.253   7.248
   65   3HG2  ILE   7          HG23      ILE   7   5.744  -5.279   8.715
   66   1HD1  ILE   7          HD11      ILE   7   4.227  -2.261   6.663
   67   2HD1  ILE   7          HD12      ILE   7   4.348  -2.502   4.921
   68   3HD1  ILE   7          HD13      ILE   7   5.642  -3.061   5.982
   69    H    ALA   8           HN       ALA   8   4.156  -8.333   7.749
   70    HA   ALA   8           HA       ALA   8   3.635  -9.006  10.438
   71   1HB   ALA   8          HB1       ALA   8   4.035 -10.788   8.923
   72   2HB   ALA   8          HB2       ALA   8   5.443 -10.772   9.983
   73   3HB   ALA   8          HB3       ALA   8   5.548 -10.074   8.365
   74    H    LYS   9           HN       LYS   9   4.607  -8.598  12.177
   75    HA   LYS   9           HA       LYS   9   6.560  -6.633  12.461
   76   1HB   LYS   9          HB2       LYS   9   4.941  -7.154  14.249
   77   2HB   LYS   9          HB1       LYS   9   5.675  -8.733  14.470
   78   1HG   LYS   9          HG2       LYS   9   7.794  -7.661  15.177
   79   2HG   LYS   9          HG1       LYS   9   7.065  -6.068  14.961
   80   1HD   LYS   9          HD2       LYS   9   5.456  -6.480  16.697
   81   2HD   LYS   9          HD1       LYS   9   5.926  -8.177  16.806
   82   1HE   LYS   9          HE2       LYS   9   6.921  -6.784  18.625
   83   2HE   LYS   9          HE1       LYS   9   8.142  -7.553  17.613
   84   1HZ   LYS   9          HZ1       LYS   9   8.511  -5.547  16.454
   85   2HZ   LYS   9          HZ2       LYS   9   8.506  -5.140  18.104
   86   3HZ   LYS   9          HZ3       LYS   9   7.149  -4.802  17.139
   87    H    THR  10           HN       THR  10   6.944 -10.038  11.977
   88    HA   THR  10           HA       THR  10   9.558 -10.376  13.017
   89    HB   THR  10           HB       THR  10   9.652 -12.241  11.297
   90    HG1  THR  10           HG1      THR  10   7.996 -12.499   9.975
   91   1HG2  THR  10          HG21      THR  10   8.847 -12.579  13.608
   92   2HG2  THR  10          HG22      THR  10   7.955 -13.586  12.468
   93   3HG2  THR  10          HG23      THR  10   7.221 -12.116  13.107
   94    H    SER  11           HN       SER  11   8.399  -8.434  10.506
   95    HA   SER  11           HA       SER  11  11.110  -8.232   9.296
   96   1HB   SER  11          HB2       SER  11   8.412  -7.890   7.969
   97   2HB   SER  11          HB1       SER  11   9.963  -7.552   7.206
   98    HG   SER  11           HG       SER  11  10.053  -9.969   8.330
   99    HA   PRO  12           HA       PRO  12   9.931  -4.057  11.025
  100   1HB   PRO  12          HB2       PRO  12  12.580  -3.866  12.153
  101   2HB   PRO  12          HB1       PRO  12  11.046  -4.029  13.025
  102   1HG   PRO  12          HG2       PRO  12  13.027  -5.959  12.945
  103   2HG   PRO  12          HG1       PRO  12  11.327  -6.265  13.333
  104   1HD   PRO  12          HD2       PRO  12  12.791  -6.750  10.761
  105   2HD   PRO  12          HD1       PRO  12  11.480  -7.682  11.511
  106    H    LEU  13           HN       LEU  13  10.085  -2.247  10.071
  107    HA   LEU  13           HA       LEU  13  12.238  -1.916   8.066
  108   1HB   LEU  13          HB2       LEU  13   9.611  -0.427   8.140
  109   2HB   LEU  13          HB1       LEU  13  10.728  -0.609   6.787
  110    HG   LEU  13           HG       LEU  13   9.127  -2.852   8.064
  111   1HD1  LEU  13          HD11      LEU  13   8.058  -2.927   5.767
  112   2HD1  LEU  13          HD12      LEU  13   8.822  -1.374   5.436
  113   3HD1  LEU  13          HD13      LEU  13   7.638  -1.517   6.737
  114   1HD2  LEU  13          HD21      LEU  13   9.996  -4.082   5.965
  115   2HD2  LEU  13          HD22      LEU  13  11.144  -3.826   7.277
  116   3HD2  LEU  13          HD23      LEU  13  11.190  -2.791   5.852
  117    HA   PRO  14           HA       PRO  14  14.050   1.234  10.495
  118   1HB   PRO  14          HB2       PRO  14  14.185   3.293   8.442
  119   2HB   PRO  14          HB1       PRO  14  15.495   2.271   9.054
  120   1HG   PRO  14          HG2       PRO  14  13.949   2.004   6.589
  121   2HG   PRO  14          HG1       PRO  14  15.460   1.210   7.051
  122   1HD   PRO  14          HD2       PRO  14  13.000  -0.075   6.864
  123   2HD   PRO  14          HD1       PRO  14  14.372  -0.673   7.820
  124    H    ALA  15           HN       ALA  15  13.635   3.020  11.644
  125    HA   ALA  15           HA       ALA  15  11.011   3.618  12.316
  126   1HB   ALA  15          HB1       ALA  15  13.043   3.956  13.713
  127   2HB   ALA  15          HB2       ALA  15  11.919   5.314  13.739
  128   3HB   ALA  15          HB3       ALA  15  13.392   5.406  12.775
  129    H    GLY  16           HN       GLY  16  10.821   4.043   9.591
  130   1HA   GLY  16          HA2       GLY  16   9.723   6.663   9.444
  131   2HA   GLY  16          HA1       GLY  16  11.259   6.645   8.636
  132    H    ALA  17           HN       ALA  17  10.697   3.683   8.068
  133    HA   ALA  17           HA       ALA  17   9.823   4.117   5.395
  134   1HB   ALA  17          HB1       ALA  17   9.909   1.526   5.358
  135   2HB   ALA  17          HB2       ALA  17  10.581   1.693   6.980
  136   3HB   ALA  17          HB3       ALA  17  11.414   2.414   5.607
  137    H    ILE  18           HN       ILE  18   8.037   2.787   8.131
  138    HA   ILE  18           HA       ILE  18   5.892   1.827   6.591
  139    HB   ILE  18           HB       ILE  18   5.969   2.976   9.390
  140   1HG1  ILE  18          HG12      ILE  18   7.173   0.744   8.675
  141   2HG1  ILE  18          HG11      ILE  18   6.214   0.781  10.147
  142   1HG2  ILE  18          HG21      ILE  18   3.743   1.692   9.601
  143   2HG2  ILE  18          HG22      ILE  18   3.697   1.733   7.839
  144   3HG2  ILE  18          HG23      ILE  18   3.708   3.239   8.755
  145   1HD1  ILE  18          HD11      ILE  18   4.949  -0.036   7.538
  146   2HD1  ILE  18          HD12      ILE  18   4.440  -0.416   9.180
  147   3HD1  ILE  18          HD13      ILE  18   5.865  -1.197   8.496
  148    H    ASP  19           HN       ASP  19   6.436   4.980   8.132
  149    HA   ASP  19           HA       ASP  19   4.059   6.180   7.147
  150   1HB   ASP  19          HB2       ASP  19   6.684   7.399   8.054
  151   2HB   ASP  19          HB1       ASP  19   5.276   8.358   7.597
  152    H    ALA  20           HN       ALA  20   7.300   5.915   5.732
  153    HA   ALA  20           HA       ALA  20   6.693   7.632   3.575
  154   1HB   ALA  20          HB1       ALA  20   8.642   5.354   3.292
  155   2HB   ALA  20          HB2       ALA  20   9.006   6.704   4.364
  156   3HB   ALA  20          HB3       ALA  20   8.748   6.991   2.642
  157    H    LEU  21           HN       LEU  21   6.342   4.150   4.015
  158    HA   LEU  21           HA       LEU  21   5.602   3.469   1.422
  159   1HB   LEU  21          HB2       LEU  21   6.308   1.805   3.006
  160   2HB   LEU  21          HB1       LEU  21   5.022   2.240   4.123
  161    HG   LEU  21           HG       LEU  21   3.360   1.453   2.482
  162   1HD1  LEU  21          HD11      LEU  21   5.833   0.713   0.904
  163   2HD1  LEU  21          HD12      LEU  21   4.493   1.729   0.374
  164   3HD1  LEU  21          HD13      LEU  21   4.253   0.000   0.593
  165   1HD2  LEU  21          HD21      LEU  21   4.013  -1.001   2.631
  166   2HD2  LEU  21          HD22      LEU  21   4.033  -0.121   4.160
  167   3HD2  LEU  21          HD23      LEU  21   5.544  -0.459   3.317
  168    H    ALA  22           HN       ALA  22   3.597   4.259   4.245
  169    HA   ALA  22           HA       ALA  22   1.057   4.003   2.985
  170   1HB   ALA  22          HB1       ALA  22   0.336   5.619   4.834
  171   2HB   ALA  22          HB2       ALA  22   2.012   5.569   5.382
  172   3HB   ALA  22          HB3       ALA  22   1.050   4.093   5.357
  173    H    GLY  23           HN       GLY  23   3.261   6.791   3.240
  174   1HA   GLY  23          HA2       GLY  23   1.457   8.631   1.997
  175   2HA   GLY  23          HA1       GLY  23   3.223   8.784   2.183
  176    H    GLU  24           HN       GLU  24   4.083   6.571   0.683
  177    HA   GLU  24           HA       GLU  24   3.741   7.574  -1.934
  178   1HB   GLU  24          HB2       GLU  24   5.765   6.297  -1.212
  179   2HB   GLU  24          HB1       GLU  24   4.784   4.835  -1.102
  180   1HG   GLU  24          HG2       GLU  24   4.202   5.081  -3.520
  181   2HG   GLU  24          HG1       GLU  24   5.262   6.487  -3.606
  182    H    LEU  25           HN       LEU  25   2.305   4.792  -0.257
  183    HA   LEU  25           HA       LEU  25   0.948   3.769  -2.501
  184   1HB   LEU  25          HB2       LEU  25   0.355   3.535   0.446
  185   2HB   LEU  25          HB1       LEU  25  -0.576   2.695  -0.792
  186    HG   LEU  25           HG       LEU  25   2.428   2.440  -0.436
  187   1HD1  LEU  25          HD11      LEU  25   1.885   0.185   0.472
  188   2HD1  LEU  25          HD12      LEU  25   0.171   0.593   0.399
  189   3HD1  LEU  25          HD13      LEU  25   1.242   1.481   1.480
  190   1HD2  LEU  25          HD21      LEU  25   0.437   1.306  -2.381
  191   2HD2  LEU  25          HD22      LEU  25   1.732   0.240  -1.834
  192   3HD2  LEU  25          HD23      LEU  25   2.124   1.757  -2.636
  193    H    SER  26           HN       SER  26  -0.084   6.171  -0.099
  194    HA   SER  26           HA       SER  26  -2.762   6.366  -0.946
  195   1HB   SER  26          HB2       SER  26  -0.956   8.451   0.291
  196   2HB   SER  26          HB1       SER  26  -2.695   8.642   0.080
  197    HG   SER  26           HG       SER  26  -2.753   7.669   1.951
  198    H    ARG  27           HN       ARG  27   0.120   8.204  -2.026
  199    HA   ARG  27           HA       ARG  27  -1.269   9.900  -3.817
  200   1HB   ARG  27          HB2       ARG  27   1.069  10.309  -3.135
  201   2HB   ARG  27          HB1       ARG  27   1.576   8.862  -4.005
  202   1HG   ARG  27          HG2       ARG  27   0.798   9.834  -6.123
  203   2HG   ARG  27          HG1       ARG  27   0.215  11.263  -5.270
  204   1HD   ARG  27          HD2       ARG  27   3.100  10.341  -5.269
  205   2HD   ARG  27          HD1       ARG  27   2.460  11.575  -6.350
  206    HE   ARG  27           HE       ARG  27   3.084  11.900  -3.554
  207   1HH1  ARG  27          HH11      ARG  27   2.306  13.489  -6.399
  208   2HH1  ARG  27          HH12      ARG  27   1.501  14.830  -5.654
  209   1HH2  ARG  27          HH21      ARG  27   1.521  13.420  -2.486
  210   2HH2  ARG  27          HH22      ARG  27   1.051  14.788  -3.437
  211    H    ARG  28           HN       ARG  28   0.119   6.664  -4.275
  212    HA   ARG  28           HA       ARG  28  -0.336   6.465  -7.057
  213   1HB   ARG  28          HB2       ARG  28  -0.158   4.375  -4.886
  214   2HB   ARG  28          HB1       ARG  28  -0.271   3.987  -6.603
  215   1HG   ARG  28          HG2       ARG  28   1.756   5.323  -7.043
  216   2HG   ARG  28          HG1       ARG  28   1.874   5.709  -5.326
  217   1HD   ARG  28          HD2       ARG  28   2.064   3.284  -4.821
  218   2HD   ARG  28          HD1       ARG  28   2.025   2.946  -6.545
  219    HE   ARG  28           HE       ARG  28   4.256   4.047  -5.049
  220   1HH1  ARG  28          HH21      ARG  28   4.515   1.935  -7.188
  221   2HH1  ARG  28          HH22      ARG  28   5.202   2.828  -8.502
  222   1HH2  ARG  28          HH11      ARG  28   4.390   5.925  -7.166
  223   2HH2  ARG  28          HH12      ARG  28   5.131   5.089  -8.491
  224    H    ILE  29           HN       ILE  29  -2.337   5.631  -4.261
  225    HA   ILE  29           HA       ILE  29  -4.456   4.421  -5.676
  226    HB   ILE  29           HB       ILE  29  -4.346   5.764  -2.975
  227   1HG1  ILE  29          HG12      ILE  29  -3.065   3.665  -3.212
  228   2HG1  ILE  29          HG11      ILE  29  -4.441   3.443  -2.146
  229   1HG2  ILE  29          HG21      ILE  29  -6.636   4.324  -4.331
  230   2HG2  ILE  29          HG22      ILE  29  -6.643   5.944  -3.633
  231   3HG2  ILE  29          HG23      ILE  29  -6.536   4.532  -2.584
  232   1HD1  ILE  29          HD11      ILE  29  -5.586   2.697  -4.492
  233   2HD1  ILE  29          HD12      ILE  29  -4.722   1.571  -3.455
  234   3HD1  ILE  29          HD13      ILE  29  -3.909   2.288  -4.841
  235    H    GLN  30           HN       GLN  30  -3.992   7.752  -4.578
  236    HA   GLN  30           HA       GLN  30  -6.496   8.760  -5.505
  237   1HB   GLN  30          HB2       GLN  30  -4.997   9.982  -3.909
  238   2HB   GLN  30          HB1       GLN  30  -3.868  10.254  -5.235
  239   1HG   GLN  30          HG2       GLN  30  -5.606  11.485  -6.479
  240   2HG   GLN  30          HG1       GLN  30  -6.756  11.200  -5.173
  241   1HE2  GLN  30          HE21      GLN  30  -5.847  13.843  -6.082
  242   2HE2  GLN  30          HE22      GLN  30  -5.059  14.562  -4.762
  243    H    TYR  31           HN       TYR  31  -3.346   8.484  -7.188
  244    HA   TYR  31           HA       TYR  31  -4.282   9.847  -9.484
  245   1HB   TYR  31          HB2       TYR  31  -1.873   9.526  -9.050
  246   2HB   TYR  31          HB1       TYR  31  -2.071   7.783  -9.234
  247    HD1  TYR  31           HD1      TYR  31  -2.490   6.780 -11.422
  248    HD2  TYR  31           HD2      TYR  31  -2.033  11.026 -10.974
  249    HE1  TYR  31           HE1      TYR  31  -2.240   7.012 -13.879
  250    HE2  TYR  31           HE2      TYR  31  -1.782  11.259 -13.429
  251    HH   TYR  31           HH       TYR  31  -1.967  10.213 -15.397
  252    H    ALA  32           HN       ALA  32  -4.287   6.444  -8.535
  253    HA   ALA  32           HA       ALA  32  -5.234   5.457 -11.024
  254   1HB   ALA  32          HB1       ALA  32  -5.813   3.417  -9.615
  255   2HB   ALA  32          HB2       ALA  32  -5.185   4.318  -8.234
  256   3HB   ALA  32          HB3       ALA  32  -4.126   3.932  -9.591
  257    H    PHE  33           HN       PHE  33  -6.812   6.443  -8.034
  258    HA   PHE  33           HA       PHE  33  -9.489   6.090  -9.295
  259   1HB   PHE  33          HB2       PHE  33  -8.722   5.975  -6.374
  260   2HB   PHE  33          HB1       PHE  33 -10.351   5.805  -7.022
  261    HD1  PHE  33           HD1      PHE  33  -7.042   4.217  -6.706
  262    HD2  PHE  33           HD2      PHE  33 -11.025   3.799  -8.255
  263    HE1  PHE  33           HE1      PHE  33  -6.638   1.803  -7.082
  264    HE2  PHE  33           HE2      PHE  33 -10.622   1.379  -8.629
  265    HZ   PHE  33           HZ       PHE  33  -8.428   0.382  -8.040
  266    HA   PRO  34           HA       PRO  34  -8.962  10.612  -8.526
  267   1HB   PRO  34          HB2       PRO  34 -10.553  11.140 -10.888
  268   2HB   PRO  34          HB1       PRO  34  -8.833  11.454 -10.620
  269   1HG   PRO  34          HG2       PRO  34  -9.875   9.543 -12.348
  270   2HG   PRO  34          HG1       PRO  34  -8.213   9.590 -11.741
  271   1HD   PRO  34          HD2       PRO  34 -10.477   7.844 -10.889
  272   2HD   PRO  34          HD1       PRO  34  -8.726   7.535 -10.856
  273    H    ASP  35           HN       ASP  35 -11.804   8.750  -9.341
  274    HA   ASP  35           HA       ASP  35 -13.672  10.763  -8.377
  275   1HB   ASP  35          HB2       ASP  35 -14.019   8.083  -9.695
  276   2HB   ASP  35          HB1       ASP  35 -15.376   9.038  -9.105
  277    H    ASN  36           HN       ASN  36 -12.011   8.134  -6.859
  278    HA   ASN  36           HA       ASN  36 -14.203   7.945  -4.861
  279   1HB   ASN  36          HB2       ASN  36 -12.247   5.813  -5.694
  280   2HB   ASN  36          HB1       ASN  36 -13.450   5.653  -4.421
  281   1HD2  ASN  36          HD21      ASN  36 -15.723   6.789  -5.526
  282   2HD2  ASN  36          HD22      ASN  36 -16.167   5.962  -6.941
  283    H    GLU  37           HN       GLU  37 -13.553   8.580  -2.708
  284    HA   GLU  37           HA       GLU  37 -10.997   9.522  -2.066
  285   1HB   GLU  37          HB2       GLU  37 -13.182   8.353  -0.342
  286   2HB   GLU  37          HB1       GLU  37 -11.864   9.382   0.205
  287   1HG   GLU  37          HG2       GLU  37 -12.716  11.240  -1.206
  288   2HG   GLU  37          HG1       GLU  37 -14.024  10.198  -1.776
  289    H    GLY  38           HN       GLY  38  -9.176   8.316  -1.682
  290   1HA   GLY  38          HA2       GLY  38  -9.460   5.433  -0.937
  291   2HA   GLY  38          HA1       GLY  38  -8.125   5.988  -1.697
  292    H    HIS  39           HN       HIS  39  -8.941   4.986   1.325
  293    HA   HIS  39           HA       HIS  39  -7.049   6.860   2.602
  294   1HB   HIS  39          HB2       HIS  39  -9.292   6.917   3.608
  295   2HB   HIS  39          HB1       HIS  39  -9.243   5.171   3.847
  296    HD1  HIS  39           HD1      HIS  39  -6.913   8.086   4.725
  297    HD2  HIS  39           HD2      HIS  39  -8.455   4.599   6.409
  298    HE1  HIS  39           HE1      HIS  39  -5.967   7.944   7.071
  299    H    VAL  40           HN       VAL  40  -5.096   5.866   3.088
  300    HA   VAL  40           HA       VAL  40  -5.006   2.922   3.113
  301    HB   VAL  40           HB       VAL  40  -2.829   4.908   2.463
  302   1HG1  VAL  40          HG11      VAL  40  -1.880   2.870   3.306
  303   2HG1  VAL  40          HG12      VAL  40  -1.757   2.801   1.548
  304   3HG1  VAL  40          HG13      VAL  40  -3.017   1.890   2.379
  305   1HG2  VAL  40          HG21      VAL  40  -4.584   4.948   0.759
  306   2HG2  VAL  40          HG22      VAL  40  -4.616   3.187   0.711
  307   3HG2  VAL  40          HG23      VAL  40  -3.198   4.056   0.129
  308    H    SER  41           HN       SER  41  -4.357   1.930   4.891
  309    HA   SER  41           HA       SER  41  -2.861   3.460   6.942
  310   1HB   SER  41          HB2       SER  41  -5.103   1.477   7.428
  311   2HB   SER  41          HB1       SER  41  -4.036   2.082   8.692
  312    HG   SER  41           HG       SER  41  -6.196   3.235   7.599
  313    H    VAL  42           HN       VAL  42  -1.182   2.463   7.916
  314    HA   VAL  42           HA       VAL  42  -0.644  -0.351   7.178
  315    HB   VAL  42           HB       VAL  42   1.432   1.870   7.212
  316   1HG1  VAL  42          HG11      VAL  42   1.627  -1.047   6.403
  317   2HG1  VAL  42          HG12      VAL  42   2.299  -0.345   7.875
  318   3HG1  VAL  42          HG13      VAL  42   2.930   0.137   6.301
  319   1HG2  VAL  42          HG21      VAL  42  -0.276   1.800   5.253
  320   2HG2  VAL  42          HG22      VAL  42   0.555   0.323   4.773
  321   3HG2  VAL  42          HG23      VAL  42   1.439   1.843   4.851
  322    H    ARG  43           HN       ARG  43  -0.202  -1.600   8.846
  323    HA   ARG  43           HA       ARG  43   1.016  -0.452  11.236
  324   1HB   ARG  43          HB2       ARG  43  -1.297  -0.122  11.762
  325   2HB   ARG  43          HB1       ARG  43  -1.722  -1.742  11.219
  326   1HG   ARG  43          HG2       ARG  43  -0.559  -2.753  13.062
  327   2HG   ARG  43          HG1       ARG  43   0.165  -1.214  13.528
  328   1HD   ARG  43          HD2       ARG  43  -2.823  -1.708  13.489
  329   2HD   ARG  43          HD1       ARG  43  -1.826  -1.913  14.928
  330    HE   ARG  43           HE       ARG  43  -1.249   0.625  13.991
  331   1HH1  ARG  43          HH11      ARG  43  -2.999  -0.583  16.435
  332   2HH1  ARG  43          HH12      ARG  43  -4.287   0.574  16.407
  333   1HH2  ARG  43          HH21      ARG  43  -3.379   1.906  13.339
  334   2HH2  ARG  43          HH22      ARG  43  -4.504   1.982  14.654
  335    H    TYR  44           HN       TYR  44   1.768  -2.104  12.761
  336    HA   TYR  44           HA       TYR  44   2.697  -4.507  11.358
  337   1HB   TYR  44          HB2       TYR  44   3.213  -3.407  14.142
  338   2HB   TYR  44          HB1       TYR  44   3.842  -4.950  13.586
  339    HD1  TYR  44           HD1      TYR  44   5.003  -4.776  11.123
  340    HD2  TYR  44           HD2      TYR  44   4.675  -1.593  13.996
  341    HE1  TYR  44           HE1      TYR  44   6.948  -3.638  10.091
  342    HE2  TYR  44           HE2      TYR  44   6.618  -0.461  12.963
  343    HH   TYR  44           HH       TYR  44   8.418  -0.811  11.558
  344    H    ALA  45           HN       ALA  45   2.108  -6.562  11.719
  345    HA   ALA  45           HA       ALA  45   0.097  -7.126  13.785
  346   1HB   ALA  45          HB1       ALA  45  -1.067  -6.611  11.607
  347   2HB   ALA  45          HB2       ALA  45  -1.343  -8.248  12.205
  348   3HB   ALA  45          HB3       ALA  45  -0.200  -7.970  10.891
  349    H    ALA  46           HN       ALA  46  -0.220  -9.575  13.922
  350    HA   ALA  46           HA       ALA  46   2.306 -10.800  14.238
  351   1HB   ALA  46          HB1       ALA  46   1.000 -12.903  14.608
  352   2HB   ALA  46          HB2       ALA  46  -0.456 -12.053  14.092
  353   3HB   ALA  46          HB3       ALA  46   0.385 -11.551  15.559
  354    H    ALA  47           HN       ALA  47   0.164 -10.623  11.487
  355    HA   ALA  47           HA       ALA  47   2.178 -12.144   9.941
  356   1HB   ALA  47          HB1       ALA  47  -0.784 -12.601   9.605
  357   2HB   ALA  47          HB2       ALA  47   0.241 -13.622  10.613
  358   3HB   ALA  47          HB3       ALA  47   0.543 -13.507   8.879
  359    H    ASN  48           HN       ASN  48   2.239 -11.756   7.704
  360    HA   ASN  48           HA       ASN  48   1.562  -9.059   6.912
  361   1HB   ASN  48          HB2       ASN  48   2.589  -9.625   4.813
  362   2HB   ASN  48          HB1       ASN  48   3.588 -10.296   6.101
  363   1HD2  ASN  48          HD21      ASN  48   3.415 -11.282   3.308
  364   2HD2  ASN  48          HD22      ASN  48   2.865 -12.886   3.408
  365    H    ASN  49           HN       ASN  49  -0.318  -8.425   5.987
  366    HA   ASN  49           HA       ASN  49  -1.923 -10.278   4.405
  367   1HB   ASN  49          HB2       ASN  49  -2.588 -10.502   6.884
  368   2HB   ASN  49          HB1       ASN  49  -3.251  -8.882   6.721
  369   1HD2  ASN  49          HD21      ASN  49  -5.417  -9.918   7.092
  370   2HD2  ASN  49          HD22      ASN  49  -6.195 -10.683   5.792
  371    H    LEU  50           HN       LEU  50  -3.417  -9.211   3.069
  372    HA   LEU  50           HA       LEU  50  -3.306  -6.252   3.036
  373   1HB   LEU  50          HB2       LEU  50  -1.942  -7.177   1.187
  374   2HB   LEU  50          HB1       LEU  50  -3.307  -8.165   0.674
  375    HG   LEU  50           HG       LEU  50  -4.633  -6.119   0.241
  376   1HD1  LEU  50          HD11      LEU  50  -3.875  -4.474   1.692
  377   2HD1  LEU  50          HD12      LEU  50  -3.191  -3.943   0.159
  378   3HD1  LEU  50          HD13      LEU  50  -2.176  -4.782   1.331
  379   1HD2  LEU  50          HD21      LEU  50  -3.299  -5.285  -1.706
  380   2HD2  LEU  50          HD22      LEU  50  -3.344  -7.044  -1.623
  381   3HD2  LEU  50          HD23      LEU  50  -1.904  -6.172  -1.096
  382    H    SER  51           HN       SER  51  -5.366  -5.456   3.343
  383    HA   SER  51           HA       SER  51  -7.645  -7.179   2.534
  384   1HB   SER  51          HB2       SER  51  -8.821  -5.960   4.450
  385   2HB   SER  51          HB1       SER  51  -7.623  -7.171   4.899
  386    HG   SER  51           HG       SER  51  -7.329  -5.214   6.044
  387    H    VAL  52           HN       VAL  52  -9.055  -6.216   1.146
  388    HA   VAL  52           HA       VAL  52  -9.016  -3.278   0.899
  389    HB   VAL  52           HB       VAL  52  -9.357  -5.312  -1.325
  390   1HG1  VAL  52          HG11      VAL  52  -9.352  -3.233  -2.761
  391   2HG1  VAL  52          HG12      VAL  52  -9.512  -2.284  -1.283
  392   3HG1  VAL  52          HG13      VAL  52 -10.786  -3.410  -1.750
  393   1HG2  VAL  52          HG21      VAL  52  -7.156  -3.362  -0.591
  394   2HG2  VAL  52          HG22      VAL  52  -7.274  -4.122  -2.178
  395   3HG2  VAL  52          HG23      VAL  52  -7.031  -5.114  -0.740
  396    H    ILE  53           HN       ILE  53 -10.968  -2.386   1.337
  397    HA   ILE  53           HA       ILE  53 -13.390  -4.092   1.082
  398    HB   ILE  53           HB       ILE  53 -12.830  -1.916   3.112
  399   1HG1  ILE  53          HG12      ILE  53 -13.266  -4.868   3.641
  400   2HG1  ILE  53          HG11      ILE  53 -11.653  -4.205   3.366
  401   1HG2  ILE  53          HG21      ILE  53 -15.227  -3.658   2.516
  402   2HG2  ILE  53          HG22      ILE  53 -15.160  -1.900   2.642
  403   3HG2  ILE  53          HG23      ILE  53 -14.997  -2.895   4.089
  404   1HD1  ILE  53          HD11      ILE  53 -13.600  -3.383   5.538
  405   2HD1  ILE  53          HD12      ILE  53 -12.068  -2.569   5.218
  406   3HD1  ILE  53          HD13      ILE  53 -12.079  -4.247   5.758
  407    H    GLY  54           HN       GLY  54 -14.888  -3.345  -0.280
  408   1HA   GLY  54          HA2       GLY  54 -16.343  -1.674  -1.135
  409   2HA   GLY  54          HA1       GLY  54 -15.157  -0.445  -0.703
  410    H    ALA  55           HN       ALA  55 -13.827  -3.194  -2.291
  411    HA   ALA  55           HA       ALA  55 -13.759  -1.685  -4.851
  412   1HB   ALA  55          HB1       ALA  55 -11.498  -3.479  -4.015
  413   2HB   ALA  55          HB2       ALA  55 -11.606  -1.852  -3.350
  414   3HB   ALA  55          HB3       ALA  55 -11.479  -2.083  -5.094
  415    H    THR  56           HN       THR  56 -13.274  -2.929  -6.741
  416    HA   THR  56           HA       THR  56 -14.740  -5.494  -6.960
  417    HB   THR  56           HB       THR  56 -14.571  -5.030  -9.315
  418    HG1  THR  56           HG1      THR  56 -13.584  -2.595  -9.357
  419   1HG2  THR  56          HG21      THR  56 -15.298  -2.455  -7.895
  420   2HG2  THR  56          HG22      THR  56 -16.343  -3.875  -7.944
  421   3HG2  THR  56          HG23      THR  56 -15.926  -3.034  -9.438
  422    H    LYS  57           HN       LYS  57 -13.816  -7.228  -8.063
  423    HA   LYS  57           HA       LYS  57 -11.318  -8.031  -7.145
  424   1HB   LYS  57          HB2       LYS  57 -12.832  -9.001  -9.590
  425   2HB   LYS  57          HB1       LYS  57 -11.489  -9.850  -8.835
  426   1HG   LYS  57          HG2       LYS  57 -12.799 -10.083  -6.742
  427   2HG   LYS  57          HG1       LYS  57 -14.141  -9.209  -7.487
  428   1HD   LYS  57          HD2       LYS  57 -12.966 -11.812  -8.515
  429   2HD   LYS  57          HD1       LYS  57 -14.447 -11.676  -7.570
  430   1HE   LYS  57          HE2       LYS  57 -14.998  -9.885  -9.559
  431   2HE   LYS  57          HE1       LYS  57 -13.978 -11.027 -10.435
  432   1HZ   LYS  57          HZ1       LYS  57 -15.813 -12.403  -8.776
  433   2HZ   LYS  57          HZ2       LYS  57 -15.618 -12.489 -10.462
  434   3HZ   LYS  57          HZ3       LYS  57 -16.642 -11.317  -9.780
  435    H    GLU  58           HN       GLU  58 -12.114  -6.508 -10.328
  436    HA   GLU  58           HA       GLU  58  -9.508  -6.872 -11.391
  437   1HB   GLU  58          HB2       GLU  58 -11.547  -6.388 -12.743
  438   2HB   GLU  58          HB1       GLU  58 -11.589  -4.769 -12.047
  439   1HG   GLU  58          HG2       GLU  58  -9.356  -4.302 -12.968
  440   2HG   GLU  58          HG1       GLU  58  -9.288  -5.927 -13.647
  441    H    ASP  59           HN       ASP  59 -11.030  -4.311  -9.471
  442    HA   ASP  59           HA       ASP  59  -8.923  -2.439  -9.683
  443   1HB   ASP  59          HB2       ASP  59 -11.027  -2.892  -7.556
  444   2HB   ASP  59          HB1       ASP  59  -9.885  -1.550  -7.506
  445    H    LYS  60           HN       LYS  60  -9.670  -5.056  -7.447
  446    HA   LYS  60           HA       LYS  60  -7.459  -4.623  -5.718
  447   1HB   LYS  60          HB2       LYS  60  -9.404  -5.963  -5.006
  448   2HB   LYS  60          HB1       LYS  60  -9.013  -7.180  -6.219
  449   1HG   LYS  60          HG2       LYS  60  -6.845  -7.600  -5.117
  450   2HG   LYS  60          HG1       LYS  60  -7.214  -6.362  -3.914
  451   1HD   LYS  60          HD2       LYS  60  -9.067  -7.639  -3.065
  452   2HD   LYS  60          HD1       LYS  60  -8.958  -8.790  -4.397
  453   1HE   LYS  60          HE2       LYS  60  -7.925  -9.727  -2.370
  454   2HE   LYS  60          HE1       LYS  60  -6.706  -9.463  -3.619
  455   1HZ   LYS  60          HZ1       LYS  60  -6.200  -7.317  -2.553
  456   2HZ   LYS  60          HZ2       LYS  60  -5.895  -8.643  -1.535
  457   3HZ   LYS  60          HZ3       LYS  60  -7.285  -7.694  -1.306
  458    H    GLN  61           HN       GLN  61  -7.683  -6.633  -8.674
  459    HA   GLN  61           HA       GLN  61  -5.105  -7.798  -8.295
  460   1HB   GLN  61          HB2       GLN  61  -6.823  -8.614  -9.947
  461   2HB   GLN  61          HB1       GLN  61  -6.513  -7.171 -10.911
  462   1HG   GLN  61          HG2       GLN  61  -5.177  -8.973 -11.813
  463   2HG   GLN  61          HG1       GLN  61  -4.091  -7.839 -11.010
  464   1HE2  GLN  61          HE21      GLN  61  -6.009 -10.790 -10.177
  465   2HE2  GLN  61          HE22      GLN  61  -4.808 -11.457  -9.179
  466    H    ARG  62           HN       ARG  62  -6.256  -4.811  -9.905
  467    HA   ARG  62           HA       ARG  62  -3.753  -4.040 -10.898
  468   1HB   ARG  62          HB2       ARG  62  -5.828  -2.972 -11.656
  469   2HB   ARG  62          HB1       ARG  62  -6.099  -2.309 -10.046
  470   1HG   ARG  62          HG2       ARG  62  -4.038  -0.977 -10.228
  471   2HG   ARG  62          HG1       ARG  62  -3.716  -1.668 -11.818
  472   1HD   ARG  62          HD2       ARG  62  -5.738  -0.673 -12.715
  473   2HD   ARG  62          HD1       ARG  62  -6.210  -0.101 -11.118
  474    HE   ARG  62           HE       ARG  62  -4.793   1.700 -11.429
  475   1HH1  ARG  62          HH21      ARG  62  -4.359  -0.593 -13.947
  476   2HH1  ARG  62          HH22      ARG  62  -2.950   0.170 -14.605
  477   1HH2  ARG  62          HH11      ARG  62  -2.763   2.575 -12.110
  478   2HH2  ARG  62          HH12      ARG  62  -2.046   1.966 -13.563
  479    H    ILE  63           HN       ILE  63  -5.331  -3.327  -7.811
  480    HA   ILE  63           HA       ILE  63  -3.265  -1.687  -6.814
  481    HB   ILE  63           HB       ILE  63  -5.326  -3.335  -5.386
  482   1HG1  ILE  63          HG12      ILE  63  -5.082  -0.333  -5.586
  483   2HG1  ILE  63          HG11      ILE  63  -5.935  -1.279  -6.805
  484   1HG2  ILE  63          HG21      ILE  63  -3.168  -1.538  -4.290
  485   2HG2  ILE  63          HG22      ILE  63  -3.628  -3.152  -3.750
  486   3HG2  ILE  63          HG23      ILE  63  -4.681  -1.777  -3.412
  487   1HD1  ILE  63          HD11      ILE  63  -6.572  -1.159  -3.843
  488   2HD1  ILE  63          HD12      ILE  63  -7.364  -2.241  -4.989
  489   3HD1  ILE  63          HD13      ILE  63  -7.543  -0.495  -5.157
  490    H    SER  64           HN       SER  64  -3.679  -5.192  -6.572
  491    HA   SER  64           HA       SER  64  -1.399  -5.621  -4.928
  492   1HB   SER  64          HB2       SER  64  -2.518  -7.420  -7.100
  493   2HB   SER  64          HB1       SER  64  -1.371  -7.910  -5.856
  494    HG   SER  64           HG       SER  64  -2.917  -7.799  -4.370
  495    H    GLU  65           HN       GLU  65  -1.799  -5.311  -8.500
  496    HA   GLU  65           HA       GLU  65   0.896  -5.838  -9.115
  497   1HB   GLU  65          HB2       GLU  65  -1.218  -4.246 -10.583
  498   2HB   GLU  65          HB1       GLU  65   0.389  -4.559 -11.240
  499   1HG   GLU  65          HG2       GLU  65   0.016  -6.978 -11.058
  500   2HG   GLU  65          HG1       GLU  65  -1.576  -6.694 -10.357
  501    H    ILE  66           HN       ILE  66  -0.791  -2.790  -8.378
  502    HA   ILE  66           HA       ILE  66   1.397  -1.091  -8.866
  503    HB   ILE  66           HB       ILE  66  -0.953  -0.793  -6.983
  504   1HG1  ILE  66          HG12      ILE  66  -0.300   0.584  -9.606
  505   2HG1  ILE  66          HG11      ILE  66  -1.298  -0.867  -9.501
  506   1HG2  ILE  66          HG21      ILE  66  -0.252   1.683  -7.104
  507   2HG2  ILE  66          HG22      ILE  66   1.304   1.091  -7.684
  508   3HG2  ILE  66          HG23      ILE  66   0.733   0.639  -6.078
  509   1HD1  ILE  66          HD11      ILE  66  -1.862   1.806  -8.186
  510   2HD1  ILE  66          HD12      ILE  66  -2.823   0.349  -7.936
  511   3HD1  ILE  66          HD13      ILE  66  -2.746   1.093  -9.533
  512    H    LEU  67           HN       LEU  67   0.372  -2.757  -5.922
  513    HA   LEU  67           HA       LEU  67   2.372  -1.722  -4.225
  514   1HB   LEU  67          HB2       LEU  67   0.552  -2.887  -3.188
  515   2HB   LEU  67          HB1       LEU  67   0.789  -4.305  -4.200
  516    HG   LEU  67           HG       LEU  67   3.028  -4.663  -3.057
  517   1HD1  LEU  67          HD11      LEU  67   3.633  -2.565  -2.151
  518   2HD1  LEU  67          HD12      LEU  67   3.108  -3.476  -0.739
  519   3HD1  LEU  67          HD13      LEU  67   2.028  -2.291  -1.471
  520   1HD2  LEU  67          HD21      LEU  67   1.999  -5.495  -0.945
  521   2HD2  LEU  67          HD22      LEU  67   1.060  -5.928  -2.373
  522   3HD2  LEU  67          HD23      LEU  67   0.529  -4.602  -1.338
  523    H    GLN  68           HN       GLN  68   2.301  -4.509  -6.375
  524    HA   GLN  68           HA       GLN  68   4.868  -5.511  -5.689
  525   1HB   GLN  68          HB2       GLN  68   3.216  -6.809  -6.997
  526   2HB   GLN  68          HB1       GLN  68   3.381  -5.661  -8.324
  527   1HG   GLN  68          HG2       GLN  68   5.695  -6.250  -8.646
  528   2HG   GLN  68          HG1       GLN  68   5.701  -7.227  -7.177
  529   1HE2  GLN  68          HE21      GLN  68   6.449  -8.538  -9.504
  530   2HE2  GLN  68          HE22      GLN  68   5.210  -9.579 -10.018
  531    H    GLU  69           HN       GLU  69   3.897  -3.313  -8.380
  532    HA   GLU  69           HA       GLU  69   6.498  -2.924  -9.319
  533   1HB   GLU  69          HB2       GLU  69   4.046  -1.162  -9.429
  534   2HB   GLU  69          HB1       GLU  69   5.546  -0.783 -10.277
  535   1HG   GLU  69          HG2       GLU  69   5.423  -2.871 -11.523
  536   2HG   GLU  69          HG1       GLU  69   3.999  -3.367 -10.611
  537    H    THR  70           HN       THR  70   4.715  -1.051  -6.874
  538    HA   THR  70           HA       THR  70   6.637   0.961  -6.488
  539    HB   THR  70           HB       THR  70   4.749  -0.241  -4.494
  540    HG1  THR  70           HG1      THR  70   3.559   0.569  -6.126
  541   1HG2  THR  70          HG21      THR  70   4.962   2.030  -3.428
  542   2HG2  THR  70          HG22      THR  70   6.299   2.341  -4.536
  543   3HG2  THR  70          HG23      THR  70   6.426   1.048  -3.345
  544    H    TRP  71           HN       TRP  71   6.093  -2.051  -4.825
  545    HA   TRP  71           HA       TRP  71   8.166  -1.979  -3.010
  546   1HB   TRP  71          HB2       TRP  71   6.181  -3.459  -3.020
  547   2HB   TRP  71          HB1       TRP  71   6.904  -4.356  -4.342
  548    HD1  TRP  71           HD1      TRP  71   7.619  -6.572  -3.393
  549    HE1  TRP  71           HE1      TRP  71   8.942  -7.394  -1.349
  550    HE3  TRP  71           HE3      TRP  71   8.229  -2.149  -0.830
  551    HZ2  TRP  71           HZ2      TRP  71  10.084  -6.355   1.041
  552    HZ3  TRP  71           HZ3      TRP  71   9.425  -2.127   1.323
  553    HH2  TRP  71           HH2      TRP  71  10.347  -4.219   2.271
  554    H    GLU  72           HN       GLU  72   8.137  -3.118  -6.319
  555    HA   GLU  72           HA       GLU  72  10.842  -4.059  -6.246
  556   1HB   GLU  72          HB2       GLU  72   8.948  -3.561  -8.548
  557   2HB   GLU  72          HB1       GLU  72  10.576  -4.204  -8.761
  558   1HG   GLU  72          HG2       GLU  72  10.036  -6.084  -7.262
  559   2HG   GLU  72          HG1       GLU  72   8.408  -5.448  -7.044
  560    H    SER  73           HN       SER  73   9.526  -0.878  -6.660
  561    HA   SER  73           HA       SER  73  12.074   0.012  -7.902
  562   1HB   SER  73          HB2       SER  73  10.932   1.956  -8.656
  563   2HB   SER  73          HB1       SER  73   9.831   0.617  -8.967
  564    HG   SER  73           HG       SER  73   9.366   2.766  -7.544
  565    H    ALA  74           HN       ALA  74  11.459  -0.630  -4.977
  566    HA   ALA  74           HA       ALA  74  11.262   1.515  -3.356
  567   1HB   ALA  74          HB1       ALA  74  11.264  -0.721  -2.545
  568   2HB   ALA  74          HB2       ALA  74  12.546   0.177  -1.730
  569   3HB   ALA  74          HB3       ALA  74  12.945  -0.947  -3.029
  570    H    ASP  75           HN       ASP  75  14.283   0.441  -4.896
  571    HA   ASP  75           HA       ASP  75  16.029   2.062  -3.406
  572   1HB   ASP  75          HB2       ASP  75  16.738   0.178  -4.864
  573   2HB   ASP  75          HB1       ASP  75  16.360   1.167  -6.276
  574    H    ASP  76           HN       ASP  76  13.848   2.894  -5.978
  575    HA   ASP  76           HA       ASP  76  15.243   5.411  -6.596
  576   1HB   ASP  76          HB2       ASP  76  14.229   4.006  -8.394
  577   2HB   ASP  76          HB1       ASP  76  12.645   4.324  -7.693
  578    H    TRP  77           HN       TRP  77  12.083   4.426  -5.213
  579    HA   TRP  77           HA       TRP  77  11.526   7.263  -4.620
  580   1HB   TRP  77          HB2       TRP  77   9.305   6.684  -4.288
  581   2HB   TRP  77          HB1       TRP  77   9.829   5.675  -5.618
  582    HD1  TRP  77           HD1      TRP  77   9.820   3.052  -5.262
  583    HE1  TRP  77           HE1      TRP  77   9.019   1.540  -3.358
  584    HE3  TRP  77           HE3      TRP  77   9.143   6.533  -1.469
  585    HZ2  TRP  77           HZ2      TRP  77   8.209   1.724  -0.648
  586    HZ3  TRP  77           HZ3      TRP  77   8.347   5.779   0.714
  587    HH2  TRP  77           HH2      TRP  77   7.880   3.407   1.135
  588    H    PHE  78           HN       PHE  78  12.687   4.505  -2.817
  589    HA   PHE  78           HA       PHE  78  11.821   5.715  -0.270
  590   1HB   PHE  78          HB2       PHE  78  11.804   3.265  -0.378
  591   2HB   PHE  78          HB1       PHE  78  13.510   3.261  -0.804
  592    HD1  PHE  78           HD1      PHE  78  11.317   4.869   1.825
  593    HD2  PHE  78           HD2      PHE  78  15.008   2.798   0.966
  594    HE1  PHE  78           HE1      PHE  78  11.942   4.948   4.215
  595    HE2  PHE  78           HE2      PHE  78  15.602   2.885   3.361
  596    HZ   PHE  78           HZ       PHE  78  14.072   3.956   4.987
  597    H    VAL  79           HN       VAL  79  12.934   7.105   0.822
  598    HA   VAL  79           HA       VAL  79  15.788   7.534   0.166
  599    HB   VAL  79           HB       VAL  79  14.008   9.696   1.287
  600   1HG1  VAL  79          HG11      VAL  79  16.164   9.862  -0.825
  601   2HG1  VAL  79          HG12      VAL  79  16.528   9.908   0.901
  602   3HG1  VAL  79          HG13      VAL  79  15.519  11.161   0.178
  603   1HG2  VAL  79          HG21      VAL  79  14.058   8.785  -1.610
  604   2HG2  VAL  79          HG22      VAL  79  13.417  10.337  -1.073
  605   3HG2  VAL  79          HG23      VAL  79  12.651   8.836  -0.543
  606    H    SER  80           HN       SER  80  17.214   7.740   2.027
  607    HA   SER  80           HA       SER  80  15.893   7.538   4.678
  608   1HB   SER  80          HB2       SER  80  18.448   6.103   3.883
  609   2HB   SER  80          HB1       SER  80  17.577   5.972   5.406
  610    HG   SER  80           HG       SER  80  15.890   5.493   3.397
  611    H    GLU  81           HN       GLU  81  16.707   8.799   6.233
  612    HA   GLU  81           HA       GLU  81  18.310  11.028   5.561
  613   1HB   GLU  81          HB2       GLU  81  17.563   9.880   8.258
  614   2HB   GLU  81          HB1       GLU  81  18.320  11.456   8.015
  615   1HG   GLU  81          HG2       GLU  81  16.427  12.151   6.599
  616   2HG   GLU  81          HG1       GLU  81  15.664  10.581   6.839
  Start of MODEL    6
    1   1H    MET   1          HT1       MET   1 -14.857   3.792  -0.222
    2   2H    MET   1          HT2       MET   1 -14.057   4.193  -1.667
    3   3H    MET   1          HT3       MET   1 -13.413   4.681  -0.172
    4    HA   MET   1           HA       MET   1 -13.822   1.847  -0.355
    5   1HB   MET   1          HB2       MET   1 -11.963   1.456  -1.917
    6   2HB   MET   1          HB1       MET   1 -13.252   2.357  -2.714
    7   1HG   MET   1          HG2       MET   1 -12.009   4.477  -2.127
    8   2HG   MET   1          HG1       MET   1 -10.664   3.467  -1.602
    9   1HE   MET   1          HE1       MET   1  -9.186   1.922  -4.659
   10   2HE   MET   1          HE2       MET   1 -10.184   1.196  -3.403
   11   3HE   MET   1          HE3       MET   1  -9.003   2.430  -2.976
   12    H    ARG   2           HN       ARG   2 -12.344   0.894   1.072
   13    HA   ARG   2           HA       ARG   2 -10.316   2.694   2.287
   14   1HB   ARG   2          HB2       ARG   2 -12.213   2.351   3.832
   15   2HB   ARG   2          HB1       ARG   2 -11.989   0.606   3.715
   16   1HG   ARG   2          HG2       ARG   2  -9.807   0.735   4.728
   17   2HG   ARG   2          HG1       ARG   2  -9.812   2.498   4.639
   18   1HD   ARG   2          HD2       ARG   2 -11.585   2.652   6.259
   19   2HD   ARG   2          HD1       ARG   2 -11.854   0.912   6.213
   20    HE   ARG   2           HE       ARG   2  -9.221   1.212   6.991
   21   1HH1  ARG   2          HH21      ARG   2 -12.259   2.479   8.052
   22   2HH1  ARG   2          HH22      ARG   2 -11.841   2.454   9.733
   23   1HH2  ARG   2          HH11      ARG   2  -8.695   1.099   9.206
   24   2HH2  ARG   2          HH12      ARG   2  -9.825   1.678  10.384
   25    H    ILE   3           HN       ILE   3  -8.314   1.914   2.404
   26    HA   ILE   3           HA       ILE   3  -7.841  -0.942   1.700
   27    HB   ILE   3           HB       ILE   3  -6.132   1.495   1.161
   28   1HG1  ILE   3          HG12      ILE   3  -7.407  -0.334  -0.882
   29   2HG1  ILE   3          HG11      ILE   3  -8.295   1.039  -0.223
   30   1HG2  ILE   3          HG21      ILE   3  -5.732  -1.464   0.692
   31   2HG2  ILE   3          HG22      ILE   3  -4.654  -0.333   1.508
   32   3HG2  ILE   3          HG23      ILE   3  -4.864  -0.245  -0.241
   33   1HD1  ILE   3          HD11      ILE   3  -6.848   1.335  -2.409
   34   2HD1  ILE   3          HD12      ILE   3  -5.511   1.477  -1.269
   35   3HD1  ILE   3          HD13      ILE   3  -6.866   2.601  -1.183
   36    H    GLU   4           HN       GLU   4  -6.902  -2.081   3.316
   37    HA   GLU   4           HA       GLU   4  -5.218  -0.639   5.307
   38   1HB   GLU   4          HB2       GLU   4  -7.050  -3.004   5.828
   39   2HB   GLU   4          HB1       GLU   4  -5.985  -2.249   7.013
   40   1HG   GLU   4          HG2       GLU   4  -7.184  -0.109   6.732
   41   2HG   GLU   4          HG1       GLU   4  -8.251  -0.862   5.549
   42    H    VAL   5           HN       VAL   5  -3.214  -1.325   5.509
   43    HA   VAL   5           HA       VAL   5  -2.483  -4.002   4.411
   44    HB   VAL   5           HB       VAL   5  -0.691  -1.580   4.529
   45   1HG1  VAL   5          HG11      VAL   5   0.531  -2.911   2.761
   46   2HG1  VAL   5          HG12      VAL   5  -0.551  -4.255   3.123
   47   3HG1  VAL   5          HG13      VAL   5   0.537  -3.638   4.368
   48   1HG2  VAL   5          HG21      VAL   5  -2.327  -0.843   3.019
   49   2HG2  VAL   5          HG22      VAL   5  -2.646  -2.465   2.416
   50   3HG2  VAL   5          HG23      VAL   5  -1.167  -1.630   1.951
   51    H    THR   6           HN       THR   6  -1.370  -5.372   5.695
   52    HA   THR   6           HA       THR   6  -0.278  -4.315   8.252
   53    HB   THR   6           HB       THR   6  -0.821  -6.528   9.240
   54    HG1  THR   6           HG1      THR   6  -1.210  -7.163   6.747
   55   1HG2  THR   6          HG21      THR   6  -3.212  -6.080   9.494
   56   2HG2  THR   6          HG22      THR   6  -3.200  -5.078   8.041
   57   3HG2  THR   6          HG23      THR   6  -2.322  -4.554   9.481
   58    H    ILE   7           HN       ILE   7   1.719  -4.816   8.734
   59    HA   ILE   7           HA       ILE   7   3.226  -6.660   6.965
   60    HB   ILE   7           HB       ILE   7   3.901  -4.063   8.325
   61   1HG1  ILE   7          HG12      ILE   7   4.484  -5.070   5.520
   62   2HG1  ILE   7          HG11      ILE   7   3.024  -4.182   5.951
   63   1HG2  ILE   7          HG21      ILE   7   5.778  -6.290   7.482
   64   2HG2  ILE   7          HG22      ILE   7   5.787  -5.358   8.978
   65   3HG2  ILE   7          HG23      ILE   7   6.316  -4.609   7.472
   66   1HD1  ILE   7          HD11      ILE   7   5.734  -3.049   6.628
   67   2HD1  ILE   7          HD12      ILE   7   4.203  -2.205   6.398
   68   3HD1  ILE   7          HD13      ILE   7   5.068  -2.856   5.007
   69    H    ALA   8           HN       ALA   8   4.243  -8.362   7.924
   70    HA   ALA   8           HA       ALA   8   3.710  -9.021  10.614
   71   1HB   ALA   8          HB1       ALA   8   5.654 -10.097   8.570
   72   2HB   ALA   8          HB2       ALA   8   4.125 -10.805   9.094
   73   3HB   ALA   8          HB3       ALA   8   5.509 -10.789  10.186
   74    H    LYS   9           HN       LYS   9   4.673  -8.568  12.342
   75    HA   LYS   9           HA       LYS   9   6.612  -6.583  12.607
   76   1HB   LYS   9          HB2       LYS   9   4.991  -7.139  14.399
   77   2HB   LYS   9          HB1       LYS   9   5.777  -8.693  14.630
   78   1HG   LYS   9          HG2       LYS   9   7.862  -7.542  15.321
   79   2HG   LYS   9          HG1       LYS   9   7.072  -5.977  15.101
   80   1HD   LYS   9          HD2       LYS   9   5.431  -6.503  16.811
   81   2HD   LYS   9          HD1       LYS   9   6.082  -8.134  16.981
   82   1HE   LYS   9          HE2       LYS   9   6.953  -6.709  18.771
   83   2HE   LYS   9          HE1       LYS   9   8.262  -7.165  17.680
   84   1HZ   LYS   9          HZ1       LYS   9   8.064  -5.056  16.568
   85   2HZ   LYS   9          HZ2       LYS   9   8.283  -4.793  18.232
   86   3HZ   LYS   9          HZ3       LYS   9   6.743  -4.619  17.537
   87    H    THR  10           HN       THR  10   6.981  -9.991  12.138
   88    HA   THR  10           HA       THR  10   9.590 -10.383  13.157
   89    HB   THR  10           HB       THR  10   9.643 -12.201  11.361
   90    HG1  THR  10           HG1      THR  10   8.242 -11.867   9.850
   91   1HG2  THR  10          HG21      THR  10   8.875 -12.586  13.691
   92   2HG2  THR  10          HG22      THR  10   7.998 -13.580  12.529
   93   3HG2  THR  10          HG23      THR  10   7.239 -12.142  13.207
   94    H    SER  11           HN       SER  11   8.412  -8.440  10.645
   95    HA   SER  11           HA       SER  11  11.119  -8.218   9.431
   96   1HB   SER  11          HB2       SER  11  10.060  -7.670   7.332
   97   2HB   SER  11          HB1       SER  11   9.377  -9.186   7.911
   98    HG   SER  11           HG       SER  11   7.772  -7.634   8.950
   99    HA   PRO  12           HA       PRO  12   9.945  -4.082  11.228
  100   1HB   PRO  12          HB2       PRO  12  12.603  -3.889  12.337
  101   2HB   PRO  12          HB1       PRO  12  11.083  -4.086  13.225
  102   1HG   PRO  12          HG2       PRO  12  13.092  -5.991  13.072
  103   2HG   PRO  12          HG1       PRO  12  11.406  -6.318  13.504
  104   1HD   PRO  12          HD2       PRO  12  12.806  -6.778  10.895
  105   2HD   PRO  12          HD1       PRO  12  11.502  -7.701  11.660
  106    H    LEU  13           HN       LEU  13  10.054  -2.274  10.259
  107    HA   LEU  13           HA       LEU  13  12.169  -1.929   8.221
  108   1HB   LEU  13          HB2       LEU  13   9.502  -0.505   8.437
  109   2HB   LEU  13          HB1       LEU  13  10.615  -0.474   7.074
  110    HG   LEU  13           HG       LEU  13   8.980  -2.828   8.060
  111   1HD1  LEU  13          HD11      LEU  13   7.962  -1.084   6.492
  112   2HD1  LEU  13          HD12      LEU  13   7.940  -2.746   5.905
  113   3HD1  LEU  13          HD13      LEU  13   9.139  -1.612   5.286
  114   1HD2  LEU  13          HD21      LEU  13  11.045  -3.851   7.507
  115   2HD2  LEU  13          HD22      LEU  13  11.348  -2.735   6.179
  116   3HD2  LEU  13          HD23      LEU  13  10.111  -3.982   6.020
  117    HA   PRO  14           HA       PRO  14  14.063   1.204  10.617
  118   1HB   PRO  14          HB2       PRO  14  14.218   3.254   8.557
  119   2HB   PRO  14          HB1       PRO  14  15.509   2.188   9.133
  120   1HG   PRO  14          HG2       PRO  14  13.898   1.981   6.707
  121   2HG   PRO  14          HG1       PRO  14  15.396   1.143   7.127
  122   1HD   PRO  14          HD2       PRO  14  12.891  -0.066   6.999
  123   2HD   PRO  14          HD1       PRO  14  14.274  -0.716   7.899
  124    H    ALA  15           HN       ALA  15  13.696   3.045  11.740
  125    HA   ALA  15           HA       ALA  15  11.086   3.690  12.423
  126   1HB   ALA  15          HB1       ALA  15  12.015   5.218  13.931
  127   2HB   ALA  15          HB2       ALA  15  13.392   5.559  12.881
  128   3HB   ALA  15          HB3       ALA  15  13.276   4.005  13.706
  129    H    GLY  16           HN       GLY  16  10.899   4.103   9.696
  130   1HA   GLY  16          HA2       GLY  16   9.799   6.722   9.533
  131   2HA   GLY  16          HA1       GLY  16  11.340   6.706   8.730
  132    H    ALA  17           HN       ALA  17  10.786   3.738   8.221
  133    HA   ALA  17           HA       ALA  17   9.935   4.092   5.522
  134   1HB   ALA  17          HB1       ALA  17   9.988   1.429   5.731
  135   2HB   ALA  17          HB2       ALA  17  10.852   1.825   7.218
  136   3HB   ALA  17          HB3       ALA  17  11.476   2.376   5.670
  137    H    ILE  18           HN       ILE  18   8.156   2.759   8.276
  138    HA   ILE  18           HA       ILE  18   6.028   1.782   6.717
  139    HB   ILE  18           HB       ILE  18   6.123   2.869   9.537
  140   1HG1  ILE  18          HG12      ILE  18   7.285   0.648   8.757
  141   2HG1  ILE  18          HG11      ILE  18   6.328   0.647  10.230
  142   1HG2  ILE  18          HG21      ILE  18   3.878   1.575   9.721
  143   2HG2  ILE  18          HG22      ILE  18   3.803   1.757   7.969
  144   3HG2  ILE  18          HG23      ILE  18   3.859   3.184   9.002
  145   1HD1  ILE  18          HD11      ILE  18   5.070  -0.081   7.588
  146   2HD1  ILE  18          HD12      ILE  18   4.526  -0.479   9.212
  147   3HD1  ILE  18          HD13      ILE  18   5.945  -1.277   8.540
  148    H    ASP  19           HN       ASP  19   6.547   4.912   8.277
  149    HA   ASP  19           HA       ASP  19   4.170   6.107   7.301
  150   1HB   ASP  19          HB2       ASP  19   6.793   7.311   8.229
  151   2HB   ASP  19          HB1       ASP  19   5.389   8.280   7.783
  152    H    ALA  20           HN       ALA  20   7.413   5.844   5.884
  153    HA   ALA  20           HA       ALA  20   6.803   7.563   3.726
  154   1HB   ALA  20          HB1       ALA  20   9.122   6.636   4.514
  155   2HB   ALA  20          HB2       ALA  20   8.861   6.944   2.798
  156   3HB   ALA  20          HB3       ALA  20   8.765   5.298   3.424
  157    H    LEU  21           HN       LEU  21   6.468   4.071   4.149
  158    HA   LEU  21           HA       LEU  21   5.735   3.399   1.548
  159   1HB   LEU  21          HB2       LEU  21   6.431   1.724   3.119
  160   2HB   LEU  21          HB1       LEU  21   5.152   2.162   4.242
  161    HG   LEU  21           HG       LEU  21   3.478   1.394   2.603
  162   1HD1  LEU  21          HD11      LEU  21   4.392  -0.056   0.701
  163   2HD1  LEU  21          HD12      LEU  21   5.950   0.709   1.003
  164   3HD1  LEU  21          HD13      LEU  21   4.573   1.685   0.491
  165   1HD2  LEU  21          HD21      LEU  21   4.155  -0.193   4.266
  166   2HD2  LEU  21          HD22      LEU  21   5.659  -0.536   3.410
  167   3HD2  LEU  21          HD23      LEU  21   4.118  -1.063   2.732
  168    H    ALA  22           HN       ALA  22   3.732   4.205   4.365
  169    HA   ALA  22           HA       ALA  22   1.196   3.925   3.112
  170   1HB   ALA  22          HB1       ALA  22   1.998   5.769   5.381
  171   2HB   ALA  22          HB2       ALA  22   1.522   4.083   5.579
  172   3HB   ALA  22          HB3       ALA  22   0.356   5.264   4.981
  173    H    GLY  23           HN       GLY  23   3.380   6.716   3.290
  174   1HA   GLY  23          HA2       GLY  23   1.545   8.528   2.026
  175   2HA   GLY  23          HA1       GLY  23   3.306   8.698   2.214
  176    H    GLU  24           HN       GLU  24   4.156   6.442   0.701
  177    HA   GLU  24           HA       GLU  24   3.796   7.464  -1.911
  178   1HB   GLU  24          HB2       GLU  24   5.823   6.187  -1.251
  179   2HB   GLU  24          HB1       GLU  24   4.848   4.728  -1.093
  180   1HG   GLU  24          HG2       GLU  24   4.204   4.932  -3.504
  181   2HG   GLU  24          HG1       GLU  24   5.259   6.338  -3.636
  182    H    LEU  25           HN       LEU  25   2.348   4.670  -0.264
  183    HA   LEU  25           HA       LEU  25   0.991   3.664  -2.510
  184   1HB   LEU  25          HB2       LEU  25   0.418   3.425   0.435
  185   2HB   LEU  25          HB1       LEU  25  -0.528   2.588  -0.793
  186    HG   LEU  25           HG       LEU  25   2.490   2.344  -0.555
  187   1HD1  LEU  25          HD11      LEU  25   1.373   1.497   1.482
  188   2HD1  LEU  25          HD12      LEU  25   2.063   0.179   0.538
  189   3HD1  LEU  25          HD13      LEU  25   0.328   0.486   0.485
  190   1HD2  LEU  25          HD21      LEU  25   1.775   0.091  -1.796
  191   2HD2  LEU  25          HD22      LEU  25   1.977   1.578  -2.712
  192   3HD2  LEU  25          HD23      LEU  25   0.362   1.041  -2.254
  193    H    SER  26           HN       SER  26  -0.076   6.042  -0.090
  194    HA   SER  26           HA       SER  26  -2.751   6.207  -0.965
  195   1HB   SER  26          HB2       SER  26  -2.903   8.234   0.267
  196   2HB   SER  26          HB1       SER  26  -1.761   7.221   1.148
  197    HG   SER  26           HG       SER  26  -0.126   8.362  -0.200
  198    H    ARG  27           HN       ARG  27   0.131   8.075  -1.984
  199    HA   ARG  27           HA       ARG  27  -1.229   9.785  -3.780
  200   1HB   ARG  27          HB2       ARG  27   1.106  10.180  -3.064
  201   2HB   ARG  27          HB1       ARG  27   1.614   8.738  -3.943
  202   1HG   ARG  27          HG2       ARG  27   0.912   9.712  -6.057
  203   2HG   ARG  27          HG1       ARG  27   0.224  11.106  -5.227
  204   1HD   ARG  27          HD2       ARG  27   2.425  11.792  -4.457
  205   2HD   ARG  27          HD1       ARG  27   3.154  10.338  -5.133
  206    HE   ARG  27           HE       ARG  27   2.256  12.691  -6.617
  207   1HH1  ARG  27          HH21      ARG  27   4.916  11.163  -6.910
  208   2HH1  ARG  27          HH22      ARG  27   4.697  10.414  -8.458
  209   1HH2  ARG  27          HH11      ARG  27   1.271  10.950  -8.526
  210   2HH2  ARG  27          HH12      ARG  27   2.633  10.296  -9.373
  211    H    ARG  28           HN       ARG  28   0.182   6.557  -4.227
  212    HA   ARG  28           HA       ARG  28  -0.255   6.381  -7.014
  213   1HB   ARG  28          HB2       ARG  28  -0.034   4.269  -4.867
  214   2HB   ARG  28          HB1       ARG  28  -0.159   3.894  -6.589
  215   1HG   ARG  28          HG2       ARG  28   1.839   5.272  -7.041
  216   2HG   ARG  28          HG1       ARG  28   1.969   5.645  -5.322
  217   1HD   ARG  28          HD2       ARG  28   2.259   3.251  -4.819
  218   2HD   ARG  28          HD1       ARG  28   2.126   2.874  -6.534
  219    HE   ARG  28           HE       ARG  28   4.421   4.049  -5.189
  220   1HH1  ARG  28          HH11      ARG  28   4.001   5.787  -7.564
  221   2HH1  ARG  28          HH12      ARG  28   4.865   4.954  -8.812
  222   1HH2  ARG  28          HH21      ARG  28   5.006   1.954  -7.082
  223   2HH2  ARG  28          HH22      ARG  28   5.428   2.783  -8.543
  224    H    ILE  29           HN       ILE  29  -2.271   5.536  -4.251
  225    HA   ILE  29           HA       ILE  29  -4.372   4.301  -5.691
  226    HB   ILE  29           HB       ILE  29  -4.261   5.625  -2.986
  227   1HG1  ILE  29          HG12      ILE  29  -2.996   3.514  -3.270
  228   2HG1  ILE  29          HG11      ILE  29  -4.345   3.310  -2.165
  229   1HG2  ILE  29          HG21      ILE  29  -6.548   5.848  -3.606
  230   2HG2  ILE  29          HG22      ILE  29  -6.466   4.402  -2.603
  231   3HG2  ILE  29          HG23      ILE  29  -6.578   4.253  -4.356
  232   1HD1  ILE  29          HD11      ILE  29  -3.895   2.135  -4.863
  233   2HD1  ILE  29          HD12      ILE  29  -5.556   2.579  -4.488
  234   3HD1  ILE  29          HD13      ILE  29  -4.695   1.443  -3.458
  235    H    GLN  30           HN       GLN  30  -3.930   7.638  -4.603
  236    HA   GLN  30           HA       GLN  30  -6.449   8.621  -5.525
  237   1HB   GLN  30          HB2       GLN  30  -5.019   9.847  -3.897
  238   2HB   GLN  30          HB1       GLN  30  -3.843  10.132  -5.178
  239   1HG   GLN  30          HG2       GLN  30  -5.540  11.374  -6.474
  240   2HG   GLN  30          HG1       GLN  30  -6.732  11.076  -5.209
  241   1HE2  GLN  30          HE21      GLN  30  -5.799  13.728  -6.060
  242   2HE2  GLN  30          HE22      GLN  30  -5.053  14.436  -4.710
  243    H    TYR  31           HN       TYR  31  -3.288   8.432  -7.225
  244    HA   TYR  31           HA       TYR  31  -4.244   9.836  -9.493
  245   1HB   TYR  31          HB2       TYR  31  -1.826   9.479  -9.114
  246   2HB   TYR  31          HB1       TYR  31  -2.052   7.744  -9.344
  247    HD1  TYR  31           HD1      TYR  31  -2.317  11.056 -11.012
  248    HD2  TYR  31           HD2      TYR  31  -2.257   6.791 -11.537
  249    HE1  TYR  31           HE1      TYR  31  -2.148  11.360 -13.468
  250    HE2  TYR  31           HE2      TYR  31  -2.084   7.098 -13.993
  251    HH   TYR  31           HH       TYR  31  -1.353   8.803 -15.587
  252    H    ALA  32           HN       ALA  32  -4.253   6.408  -8.625
  253    HA   ALA  32           HA       ALA  32  -5.220   5.484 -11.133
  254   1HB   ALA  32          HB1       ALA  32  -4.104   3.935  -9.731
  255   2HB   ALA  32          HB2       ALA  32  -5.789   3.417  -9.791
  256   3HB   ALA  32          HB3       ALA  32  -5.179   4.274  -8.375
  257    H    PHE  33           HN       PHE  33  -6.786   6.453  -8.126
  258    HA   PHE  33           HA       PHE  33  -9.456   6.158  -9.415
  259   1HB   PHE  33          HB2       PHE  33  -8.712   5.917  -6.497
  260   2HB   PHE  33          HB1       PHE  33 -10.351   5.856  -7.148
  261    HD1  PHE  33           HD1      PHE  33 -11.039   4.012  -8.674
  262    HD2  PHE  33           HD2      PHE  33  -7.210   4.052  -6.730
  263    HE1  PHE  33           HE1      PHE  33 -10.750   1.605  -9.195
  264    HE2  PHE  33           HE2      PHE  33  -6.921   1.645  -7.249
  265    HZ   PHE  33           HZ       PHE  33  -8.691   0.421  -8.483
  266    HA   PRO  34           HA       PRO  34  -8.836  10.655  -8.560
  267   1HB   PRO  34          HB2       PRO  34 -10.412  11.229 -10.921
  268   2HB   PRO  34          HB1       PRO  34  -8.690  11.519 -10.644
  269   1HG   PRO  34          HG2       PRO  34  -9.751   9.645 -12.400
  270   2HG   PRO  34          HG1       PRO  34  -8.089   9.662 -11.788
  271   1HD   PRO  34          HD2       PRO  34 -10.374   7.930 -10.973
  272   2HD   PRO  34          HD1       PRO  34  -8.626   7.607 -10.927
  273    H    ASP  35           HN       ASP  35 -11.675   8.807  -9.350
  274    HA   ASP  35           HA       ASP  35 -13.559  10.824  -8.421
  275   1HB   ASP  35          HB2       ASP  35 -13.945   9.441 -10.459
  276   2HB   ASP  35          HB1       ASP  35 -14.118   8.035  -9.410
  277    H    ASN  36           HN       ASN  36 -11.890   8.210  -6.855
  278    HA   ASN  36           HA       ASN  36 -14.093   8.037  -4.861
  279   1HB   ASN  36          HB2       ASN  36 -12.133   5.908  -5.678
  280   2HB   ASN  36          HB1       ASN  36 -13.344   5.754  -4.412
  281   1HD2  ASN  36          HD21      ASN  36 -12.887   4.735  -7.450
  282   2HD2  ASN  36          HD22      ASN  36 -14.472   4.804  -8.052
  283    H    GLU  37           HN       GLU  37 -13.464   8.607  -2.683
  284    HA   GLU  37           HA       GLU  37 -10.908   9.506  -2.018
  285   1HB   GLU  37          HB2       GLU  37 -12.932  10.103  -0.846
  286   2HB   GLU  37          HB1       GLU  37 -13.191   8.430  -0.370
  287   1HG   GLU  37          HG2       GLU  37 -11.094   8.481   0.962
  288   2HG   GLU  37          HG1       GLU  37 -10.829  10.161   0.491
  289    H    GLY  38           HN       GLY  38  -9.111   8.245  -1.636
  290   1HA   GLY  38          HA2       GLY  38  -9.466   5.363  -0.891
  291   2HA   GLY  38          HA1       GLY  38  -8.116   5.876  -1.664
  292    H    HIS  39           HN       HIS  39  -8.922   4.868   1.353
  293    HA   HIS  39           HA       HIS  39  -7.032   6.740   2.638
  294   1HB   HIS  39          HB2       HIS  39  -9.276   6.773   3.660
  295   2HB   HIS  39          HB1       HIS  39  -9.206   5.026   3.886
  296    HD1  HIS  39           HD1      HIS  39  -7.764   4.124   5.818
  297    HD2  HIS  39           HD2      HIS  39  -7.538   8.266   5.399
  298    HE1  HIS  39           HE1      HIS  39  -6.589   4.991   7.888
  299    H    VAL  40           HN       VAL  40  -5.075   5.765   3.101
  300    HA   VAL  40           HA       VAL  40  -4.951   2.827   3.116
  301    HB   VAL  40           HB       VAL  40  -2.848   4.878   2.425
  302   1HG1  VAL  40          HG11      VAL  40  -1.700   2.751   1.556
  303   2HG1  VAL  40          HG12      VAL  40  -2.846   1.862   2.556
  304   3HG1  VAL  40          HG13      VAL  40  -1.714   2.990   3.303
  305   1HG2  VAL  40          HG21      VAL  40  -3.198   4.179   0.141
  306   2HG2  VAL  40          HG22      VAL  40  -4.786   4.570   0.807
  307   3HG2  VAL  40          HG23      VAL  40  -4.285   2.885   0.646
  308    H    SER  41           HN       SER  41  -4.276   1.840   4.887
  309    HA   SER  41           HA       SER  41  -2.791   3.384   6.938
  310   1HB   SER  41          HB2       SER  41  -5.094   3.076   7.732
  311   2HB   SER  41          HB1       SER  41  -4.969   1.340   7.469
  312    HG   SER  41           HG       SER  41  -4.329   2.649   9.627
  313    H    VAL  42           HN       VAL  42  -1.117   2.401   7.933
  314    HA   VAL  42           HA       VAL  42  -0.554  -0.407   7.211
  315    HB   VAL  42           HB       VAL  42   1.494   1.836   7.259
  316   1HG1  VAL  42          HG11      VAL  42   2.468  -0.270   7.944
  317   2HG1  VAL  42          HG12      VAL  42   2.979   0.061   6.288
  318   3HG1  VAL  42          HG13      VAL  42   1.699  -1.113   6.599
  319   1HG2  VAL  42          HG21      VAL  42   1.543   1.776   4.897
  320   2HG2  VAL  42          HG22      VAL  42  -0.178   1.739   5.280
  321   3HG2  VAL  42          HG23      VAL  42   0.658   0.256   4.826
  322    H    ARG  43           HN       ARG  43  -0.151  -1.659   8.891
  323    HA   ARG  43           HA       ARG  43   1.045  -0.489  11.289
  324   1HB   ARG  43          HB2       ARG  43  -1.497  -2.126  11.499
  325   2HB   ARG  43          HB1       ARG  43  -0.677  -1.244  12.786
  326   1HG   ARG  43          HG2       ARG  43  -1.113   0.878  11.498
  327   2HG   ARG  43          HG1       ARG  43  -2.105  -0.076  10.391
  328   1HD   ARG  43          HD2       ARG  43  -2.556   0.086  13.383
  329   2HD   ARG  43          HD1       ARG  43  -3.445   1.030  12.191
  330    HE   ARG  43           HE       ARG  43  -3.856  -1.744  12.820
  331   1HH1  ARG  43          HH21      ARG  43  -4.103   0.748  10.440
  332   2HH1  ARG  43          HH22      ARG  43  -5.256  -0.101   9.465
  333   1HH2  ARG  43          HH11      ARG  43  -5.309  -2.906  11.504
  334   2HH2  ARG  43          HH12      ARG  43  -5.938  -2.170  10.067
  335    H    TYR  44           HN       TYR  44   1.770  -2.132  12.835
  336    HA   TYR  44           HA       TYR  44   2.717  -4.549  11.475
  337   1HB   TYR  44          HB2       TYR  44   3.145  -3.473  14.285
  338   2HB   TYR  44          HB1       TYR  44   3.851  -4.967  13.680
  339    HD1  TYR  44           HD1      TYR  44   5.081  -4.691  11.298
  340    HD2  TYR  44           HD2      TYR  44   4.465  -1.550  14.168
  341    HE1  TYR  44           HE1      TYR  44   6.973  -3.420  10.318
  342    HE2  TYR  44           HE2      TYR  44   6.353  -0.283  13.191
  343    HH   TYR  44           HH       TYR  44   8.592  -1.647  11.088
  344    H    ALA  45           HN       ALA  45   2.017  -6.557  11.765
  345    HA   ALA  45           HA       ALA  45   0.011  -7.118  13.835
  346   1HB   ALA  45          HB1       ALA  45  -0.412  -8.033  10.990
  347   2HB   ALA  45          HB2       ALA  45  -1.072  -6.503  11.567
  348   3HB   ALA  45          HB3       ALA  45  -1.565  -8.017  12.325
  349    H    ALA  46           HN       ALA  46  -0.361  -9.581  13.906
  350    HA   ALA  46           HA       ALA  46   2.159 -10.824  14.175
  351   1HB   ALA  46          HB1       ALA  46   0.958 -12.849  14.717
  352   2HB   ALA  46          HB2       ALA  46  -0.503 -12.252  13.928
  353   3HB   ALA  46          HB3       ALA  46   0.066 -11.500  15.419
  354    H    ALA  47           HN       ALA  47   0.004 -10.608  11.425
  355    HA   ALA  47           HA       ALA  47   2.020 -12.114   9.869
  356   1HB   ALA  47          HB1       ALA  47   0.221 -13.308   8.671
  357   2HB   ALA  47          HB2       ALA  47  -0.969 -12.584   9.754
  358   3HB   ALA  47          HB3       ALA  47   0.236 -13.704  10.389
  359    H    ASN  48           HN       ASN  48   2.150 -11.654   7.662
  360    HA   ASN  48           HA       ASN  48   1.481  -8.953   6.906
  361   1HB   ASN  48          HB2       ASN  48   2.376  -9.637   4.695
  362   2HB   ASN  48          HB1       ASN  48   3.488 -10.013   6.009
  363   1HD2  ASN  48          HD21      ASN  48   3.271 -11.369   3.346
  364   2HD2  ASN  48          HD22      ASN  48   2.956 -13.000   3.693
  365    H    ASN  49           HN       ASN  49  -0.413  -8.285   6.011
  366    HA   ASN  49           HA       ASN  49  -2.043 -10.129   4.443
  367   1HB   ASN  49          HB2       ASN  49  -2.659 -10.314   6.952
  368   2HB   ASN  49          HB1       ASN  49  -3.339  -8.702   6.764
  369   1HD2  ASN  49          HD21      ASN  49  -5.486  -9.751   7.196
  370   2HD2  ASN  49          HD22      ASN  49  -6.281 -10.552   5.929
  371    H    LEU  50           HN       LEU  50  -3.535  -9.062   3.109
  372    HA   LEU  50           HA       LEU  50  -3.438  -6.100   3.092
  373   1HB   LEU  50          HB2       LEU  50  -2.060  -7.040   1.246
  374   2HB   LEU  50          HB1       LEU  50  -3.448  -7.981   0.706
  375    HG   LEU  50           HG       LEU  50  -4.721  -5.880   0.340
  376   1HD1  LEU  50          HD11      LEU  50  -3.141  -3.766   0.269
  377   2HD1  LEU  50          HD12      LEU  50  -2.231  -4.668   1.482
  378   3HD1  LEU  50          HD13      LEU  50  -3.924  -4.261   1.767
  379   1HD2  LEU  50          HD21      LEU  50  -3.361  -5.049  -1.604
  380   2HD2  LEU  50          HD22      LEU  50  -3.525  -6.804  -1.568
  381   3HD2  LEU  50          HD23      LEU  50  -2.020  -6.046  -1.040
  382    H    SER  51           HN       SER  51  -5.513  -5.328   3.378
  383    HA   SER  51           HA       SER  51  -7.774  -7.067   2.544
  384   1HB   SER  51          HB2       SER  51  -7.453  -5.303   4.973
  385   2HB   SER  51          HB1       SER  51  -9.002  -5.951   4.439
  386    HG   SER  51           HG       SER  51  -6.950  -7.787   4.565
  387    H    VAL  52           HN       VAL  52  -9.181  -6.103   1.151
  388    HA   VAL  52           HA       VAL  52  -9.146  -3.162   0.920
  389    HB   VAL  52           HB       VAL  52  -9.472  -5.161  -1.331
  390   1HG1  VAL  52          HG11      VAL  52  -9.389  -2.991  -2.690
  391   2HG1  VAL  52          HG12      VAL  52  -9.675  -2.144  -1.170
  392   3HG1  VAL  52          HG13      VAL  52 -10.876  -3.279  -1.787
  393   1HG2  VAL  52          HG21      VAL  52  -7.366  -4.140  -2.149
  394   2HG2  VAL  52          HG22      VAL  52  -7.138  -4.898  -0.572
  395   3HG2  VAL  52          HG23      VAL  52  -7.291  -3.145  -0.696
  396    H    ILE  53           HN       ILE  53 -11.111  -2.261   1.283
  397    HA   ILE  53           HA       ILE  53 -13.519  -3.988   1.029
  398    HB   ILE  53           HB       ILE  53 -13.047  -1.713   2.972
  399   1HG1  ILE  53          HG12      ILE  53 -13.330  -4.662   3.611
  400   2HG1  ILE  53          HG11      ILE  53 -11.754  -3.907   3.360
  401   1HG2  ILE  53          HG21      ILE  53 -15.171  -2.646   3.975
  402   2HG2  ILE  53          HG22      ILE  53 -15.333  -3.655   2.538
  403   3HG2  ILE  53          HG23      ILE  53 -15.385  -1.898   2.392
  404   1HD1  ILE  53          HD11      ILE  53 -12.206  -2.307   5.158
  405   2HD1  ILE  53          HD12      ILE  53 -12.389  -3.955   5.760
  406   3HD1  ILE  53          HD13      ILE  53 -13.817  -2.990   5.383
  407    H    GLY  54           HN       GLY  54 -15.037  -3.287  -0.358
  408   1HA   GLY  54          HA2       GLY  54 -16.468  -1.659  -1.312
  409   2HA   GLY  54          HA1       GLY  54 -15.298  -0.412  -0.891
  410    H    ALA  55           HN       ALA  55 -13.946  -3.205  -2.435
  411    HA   ALA  55           HA       ALA  55 -13.867  -1.712  -5.005
  412   1HB   ALA  55          HB1       ALA  55 -11.585  -2.147  -5.257
  413   2HB   ALA  55          HB2       ALA  55 -11.602  -3.467  -4.087
  414   3HB   ALA  55          HB3       ALA  55 -11.721  -1.797  -3.533
  415    H    THR  56           HN       THR  56 -13.358  -2.958  -6.876
  416    HA   THR  56           HA       THR  56 -14.801  -5.533  -7.092
  417    HB   THR  56           HB       THR  56 -14.710  -5.072  -9.420
  418    HG1  THR  56           HG1      THR  56 -12.538  -4.195  -9.307
  419   1HG2  THR  56          HG21      THR  56 -15.953  -3.013  -9.539
  420   2HG2  THR  56          HG22      THR  56 -15.207  -2.413  -8.059
  421   3HG2  THR  56          HG23      THR  56 -16.341  -3.763  -7.990
  422    H    LYS  57           HN       LYS  57 -13.862  -7.265  -8.169
  423    HA   LYS  57           HA       LYS  57 -11.367  -8.040  -7.227
  424   1HB   LYS  57          HB2       LYS  57 -12.835  -9.055  -9.678
  425   2HB   LYS  57          HB1       LYS  57 -11.525  -9.893  -8.855
  426   1HG   LYS  57          HG2       LYS  57 -12.916 -10.047  -6.799
  427   2HG   LYS  57          HG1       LYS  57 -14.224  -9.200  -7.634
  428   1HD   LYS  57          HD2       LYS  57 -14.330 -11.005  -9.303
  429   2HD   LYS  57          HD1       LYS  57 -13.008 -11.843  -8.489
  430   1HE   LYS  57          HE2       LYS  57 -15.138 -12.808  -7.779
  431   2HE   LYS  57          HE1       LYS  57 -14.395 -11.959  -6.424
  432   1HZ   LYS  57          HZ1       LYS  57 -16.868 -11.441  -7.735
  433   2HZ   LYS  57          HZ2       LYS  57 -15.879 -10.058  -7.725
  434   3HZ   LYS  57          HZ3       LYS  57 -16.282 -10.830  -6.265
  435    H    GLU  58           HN       GLU  58 -12.142  -6.558 -10.428
  436    HA   GLU  58           HA       GLU  58  -9.519  -6.915 -11.471
  437   1HB   GLU  58          HB2       GLU  58 -11.862  -5.143 -12.144
  438   2HB   GLU  58          HB1       GLU  58 -10.312  -4.930 -12.957
  439   1HG   GLU  58          HG2       GLU  58 -10.354  -7.261 -13.710
  440   2HG   GLU  58          HG1       GLU  58 -11.863  -7.540 -12.844
  441    H    ASP  59           HN       ASP  59 -11.064  -4.389  -9.536
  442    HA   ASP  59           HA       ASP  59  -8.973  -2.493  -9.724
  443   1HB   ASP  59          HB2       ASP  59 -11.073  -2.979  -7.599
  444   2HB   ASP  59          HB1       ASP  59  -9.949  -1.623  -7.554
  445    H    LYS  60           HN       LYS  60  -9.738  -5.086  -7.467
  446    HA   LYS  60           HA       LYS  60  -7.534  -4.662  -5.728
  447   1HB   LYS  60          HB2       LYS  60  -9.240  -7.105  -6.255
  448   2HB   LYS  60          HB1       LYS  60  -7.958  -7.071  -5.045
  449   1HG   LYS  60          HG2       LYS  60  -9.043  -5.334  -3.806
  450   2HG   LYS  60          HG1       LYS  60 -10.194  -5.038  -5.110
  451   1HD   LYS  60          HD2       LYS  60 -11.305  -6.330  -3.380
  452   2HD   LYS  60          HD1       LYS  60 -11.072  -7.362  -4.789
  453   1HE   LYS  60          HE2       LYS  60  -9.250  -8.512  -3.778
  454   2HE   LYS  60          HE1       LYS  60  -9.082  -7.293  -2.514
  455   1HZ   LYS  60          HZ1       LYS  60 -11.605  -8.780  -2.805
  456   2HZ   LYS  60          HZ2       LYS  60 -10.951  -8.037  -1.425
  457   3HZ   LYS  60          HZ3       LYS  60 -10.294  -9.495  -2.001
  458    H    GLN  61           HN       GLN  61  -7.760  -6.675  -8.685
  459    HA   GLN  61           HA       GLN  61  -5.183  -7.840  -8.279
  460   1HB   GLN  61          HB2       GLN  61  -6.759  -7.304 -10.820
  461   2HB   GLN  61          HB1       GLN  61  -5.256  -8.224 -10.764
  462   1HG   GLN  61          HG2       GLN  61  -7.706  -8.937  -9.133
  463   2HG   GLN  61          HG1       GLN  61  -7.353  -9.635 -10.711
  464   1HE2  GLN  61          HE21      GLN  61  -7.354 -10.815  -7.845
  465   2HE2  GLN  61          HE22      GLN  61  -5.851 -11.598  -7.740
  466    H    ARG  62           HN       ARG  62  -6.350  -4.870  -9.908
  467    HA   ARG  62           HA       ARG  62  -3.856  -4.085 -10.907
  468   1HB   ARG  62          HB2       ARG  62  -5.937  -3.028 -11.668
  469   2HB   ARG  62          HB1       ARG  62  -6.214  -2.369 -10.057
  470   1HG   ARG  62          HG2       ARG  62  -4.200  -1.001 -10.226
  471   2HG   ARG  62          HG1       ARG  62  -3.804  -1.720 -11.788
  472   1HD   ARG  62          HD2       ARG  62  -6.325  -0.144 -11.207
  473   2HD   ARG  62          HD1       ARG  62  -4.901   0.503 -12.017
  474    HE   ARG  62           HE       ARG  62  -6.914  -1.157 -13.197
  475   1HH1  ARG  62          HH21      ARG  62  -5.439   0.745 -14.876
  476   2HH1  ARG  62          HH22      ARG  62  -4.346  -0.257 -15.771
  477   1HH2  ARG  62          HH11      ARG  62  -4.674  -2.974 -13.639
  478   2HH2  ARG  62          HH12      ARG  62  -3.916  -2.365 -15.073
  479    H    ILE  63           HN       ILE  63  -5.434  -3.370  -7.822
  480    HA   ILE  63           HA       ILE  63  -3.365  -1.729  -6.831
  481    HB   ILE  63           HB       ILE  63  -5.376  -3.423  -5.370
  482   1HG1  ILE  63          HG12      ILE  63  -5.191  -0.416  -5.559
  483   2HG1  ILE  63          HG11      ILE  63  -6.089  -1.379  -6.733
  484   1HG2  ILE  63          HG21      ILE  63  -3.298  -1.510  -4.295
  485   2HG2  ILE  63          HG22      ILE  63  -3.548  -3.194  -3.835
  486   3HG2  ILE  63          HG23      ILE  63  -4.732  -1.970  -3.376
  487   1HD1  ILE  63          HD11      ILE  63  -7.503  -2.290  -4.966
  488   2HD1  ILE  63          HD12      ILE  63  -7.536  -0.528  -4.886
  489   3HD1  ILE  63          HD13      ILE  63  -6.559  -1.447  -3.738
  490    H    SER  64           HN       SER  64  -3.770  -5.231  -6.652
  491    HA   SER  64           HA       SER  64  -1.480  -5.712  -5.040
  492   1HB   SER  64          HB2       SER  64  -3.146  -7.480  -5.587
  493   2HB   SER  64          HB1       SER  64  -2.607  -7.444  -7.264
  494    HG   SER  64           HG       SER  64  -1.312  -8.950  -6.490
  495    H    GLU  65           HN       GLU  65  -1.905  -5.391  -8.623
  496    HA   GLU  65           HA       GLU  65   0.789  -5.865  -9.248
  497   1HB   GLU  65          HB2       GLU  65  -1.348  -4.286 -10.694
  498   2HB   GLU  65          HB1       GLU  65   0.265  -4.550 -11.358
  499   1HG   GLU  65          HG2       GLU  65  -0.055  -6.984 -11.205
  500   2HG   GLU  65          HG1       GLU  65  -1.658  -6.740 -10.515
  501    H    ILE  66           HN       ILE  66  -0.898  -2.836  -8.450
  502    HA   ILE  66           HA       ILE  66   1.276  -1.106  -8.910
  503    HB   ILE  66           HB       ILE  66  -1.054  -0.888  -6.991
  504   1HG1  ILE  66          HG12      ILE  66  -0.449   0.577  -9.577
  505   2HG1  ILE  66          HG11      ILE  66  -1.423  -0.891  -9.506
  506   1HG2  ILE  66          HG21      ILE  66   1.166   1.062  -7.650
  507   2HG2  ILE  66          HG22      ILE  66   0.627   0.535  -6.056
  508   3HG2  ILE  66          HG23      ILE  66  -0.395   1.594  -7.025
  509   1HD1  ILE  66          HD11      ILE  66  -2.674   1.370  -9.441
  510   2HD1  ILE  66          HD12      ILE  66  -2.078   1.506  -7.788
  511   3HD1  ILE  66          HD13      ILE  66  -3.124   0.160  -8.240
  512    H    LEU  67           HN       LEU  67   0.299  -2.820  -5.981
  513    HA   LEU  67           HA       LEU  67   2.311  -1.797  -4.291
  514   1HB   LEU  67          HB2       LEU  67   0.467  -3.014  -3.299
  515   2HB   LEU  67          HB1       LEU  67   0.816  -4.435  -4.271
  516    HG   LEU  67           HG       LEU  67   3.050  -4.621  -3.071
  517   1HD1  LEU  67          HD11      LEU  67   2.907  -3.391  -0.734
  518   2HD1  LEU  67          HD12      LEU  67   1.884  -2.255  -1.610
  519   3HD1  LEU  67          HD13      LEU  67   3.545  -2.537  -2.135
  520   1HD2  LEU  67          HD21      LEU  67   2.092  -5.684  -1.137
  521   2HD2  LEU  67          HD22      LEU  67   0.943  -5.886  -2.458
  522   3HD2  LEU  67          HD23      LEU  67   0.654  -4.668  -1.216
  523    H    GLN  68           HN       GLN  68   2.249  -4.570  -6.482
  524    HA   GLN  68           HA       GLN  68   4.823  -5.555  -5.795
  525   1HB   GLN  68          HB2       GLN  68   3.203  -6.888  -7.096
  526   2HB   GLN  68          HB1       GLN  68   3.347  -5.751  -8.435
  527   1HG   GLN  68          HG2       GLN  68   5.679  -6.299  -8.741
  528   2HG   GLN  68          HG1       GLN  68   5.695  -7.265  -7.265
  529   1HE2  GLN  68          HE21      GLN  68   6.488  -8.582  -9.564
  530   2HE2  GLN  68          HE22      GLN  68   5.274  -9.649 -10.085
  531    H    GLU  69           HN       GLU  69   3.845  -3.375  -8.501
  532    HA   GLU  69           HA       GLU  69   6.435  -2.962  -9.454
  533   1HB   GLU  69          HB2       GLU  69   3.956  -1.237  -9.572
  534   2HB   GLU  69          HB1       GLU  69   5.444  -0.852 -10.440
  535   1HG   GLU  69          HG2       GLU  69   5.343  -3.026 -11.593
  536   2HG   GLU  69          HG1       GLU  69   3.864  -3.424 -10.722
  537    H    THR  70           HN       THR  70   4.637  -1.030  -7.055
  538    HA   THR  70           HA       THR  70   6.558   0.992  -6.745
  539    HB   THR  70           HB       THR  70   4.690  -0.129  -4.683
  540    HG1  THR  70           HG1      THR  70   3.775   0.677  -6.684
  541   1HG2  THR  70          HG21      THR  70   6.206   1.213  -3.493
  542   2HG2  THR  70          HG22      THR  70   4.893   2.327  -3.878
  543   3HG2  THR  70          HG23      THR  70   6.377   2.352  -4.830
  544    H    TRP  71           HN       TRP  71   6.056  -2.000  -5.041
  545    HA   TRP  71           HA       TRP  71   8.131  -1.836  -3.224
  546   1HB   TRP  71          HB2       TRP  71   6.179  -3.343  -3.149
  547   2HB   TRP  71          HB1       TRP  71   6.886  -4.271  -4.458
  548    HD1  TRP  71           HD1      TRP  71   7.704  -6.437  -3.468
  549    HE1  TRP  71           HE1      TRP  71   9.096  -7.152  -1.427
  550    HE3  TRP  71           HE3      TRP  71   8.201  -1.924  -1.044
  551    HZ2  TRP  71           HZ2      TRP  71  10.242  -6.003   0.910
  552    HZ3  TRP  71           HZ3      TRP  71   9.434  -1.794   1.085
  553    HH2  TRP  71           HH2      TRP  71  10.449  -3.823   2.072
  554    H    GLU  72           HN       GLU  72   8.116  -3.128  -6.495
  555    HA   GLU  72           HA       GLU  72  10.823  -4.036  -6.370
  556   1HB   GLU  72          HB2       GLU  72   8.963  -3.598  -8.713
  557   2HB   GLU  72          HB1       GLU  72  10.602  -4.223  -8.889
  558   1HG   GLU  72          HG2       GLU  72  10.058  -6.092  -7.375
  559   2HG   GLU  72          HG1       GLU  72   8.417  -5.472  -7.196
  560    H    SER  73           HN       SER  73   9.476  -0.885  -6.848
  561    HA   SER  73           HA       SER  73  12.009   0.027  -8.097
  562   1HB   SER  73          HB2       SER  73   9.270   1.301  -7.958
  563   2HB   SER  73          HB1       SER  73  10.701   2.127  -8.571
  564    HG   SER  73           HG       SER  73  10.704   0.863 -10.291
  565    H    ALA  74           HN       ALA  74  11.377  -0.584  -5.176
  566    HA   ALA  74           HA       ALA  74  11.129   1.558  -3.558
  567   1HB   ALA  74          HB1       ALA  74  12.915  -0.825  -3.174
  568   2HB   ALA  74          HB2       ALA  74  11.187  -0.748  -2.833
  569   3HB   ALA  74          HB3       ALA  74  12.315   0.235  -1.898
  570    H    ASP  75           HN       ASP  75  14.135   0.721  -5.224
  571    HA   ASP  75           HA       ASP  75  15.846   2.316  -3.599
  572   1HB   ASP  75          HB2       ASP  75  16.117   1.224  -6.394
  573   2HB   ASP  75          HB1       ASP  75  17.405   2.106  -5.574
  574    H    ASP  76           HN       ASP  76  13.661   3.233  -6.129
  575    HA   ASP  76           HA       ASP  76  15.117   5.730  -6.720
  576   1HB   ASP  76          HB2       ASP  76  12.553   4.564  -7.809
  577   2HB   ASP  76          HB1       ASP  76  13.276   6.080  -8.347
  578    H    TRP  77           HN       TRP  77  11.972   4.815  -5.308
  579    HA   TRP  77           HA       TRP  77  11.435   7.649  -4.701
  580   1HB   TRP  77          HB2       TRP  77   9.241   7.045  -4.232
  581   2HB   TRP  77          HB1       TRP  77   9.703   6.070  -5.609
  582    HD1  TRP  77           HD1      TRP  77   9.845   3.444  -5.288
  583    HE1  TRP  77           HE1      TRP  77   9.107   1.877  -3.408
  584    HE3  TRP  77           HE3      TRP  77   9.129   6.834  -1.410
  585    HZ2  TRP  77           HZ2      TRP  77   8.325   1.979  -0.701
  586    HZ3  TRP  77           HZ3      TRP  77   8.368   5.999   0.760
  587    HH2  TRP  77           HH2      TRP  77   7.974   3.599   1.125
  588    H    PHE  78           HN       PHE  78  12.727   4.945  -2.946
  589    HA   PHE  78           HA       PHE  78  11.919   6.149  -0.385
  590   1HB   PHE  78          HB2       PHE  78  11.830   3.742  -0.442
  591   2HB   PHE  78          HB1       PHE  78  13.497   3.653  -0.993
  592    HD1  PHE  78           HD1      PHE  78  15.382   4.078   0.508
  593    HD2  PHE  78           HD2      PHE  78  11.313   4.460   1.890
  594    HE1  PHE  78           HE1      PHE  78  16.180   4.194   2.841
  595    HE2  PHE  78           HE2      PHE  78  12.135   4.563   4.220
  596    HZ   PHE  78           HZ       PHE  78  14.559   4.430   4.701
  597    H    VAL  79           HN       VAL  79  13.072   7.522   0.678
  598    HA   VAL  79           HA       VAL  79  15.938   7.837   0.038
  599    HB   VAL  79           HB       VAL  79  14.990   9.715  -0.976
  600   1HG1  VAL  79          HG11      VAL  79  13.084  10.989   0.089
  601   2HG1  VAL  79          HG12      VAL  79  12.985   9.712   1.297
  602   3HG1  VAL  79          HG13      VAL  79  12.674   9.342  -0.403
  603   1HG2  VAL  79          HG21      VAL  79  15.587  11.611   0.328
  604   2HG2  VAL  79          HG22      VAL  79  16.614  10.313   0.940
  605   3HG2  VAL  79          HG23      VAL  79  15.179  10.802   1.841
  606    H    SER  80           HN       SER  80  17.284   8.442   1.918
  607    HA   SER  80           HA       SER  80  15.921   8.555   4.539
  608   1HB   SER  80          HB2       SER  80  18.179   6.660   3.810
  609   2HB   SER  80          HB1       SER  80  17.681   7.030   5.457
  610    HG   SER  80           HG       SER  80  16.140   5.645   5.193
  611    H    GLU  81           HN       GLU  81  16.775  10.028   5.871
  612    HA   GLU  81           HA       GLU  81  18.708  11.876   4.892
  613   1HB   GLU  81          HB2       GLU  81  17.625  11.481   7.693
  614   2HB   GLU  81          HB1       GLU  81  18.562  12.873   7.155
  615   1HG   GLU  81          HG2       GLU  81  16.824  13.396   5.481
  616   2HG   GLU  81          HG1       GLU  81  15.883  12.006   6.023
  Start of MODEL    7
    1   1H    MET   1          HT1       MET   1 -13.921   3.962  -1.770
    2   2H    MET   1          HT2       MET   1 -13.150   4.574  -0.385
    3   3H    MET   1          HT3       MET   1 -14.592   3.686  -0.237
    4    HA   MET   1           HA       MET   1 -13.584   1.706  -0.429
    5   1HB   MET   1          HB2       MET   1 -11.768   3.194  -2.339
    6   2HB   MET   1          HB1       MET   1 -11.358   1.571  -1.788
    7   1HG   MET   1          HG2       MET   1 -13.243   0.612  -2.819
    8   2HG   MET   1          HG1       MET   1 -14.072   2.162  -2.956
    9   1HE   MET   1          HE1       MET   1 -10.206   2.142  -3.736
   10   2HE   MET   1          HE2       MET   1 -10.180   1.213  -5.232
   11   3HE   MET   1          HE3       MET   1 -10.730   0.450  -3.743
   12    H    ARG   2           HN       ARG   2 -12.203   0.790   1.075
   13    HA   ARG   2           HA       ARG   2 -10.218   2.592   2.339
   14   1HB   ARG   2          HB2       ARG   2 -12.083   0.593   3.652
   15   2HB   ARG   2          HB1       ARG   2 -10.688   1.296   4.474
   16   1HG   ARG   2          HG2       ARG   2 -11.600   3.569   4.021
   17   2HG   ARG   2          HG1       ARG   2 -13.021   2.828   3.284
   18   1HD   ARG   2          HD2       ARG   2 -13.537   1.693   5.414
   19   2HD   ARG   2          HD1       ARG   2 -12.117   2.431   6.151
   20    HE   ARG   2           HE       ARG   2 -13.284   4.448   6.290
   21   1HH1  ARG   2          HH21      ARG   2 -15.546   2.127   5.929
   22   2HH1  ARG   2          HH22      ARG   2 -16.727   3.076   5.090
   23   1HH2  ARG   2          HH11      ARG   2 -14.562   5.716   4.481
   24   2HH2  ARG   2          HH12      ARG   2 -16.170   5.108   4.269
   25    H    ILE   3           HN       ILE   3  -8.218   1.834   2.420
   26    HA   ILE   3           HA       ILE   3  -7.725  -1.013   1.692
   27    HB   ILE   3           HB       ILE   3  -6.092   1.457   1.085
   28   1HG1  ILE   3          HG12      ILE   3  -7.563  -0.482  -0.728
   29   2HG1  ILE   3          HG11      ILE   3  -8.213   1.077  -0.225
   30   1HG2  ILE   3          HG21      ILE   3  -4.810  -0.282  -0.318
   31   2HG2  ILE   3          HG22      ILE   3  -5.609  -1.502   0.671
   32   3HG2  ILE   3          HG23      ILE   3  -4.540  -0.319   1.423
   33   1HD1  ILE   3          HD11      ILE   3  -6.202   2.181  -1.216
   34   2HD1  ILE   3          HD12      ILE   3  -7.178   1.322  -2.410
   35   3HD1  ILE   3          HD13      ILE   3  -5.677   0.606  -1.814
   36    H    GLU   4           HN       GLU   4  -6.747  -2.156   3.275
   37    HA   GLU   4           HA       GLU   4  -5.087  -0.708   5.282
   38   1HB   GLU   4          HB2       GLU   4  -7.235  -1.422   6.259
   39   2HB   GLU   4          HB1       GLU   4  -6.928  -3.080   5.754
   40   1HG   GLU   4          HG2       GLU   4  -4.917  -3.147   7.189
   41   2HG   GLU   4          HG1       GLU   4  -5.225  -1.485   7.692
   42    H    VAL   5           HN       VAL   5  -3.078  -1.376   5.492
   43    HA   VAL   5           HA       VAL   5  -2.318  -4.052   4.413
   44    HB   VAL   5           HB       VAL   5  -0.520  -1.638   4.527
   45   1HG1  VAL   5          HG11      VAL   5   0.468  -3.944   4.395
   46   2HG1  VAL   5          HG12      VAL   5   0.855  -2.926   3.008
   47   3HG1  VAL   5          HG13      VAL   5  -0.390  -4.168   2.870
   48   1HG2  VAL   5          HG21      VAL   5  -0.989  -1.656   1.968
   49   2HG2  VAL   5          HG22      VAL   5  -2.193  -0.920   3.023
   50   3HG2  VAL   5          HG23      VAL   5  -2.451  -2.542   2.394
   51    H    THR   6           HN       THR   6  -1.216  -5.397   5.695
   52    HA   THR   6           HA       THR   6  -0.166  -4.378   8.285
   53    HB   THR   6           HB       THR   6  -0.656  -6.774   9.072
   54    HG1  THR   6           HG1      THR   6  -1.994  -6.631   6.604
   55   1HG2  THR   6          HG21      THR   6  -3.037  -6.232   9.522
   56   2HG2  THR   6          HG22      THR   6  -2.943  -4.919   8.348
   57   3HG2  THR   6          HG23      THR   6  -1.976  -4.855   9.822
   58    H    ILE   7           HN       ILE   7   1.832  -4.918   8.799
   59    HA   ILE   7           HA       ILE   7   3.350  -6.739   7.015
   60    HB   ILE   7           HB       ILE   7   4.016  -4.151   8.389
   61   1HG1  ILE   7          HG12      ILE   7   4.554  -5.087   5.556
   62   2HG1  ILE   7          HG11      ILE   7   3.060  -4.281   6.034
   63   1HG2  ILE   7          HG21      ILE   7   5.868  -6.390   7.547
   64   2HG2  ILE   7          HG22      ILE   7   5.956  -5.349   8.968
   65   3HG2  ILE   7          HG23      ILE   7   6.409  -4.715   7.388
   66   1HD1  ILE   7          HD11      ILE   7   4.892  -2.771   5.088
   67   2HD1  ILE   7          HD12      ILE   7   5.785  -3.089   6.575
   68   3HD1  ILE   7          HD13      ILE   7   4.216  -2.286   6.642
   69    H    ALA   8           HN       ALA   8   4.374  -8.431   7.965
   70    HA   ALA   8           HA       ALA   8   3.849  -9.114  10.657
   71   1HB   ALA   8          HB1       ALA   8   5.806 -10.196   8.627
   72   2HB   ALA   8          HB2       ALA   8   4.224 -10.852   9.053
   73   3HB   ALA   8          HB3       ALA   8   5.549 -10.923  10.214
   74    H    LYS   9           HN       LYS   9   4.876  -8.807  12.363
   75    HA   LYS   9           HA       LYS   9   6.858  -6.851  12.696
   76   1HB   LYS   9          HB2       LYS   9   5.803  -9.015  14.531
   77   2HB   LYS   9          HB1       LYS   9   7.053  -7.904  15.082
   78   1HG   LYS   9          HG2       LYS   9   5.517  -5.999  14.689
   79   2HG   LYS   9          HG1       LYS   9   4.268  -7.127  14.138
   80   1HD   LYS   9          HD2       LYS   9   4.344  -8.244  16.342
   81   2HD   LYS   9          HD1       LYS   9   5.559  -7.084  16.877
   82   1HE   LYS   9          HE2       LYS   9   3.982  -5.239  16.549
   83   2HE   LYS   9          HE1       LYS   9   2.770  -6.363  15.932
   84   1HZ   LYS   9          HZ1       LYS   9   3.941  -6.364  18.661
   85   2HZ   LYS   9          HZ2       LYS   9   2.843  -7.520  18.072
   86   3HZ   LYS   9          HZ3       LYS   9   2.364  -5.899  18.246
   87    H    THR  10           HN       THR  10   7.215 -10.240  12.035
   88    HA   THR  10           HA       THR  10   9.841 -10.609  12.995
   89    HB   THR  10           HB       THR  10   9.925 -12.316  11.076
   90    HG1  THR  10           HG1      THR  10   7.360 -11.192  10.792
   91   1HG2  THR  10          HG21      THR  10   7.721 -12.359  13.152
   92   2HG2  THR  10          HG22      THR  10   9.345 -13.031  13.305
   93   3HG2  THR  10          HG23      THR  10   8.188 -13.764  12.193
   94    H    SER  11           HN       SER  11   8.578  -8.557  10.584
   95    HA   SER  11           HA       SER  11  11.279  -8.189   9.391
   96   1HB   SER  11          HB2       SER  11  10.236  -7.688   7.282
   97   2HB   SER  11          HB1       SER  11   9.601  -9.230   7.849
   98    HG   SER  11           HG       SER  11   8.182  -7.242   7.121
   99    HA   PRO  12           HA       PRO  12   9.969  -4.083  11.199
  100   1HB   PRO  12          HB2       PRO  12  12.620  -3.858  12.321
  101   2HB   PRO  12          HB1       PRO  12  11.096  -4.068  13.201
  102   1HG   PRO  12          HG2       PRO  12  13.127  -5.952  13.061
  103   2HG   PRO  12          HG1       PRO  12  11.443  -6.293  13.492
  104   1HD   PRO  12          HD2       PRO  12  12.857  -6.771  10.896
  105   2HD   PRO  12          HD1       PRO  12  11.542  -7.684  11.656
  106    H    LEU  13           HN       LEU  13  10.065  -2.248  10.257
  107    HA   LEU  13           HA       LEU  13  12.180  -1.867   8.225
  108   1HB   LEU  13          HB2       LEU  13   9.517  -0.439   8.448
  109   2HB   LEU  13          HB1       LEU  13  10.625  -0.421   7.080
  110    HG   LEU  13           HG       LEU  13   9.012  -2.780   8.098
  111   1HD1  LEU  13          HD11      LEU  13   9.078  -1.411   5.387
  112   2HD1  LEU  13          HD12      LEU  13   7.831  -1.164   6.610
  113   3HD1  LEU  13          HD13      LEU  13   8.028  -2.745   5.858
  114   1HD2  LEU  13          HD21      LEU  13  11.066  -3.784   7.494
  115   2HD2  LEU  13          HD22      LEU  13  11.335  -2.657   6.168
  116   3HD2  LEU  13          HD23      LEU  13  10.107  -3.913   6.024
  117    HA   PRO  14           HA       PRO  14  14.073   1.242  10.641
  118   1HB   PRO  14          HB2       PRO  14  14.199   3.318   8.602
  119   2HB   PRO  14          HB1       PRO  14  15.505   2.258   9.157
  120   1HG   PRO  14          HG2       PRO  14  13.870   2.060   6.743
  121   2HG   PRO  14          HG1       PRO  14  15.386   1.240   7.136
  122   1HD   PRO  14          HD2       PRO  14  12.907  -0.012   7.018
  123   2HD   PRO  14          HD1       PRO  14  14.302  -0.640   7.917
  124    H    ALA  15           HN       ALA  15  13.699   3.033  11.802
  125    HA   ALA  15           HA       ALA  15  11.095   3.680  12.506
  126   1HB   ALA  15          HB1       ALA  15  13.572   5.341  12.952
  127   2HB   ALA  15          HB2       ALA  15  13.093   3.948  13.923
  128   3HB   ALA  15          HB3       ALA  15  12.083   5.395  13.896
  129    H    GLY  16           HN       GLY  16  10.997   4.133   9.744
  130   1HA   GLY  16          HA2       GLY  16   9.890   6.757   9.632
  131   2HA   GLY  16          HA1       GLY  16  11.434   6.737   8.826
  132    H    ALA  17           HN       ALA  17  10.882   3.791   8.245
  133    HA   ALA  17           HA       ALA  17  10.008   4.231   5.573
  134   1HB   ALA  17          HB1       ALA  17  10.066   1.565   5.655
  135   2HB   ALA  17          HB2       ALA  17  10.952   1.889   7.147
  136   3HB   ALA  17          HB3       ALA  17  11.550   2.521   5.616
  137    H    ILE  18           HN       ILE  18   8.240   2.832   8.298
  138    HA   ILE  18           HA       ILE  18   6.126   1.851   6.736
  139    HB   ILE  18           HB       ILE  18   6.172   2.949   9.556
  140   1HG1  ILE  18          HG12      ILE  18   7.441   0.769   8.796
  141   2HG1  ILE  18          HG11      ILE  18   6.483   0.745  10.268
  142   1HG2  ILE  18          HG21      ILE  18   3.905   3.155   8.978
  143   2HG2  ILE  18          HG22      ILE  18   3.984   1.555   9.714
  144   3HG2  ILE  18          HG23      ILE  18   3.934   1.716   7.958
  145   1HD1  ILE  18          HD11      ILE  18   4.764  -0.507   9.291
  146   2HD1  ILE  18          HD12      ILE  18   6.204  -1.199   8.549
  147   3HD1  ILE  18          HD13      ILE  18   5.220  -0.045   7.653
  148    H    ASP  19           HN       ASP  19   6.594   4.998   8.319
  149    HA   ASP  19           HA       ASP  19   4.200   6.164   7.325
  150   1HB   ASP  19          HB2       ASP  19   6.810   7.412   8.239
  151   2HB   ASP  19          HB1       ASP  19   5.398   8.359   7.775
  152    H    ALA  20           HN       ALA  20   7.453   5.929   5.930
  153    HA   ALA  20           HA       ALA  20   6.836   7.641   3.774
  154   1HB   ALA  20          HB1       ALA  20   9.157   6.772   4.565
  155   2HB   ALA  20          HB2       ALA  20   8.895   7.037   2.842
  156   3HB   ALA  20          HB3       ALA  20   8.827   5.403   3.504
  157    H    LEU  21           HN       LEU  21   6.560   4.140   4.175
  158    HA   LEU  21           HA       LEU  21   5.849   3.465   1.569
  159   1HB   LEU  21          HB2       LEU  21   6.566   1.799   3.141
  160   2HB   LEU  21          HB1       LEU  21   5.279   2.219   4.262
  161    HG   LEU  21           HG       LEU  21   3.625   1.431   2.604
  162   1HD1  LEU  21          HD11      LEU  21   4.787   1.692   0.510
  163   2HD1  LEU  21          HD12      LEU  21   4.547  -0.038   0.739
  164   3HD1  LEU  21          HD13      LEU  21   6.119   0.681   1.067
  165   1HD2  LEU  21          HD21      LEU  21   4.519  -0.052   4.386
  166   2HD2  LEU  21          HD22      LEU  21   5.758  -0.610   3.261
  167   3HD2  LEU  21          HD23      LEU  21   4.058  -0.951   2.940
  168    H    ALA  22           HN       ALA  22   3.833   4.245   4.376
  169    HA   ALA  22           HA       ALA  22   1.313   3.956   3.097
  170   1HB   ALA  22          HB1       ALA  22   1.922   5.915   5.315
  171   2HB   ALA  22          HB2       ALA  22   1.785   4.182   5.612
  172   3HB   ALA  22          HB3       ALA  22   0.404   5.080   4.984
  173    H    GLY  23           HN       GLY  23   3.560   6.695   3.253
  174   1HA   GLY  23          HA2       GLY  23   1.757   8.540   1.991
  175   2HA   GLY  23          HA1       GLY  23   3.520   8.697   2.183
  176    H    GLU  24           HN       GLU  24   4.401   6.454   0.708
  177    HA   GLU  24           HA       GLU  24   4.062   7.438  -1.922
  178   1HB   GLU  24          HB2       GLU  24   6.104   6.202  -1.092
  179   2HB   GLU  24          HB1       GLU  24   5.164   4.713  -1.150
  180   1HG   GLU  24          HG2       GLU  24   6.370   4.862  -3.230
  181   2HG   GLU  24          HG1       GLU  24   4.684   5.227  -3.591
  182    H    LEU  25           HN       LEU  25   2.616   4.694  -0.224
  183    HA   LEU  25           HA       LEU  25   1.315   3.608  -2.492
  184   1HB   LEU  25          HB2       LEU  25   0.644   3.410   0.442
  185   2HB   LEU  25          HB1       LEU  25  -0.250   2.548  -0.805
  186    HG   LEU  25           HG       LEU  25   2.746   2.313  -0.411
  187   1HD1  LEU  25          HD11      LEU  25   2.222   0.122   0.636
  188   2HD1  LEU  25          HD12      LEU  25   0.503   0.497   0.526
  189   3HD1  LEU  25          HD13      LEU  25   1.551   1.464   1.560
  190   1HD2  LEU  25          HD21      LEU  25   0.729   1.001  -2.230
  191   2HD2  LEU  25          HD22      LEU  25   2.122   0.065  -1.691
  192   3HD2  LEU  25          HD23      LEU  25   2.364   1.553  -2.594
  193    H    SER  26           HN       SER  26   0.249   6.041  -0.155
  194    HA   SER  26           HA       SER  26  -2.428   6.225  -1.012
  195   1HB   SER  26          HB2       SER  26  -1.539   7.199   1.096
  196   2HB   SER  26          HB1       SER  26  -0.695   8.418   0.145
  197    HG   SER  26           HG       SER  26  -3.441   8.051   0.590
  198    H    ARG  27           HN       ARG  27   0.433   8.160  -1.995
  199    HA   ARG  27           HA       ARG  27  -0.942   9.884  -3.760
  200   1HB   ARG  27          HB2       ARG  27   1.366  10.304  -2.993
  201   2HB   ARG  27          HB1       ARG  27   1.923   8.907  -3.913
  202   1HG   ARG  27          HG2       ARG  27   1.210   9.949  -6.006
  203   2HG   ARG  27          HG1       ARG  27   0.528  11.314  -5.121
  204   1HD   ARG  27          HD2       ARG  27   2.783  11.853  -4.251
  205   2HD   ARG  27          HD1       ARG  27   3.450  10.510  -5.175
  206    HE   ARG  27           HE       ARG  27   2.132  12.034  -7.043
  207   1HH1  ARG  27          HH21      ARG  27   3.295  13.908  -4.664
  208   2HH1  ARG  27          HH22      ARG  27   4.626  14.601  -5.528
  209   1HH2  ARG  27          HH11      ARG  27   4.415  12.368  -8.173
  210   2HH2  ARG  27          HH12      ARG  27   5.261  13.729  -7.515
  211    H    ARG  28           HN       ARG  28   0.567   6.716  -4.348
  212    HA   ARG  28           HA       ARG  28   0.127   6.751  -7.138
  213   1HB   ARG  28          HB2       ARG  28   1.690   5.246  -5.793
  214   2HB   ARG  28          HB1       ARG  28   0.275   4.245  -5.478
  215   1HG   ARG  28          HG2       ARG  28   0.014   3.664  -7.744
  216   2HG   ARG  28          HG1       ARG  28   0.951   5.042  -8.316
  217   1HD   ARG  28          HD2       ARG  28   3.003   4.074  -7.504
  218   2HD   ARG  28          HD1       ARG  28   2.131   2.773  -6.708
  219    HE   ARG  28           HE       ARG  28   1.380   2.431  -9.274
  220   1HH1  ARG  28          HH11      ARG  28   4.363   2.545  -7.561
  221   2HH1  ARG  28          HH12      ARG  28   5.305   1.892  -8.859
  222   1HH2  ARG  28          HH21      ARG  28   2.648   1.784 -11.085
  223   2HH2  ARG  28          HH22      ARG  28   4.334   1.461 -10.855
  224    H    ILE  29           HN       ILE  29  -1.828   5.673  -4.436
  225    HA   ILE  29           HA       ILE  29  -3.869   4.386  -5.961
  226    HB   ILE  29           HB       ILE  29  -3.849   5.545  -3.172
  227   1HG1  ILE  29          HG12      ILE  29  -2.454   3.440  -3.905
  228   2HG1  ILE  29          HG11      ILE  29  -3.400   3.369  -2.426
  229   1HG2  ILE  29          HG21      ILE  29  -6.025   4.080  -4.672
  230   2HG2  ILE  29          HG22      ILE  29  -6.139   5.602  -3.786
  231   3HG2  ILE  29          HG23      ILE  29  -5.943   4.085  -2.910
  232   1HD1  ILE  29          HD11      ILE  29  -5.156   2.120  -3.529
  233   2HD1  ILE  29          HD12      ILE  29  -3.627   1.338  -3.906
  234   3HD1  ILE  29          HD13      ILE  29  -4.412   2.357  -5.105
  235    H    GLN  30           HN       GLN  30  -3.535   7.661  -4.673
  236    HA   GLN  30           HA       GLN  30  -6.099   8.620  -5.544
  237   1HB   GLN  30          HB2       GLN  30  -3.502  10.073  -4.960
  238   2HB   GLN  30          HB1       GLN  30  -4.978  10.903  -5.447
  239   1HG   GLN  30          HG2       GLN  30  -6.155  10.099  -3.489
  240   2HG   GLN  30          HG1       GLN  30  -4.812   9.057  -3.039
  241   1HE2  GLN  30          HE21      GLN  30  -3.205  11.676  -4.138
  242   2HE2  GLN  30          HE22      GLN  30  -3.123  12.600  -2.717
  243    H    TYR  31           HN       TYR  31  -2.963   8.479  -7.229
  244    HA   TYR  31           HA       TYR  31  -3.925   9.892  -9.492
  245   1HB   TYR  31          HB2       TYR  31  -1.592   8.057  -8.970
  246   2HB   TYR  31          HB1       TYR  31  -1.968   8.546 -10.621
  247    HD1  TYR  31           HD1      TYR  31  -2.108  10.401  -7.335
  248    HD2  TYR  31           HD2      TYR  31  -0.449  10.192 -11.297
  249    HE1  TYR  31           HE1      TYR  31  -0.960  12.560  -6.969
  250    HE2  TYR  31           HE2      TYR  31   0.699  12.355 -10.922
  251    HH   TYR  31           HH       TYR  31   0.267  14.422  -9.377
  252    H    ALA  32           HN       ALA  32  -3.916   6.473  -8.583
  253    HA   ALA  32           HA       ALA  32  -4.854   5.511 -11.094
  254   1HB   ALA  32          HB1       ALA  32  -4.696   4.331  -8.334
  255   2HB   ALA  32          HB2       ALA  32  -3.744   3.933  -9.764
  256   3HB   ALA  32          HB3       ALA  32  -5.436   3.446  -9.670
  257    H    PHE  33           HN       PHE  33  -6.445   6.442  -8.089
  258    HA   PHE  33           HA       PHE  33  -9.111   6.047  -9.357
  259   1HB   PHE  33          HB2       PHE  33  -8.277   5.834  -6.459
  260   2HB   PHE  33          HB1       PHE  33  -9.950   5.802  -7.021
  261    HD1  PHE  33           HD1      PHE  33  -6.717   4.018  -7.050
  262    HD2  PHE  33           HD2      PHE  33 -10.838   3.908  -8.254
  263    HE1  PHE  33           HE1      PHE  33  -6.493   1.611  -7.605
  264    HE2  PHE  33           HE2      PHE  33 -10.617   1.502  -8.802
  265    HZ   PHE  33           HZ       PHE  33  -8.443   0.353  -8.480
  266    HA   PRO  34           HA       PRO  34  -8.642  10.565  -8.590
  267   1HB   PRO  34          HB2       PRO  34 -10.225  11.064 -10.968
  268   2HB   PRO  34          HB1       PRO  34  -8.512  11.407 -10.688
  269   1HG   PRO  34          HG2       PRO  34  -9.512   9.476 -12.418
  270   2HG   PRO  34          HG1       PRO  34  -7.854   9.549 -11.799
  271   1HD   PRO  34          HD2       PRO  34 -10.096   7.770 -10.962
  272   2HD   PRO  34          HD1       PRO  34  -8.342   7.495 -10.909
  273    H    ASP  35           HN       ASP  35 -11.453   8.680  -9.465
  274    HA   ASP  35           HA       ASP  35 -13.380  10.649  -8.550
  275   1HB   ASP  35          HB2       ASP  35 -13.642   7.905  -9.763
  276   2HB   ASP  35          HB1       ASP  35 -15.021   8.879  -9.257
  277    H    ASN  36           HN       ASN  36 -11.706   8.033  -6.961
  278    HA   ASN  36           HA       ASN  36 -13.926   7.855  -4.979
  279   1HB   ASN  36          HB2       ASN  36 -11.907   5.758  -5.740
  280   2HB   ASN  36          HB1       ASN  36 -13.152   5.590  -4.510
  281   1HD2  ASN  36          HD21      ASN  36 -12.578   4.531  -7.504
  282   2HD2  ASN  36          HD22      ASN  36 -14.142   4.556  -8.164
  283    H    GLU  37           HN       GLU  37 -13.325   8.454  -2.791
  284    HA   GLU  37           HA       GLU  37 -10.777   9.386  -2.109
  285   1HB   GLU  37          HB2       GLU  37 -13.134   8.363  -0.553
  286   2HB   GLU  37          HB1       GLU  37 -11.697   9.044   0.207
  287   1HG   GLU  37          HG2       GLU  37 -13.306  10.500  -1.905
  288   2HG   GLU  37          HG1       GLU  37 -13.572  10.697  -0.174
  289    H    GLY  38           HN       GLY  38  -8.980   8.167  -1.715
  290   1HA   GLY  38          HA2       GLY  38  -9.285   5.279  -0.987
  291   2HA   GLY  38          HA1       GLY  38  -7.939   5.829  -1.740
  292    H    HIS  39           HN       HIS  39  -8.803   4.839   1.274
  293    HA   HIS  39           HA       HIS  39  -6.942   6.730   2.574
  294   1HB   HIS  39          HB2       HIS  39  -9.216   6.733   3.552
  295   2HB   HIS  39          HB1       HIS  39  -9.092   4.997   3.835
  296    HD1  HIS  39           HD1      HIS  39  -7.429   4.199   5.686
  297    HD2  HIS  39           HD2      HIS  39  -7.721   8.343   5.344
  298    HE1  HIS  39           HE1      HIS  39  -6.307   5.169   7.739
  299    H    VAL  40           HN       VAL  40  -4.986   5.770   3.041
  300    HA   VAL  40           HA       VAL  40  -4.837   2.831   3.036
  301    HB   VAL  40           HB       VAL  40  -2.716   4.892   2.408
  302   1HG1  VAL  40          HG11      VAL  40  -1.555   2.876   1.461
  303   2HG1  VAL  40          HG12      VAL  40  -2.802   1.873   2.201
  304   3HG1  VAL  40          HG13      VAL  40  -1.731   2.840   3.215
  305   1HG2  VAL  40          HG21      VAL  40  -3.082   4.138   0.061
  306   2HG2  VAL  40          HG22      VAL  40  -4.523   4.898   0.740
  307   3HG2  VAL  40          HG23      VAL  40  -4.430   3.142   0.610
  308    H    SER  41           HN       SER  41  -4.162   1.841   4.797
  309    HA   SER  41           HA       SER  41  -2.701   3.385   6.863
  310   1HB   SER  41          HB2       SER  41  -5.026   3.020   7.626
  311   2HB   SER  41          HB1       SER  41  -4.833   1.287   7.381
  312    HG   SER  41           HG       SER  41  -2.845   2.435   8.881
  313    H    VAL  42           HN       VAL  42  -1.026   2.424   7.856
  314    HA   VAL  42           HA       VAL  42  -0.424  -0.374   7.130
  315    HB   VAL  42           HB       VAL  42   1.584   1.910   7.191
  316   1HG1  VAL  42          HG11      VAL  42   1.874  -1.037   6.551
  317   2HG1  VAL  42          HG12      VAL  42   2.578  -0.183   7.923
  318   3HG1  VAL  42          HG13      VAL  42   3.134   0.167   6.285
  319   1HG2  VAL  42          HG21      VAL  42  -0.006   1.827   5.195
  320   2HG2  VAL  42          HG22      VAL  42   0.728   0.276   4.793
  321   3HG2  VAL  42          HG23      VAL  42   1.711   1.736   4.807
  322    H    ARG  43           HN       ARG  43  -0.043  -1.608   8.817
  323    HA   ARG  43           HA       ARG  43   1.115  -0.441  11.228
  324   1HB   ARG  43          HB2       ARG  43  -1.229  -0.102  11.654
  325   2HB   ARG  43          HB1       ARG  43  -1.612  -1.752  11.171
  326   1HG   ARG  43          HG2       ARG  43  -0.478  -2.663  13.087
  327   2HG   ARG  43          HG1       ARG  43   0.207  -1.093  13.505
  328   1HD   ARG  43          HD2       ARG  43  -1.984  -0.217  14.037
  329   2HD   ARG  43          HD1       ARG  43  -2.768  -1.666  13.419
  330    HE   ARG  43           HE       ARG  43  -1.474  -1.360  16.001
  331   1HH1  ARG  43          HH21      ARG  43  -3.750  -3.100  14.305
  332   2HH1  ARG  43          HH22      ARG  43  -3.414  -4.634  15.036
  333   1HH2  ARG  43          HH11      ARG  43  -0.541  -3.541  16.639
  334   2HH2  ARG  43          HH12      ARG  43  -1.598  -4.884  16.356
  335    H    TYR  44           HN       TYR  44   1.777  -2.072  12.799
  336    HA   TYR  44           HA       TYR  44   2.744  -4.511  11.500
  337   1HB   TYR  44          HB2       TYR  44   3.074  -3.390  14.300
  338   2HB   TYR  44          HB1       TYR  44   3.755  -4.914  13.768
  339    HD1  TYR  44           HD1      TYR  44   5.222  -4.833  11.582
  340    HD2  TYR  44           HD2      TYR  44   4.338  -1.434  14.063
  341    HE1  TYR  44           HE1      TYR  44   7.202  -3.648  10.672
  342    HE2  TYR  44           HE2      TYR  44   6.317  -0.256  13.159
  343    HH   TYR  44           HH       TYR  44   8.653  -1.176  12.045
  344    H    ALA  45           HN       ALA  45   2.042  -6.506  11.778
  345    HA   ALA  45           HA       ALA  45  -0.016  -7.072  13.801
  346   1HB   ALA  45          HB1       ALA  45  -0.942  -6.469  11.413
  347   2HB   ALA  45          HB2       ALA  45  -1.582  -7.874  12.265
  348   3HB   ALA  45          HB3       ALA  45  -0.380  -8.086  10.990
  349    H    ALA  46           HN       ALA  46  -0.376  -9.512  13.922
  350    HA   ALA  46           HA       ALA  46   2.129 -10.778  14.220
  351   1HB   ALA  46          HB1       ALA  46  -0.493 -12.259  13.922
  352   2HB   ALA  46          HB2       ALA  46  -0.070 -11.395  15.400
  353   3HB   ALA  46          HB3       ALA  46   0.925 -12.744  14.851
  354    H    ALA  47           HN       ALA  47  -0.030 -10.565  11.468
  355    HA   ALA  47           HA       ALA  47   1.996 -12.051   9.908
  356   1HB   ALA  47          HB1       ALA  47  -0.976 -12.526   9.623
  357   2HB   ALA  47          HB2       ALA  47   0.108 -13.580  10.533
  358   3HB   ALA  47          HB3       ALA  47   0.327 -13.378   8.795
  359    H    ASN  48           HN       ASN  48   2.094 -11.612   7.684
  360    HA   ASN  48           HA       ASN  48   1.429  -8.907   6.919
  361   1HB   ASN  48          HB2       ASN  48   3.435 -10.093   6.046
  362   2HB   ASN  48          HB1       ASN  48   2.379 -11.243   5.230
  363   1HD2  ASN  48          HD21      ASN  48   3.261  -7.769   5.311
  364   2HD2  ASN  48          HD22      ASN  48   2.756  -7.448   3.722
  365    H    ASN  49           HN       ASN  49  -0.479  -8.244   6.025
  366    HA   ASN  49           HA       ASN  49  -2.074 -10.078   4.414
  367   1HB   ASN  49          HB2       ASN  49  -2.826 -10.505   6.743
  368   2HB   ASN  49          HB1       ASN  49  -3.255  -8.804   6.888
  369   1HD2  ASN  49          HD21      ASN  49  -5.503  -8.717   6.758
  370   2HD2  ASN  49          HD22      ASN  49  -6.429  -9.495   5.566
  371    H    LEU  50           HN       LEU  50  -3.579  -9.024   3.103
  372    HA   LEU  50           HA       LEU  50  -3.511  -6.063   3.091
  373   1HB   LEU  50          HB2       LEU  50  -2.107  -6.996   1.263
  374   2HB   LEU  50          HB1       LEU  50  -3.478  -7.953   0.713
  375    HG   LEU  50           HG       LEU  50  -4.763  -5.843   0.339
  376   1HD1  LEU  50          HD11      LEU  50  -3.209  -3.748   0.196
  377   2HD1  LEU  50          HD12      LEU  50  -2.213  -4.630   1.353
  378   3HD1  LEU  50          HD13      LEU  50  -3.885  -4.228   1.748
  379   1HD2  LEU  50          HD21      LEU  50  -2.088  -6.085  -1.073
  380   2HD2  LEU  50          HD22      LEU  50  -3.419  -5.081  -1.644
  381   3HD2  LEU  50          HD23      LEU  50  -3.610  -6.832  -1.561
  382    H    SER  51           HN       SER  51  -5.597  -5.302   3.375
  383    HA   SER  51           HA       SER  51  -7.841  -7.053   2.513
  384   1HB   SER  51          HB2       SER  51  -7.658  -5.191   4.889
  385   2HB   SER  51          HB1       SER  51  -9.132  -5.990   4.349
  386    HG   SER  51           HG       SER  51  -7.990  -7.133   6.011
  387    H    VAL  52           HN       VAL  52  -9.220  -6.118   1.079
  388    HA   VAL  52           HA       VAL  52  -9.200  -3.182   0.817
  389    HB   VAL  52           HB       VAL  52  -9.464  -5.239  -1.395
  390   1HG1  VAL  52          HG11      VAL  52  -9.715  -2.227  -1.332
  391   2HG1  VAL  52          HG12      VAL  52 -10.858  -3.401  -1.981
  392   3HG1  VAL  52          HG13      VAL  52  -9.335  -3.101  -2.816
  393   1HG2  VAL  52          HG21      VAL  52  -7.353  -4.150  -2.203
  394   2HG2  VAL  52          HG22      VAL  52  -7.156  -4.998  -0.669
  395   3HG2  VAL  52          HG23      VAL  52  -7.295  -3.239  -0.693
  396    H    ILE  53           HN       ILE  53 -11.186  -2.305   1.191
  397    HA   ILE  53           HA       ILE  53 -13.578  -4.049   0.892
  398    HB   ILE  53           HB       ILE  53 -13.069  -1.882   2.949
  399   1HG1  ILE  53          HG12      ILE  53 -13.511  -4.845   3.405
  400   2HG1  ILE  53          HG11      ILE  53 -11.898  -4.151   3.222
  401   1HG2  ILE  53          HG21      ILE  53 -15.466  -3.630   2.352
  402   2HG2  ILE  53          HG22      ILE  53 -15.403  -1.868   2.407
  403   3HG2  ILE  53          HG23      ILE  53 -15.245  -2.804   3.894
  404   1HD1  ILE  53          HD11      ILE  53 -12.306  -2.650   5.114
  405   2HD1  ILE  53          HD12      ILE  53 -12.574  -4.322   5.605
  406   3HD1  ILE  53          HD13      ILE  53 -13.949  -3.270   5.273
  407    H    GLY  54           HN       GLY  54 -15.138  -3.339  -0.418
  408   1HA   GLY  54          HA2       GLY  54 -16.597  -1.720  -1.353
  409   2HA   GLY  54          HA1       GLY  54 -15.437  -0.465  -0.923
  410    H    ALA  55           HN       ALA  55 -14.067  -3.231  -2.475
  411    HA   ALA  55           HA       ALA  55 -14.005  -1.747  -5.046
  412   1HB   ALA  55          HB1       ALA  55 -11.720  -2.186  -5.307
  413   2HB   ALA  55          HB2       ALA  55 -11.741  -3.518  -4.150
  414   3HB   ALA  55          HB3       ALA  55 -11.844  -1.854  -3.580
  415    H    THR  56           HN       THR  56 -13.543  -2.997  -6.920
  416    HA   THR  56           HA       THR  56 -15.024  -5.554  -7.141
  417    HB   THR  56           HB       THR  56 -14.879  -5.094  -9.481
  418    HG1  THR  56           HG1      THR  56 -13.812  -2.768  -9.703
  419   1HG2  THR  56          HG21      THR  56 -16.614  -3.880  -8.195
  420   2HG2  THR  56          HG22      THR  56 -16.066  -2.944  -9.586
  421   3HG2  THR  56          HG23      THR  56 -15.493  -2.538  -7.969
  422    H    LYS  57           HN       LYS  57 -14.119  -7.322  -8.219
  423    HA   LYS  57           HA       LYS  57 -11.635  -8.121  -7.264
  424   1HB   LYS  57          HB2       LYS  57 -13.333  -9.746  -8.006
  425   2HB   LYS  57          HB1       LYS  57 -13.127  -9.221  -9.676
  426   1HG   LYS  57          HG2       LYS  57 -10.772 -10.000  -9.633
  427   2HG   LYS  57          HG1       LYS  57 -10.974 -10.530  -7.961
  428   1HD   LYS  57          HD2       LYS  57 -12.624 -12.159  -8.599
  429   2HD   LYS  57          HD1       LYS  57 -12.691 -11.525 -10.243
  430   1HE   LYS  57          HE2       LYS  57 -11.310 -13.550 -10.191
  431   2HE   LYS  57          HE1       LYS  57 -10.304 -12.149 -10.559
  432   1HZ   LYS  57          HZ1       LYS  57 -10.590 -13.522  -7.946
  433   2HZ   LYS  57          HZ2       LYS  57  -9.796 -12.033  -8.141
  434   3HZ   LYS  57          HZ3       LYS  57  -9.198 -13.425  -8.911
  435    H    GLU  58           HN       GLU  58 -12.387  -6.739 -10.511
  436    HA   GLU  58           HA       GLU  58  -9.766  -7.108 -11.555
  437   1HB   GLU  58          HB2       GLU  58 -11.753  -6.627 -12.955
  438   2HB   GLU  58          HB1       GLU  58 -11.849  -5.019 -12.239
  439   1HG   GLU  58          HG2       GLU  58  -9.596  -4.494 -13.092
  440   2HG   GLU  58          HG1       GLU  58  -9.479  -6.110 -13.788
  441    H    ASP  59           HN       ASP  59 -11.291  -4.542  -9.646
  442    HA   ASP  59           HA       ASP  59  -9.174  -2.681  -9.835
  443   1HB   ASP  59          HB2       ASP  59 -11.283  -3.124  -7.714
  444   2HB   ASP  59          HB1       ASP  59 -10.135  -1.790  -7.672
  445    H    LYS  60           HN       LYS  60  -9.976  -5.269  -7.569
  446    HA   LYS  60           HA       LYS  60  -7.793  -4.857  -5.807
  447   1HB   LYS  60          HB2       LYS  60  -9.406  -7.353  -6.400
  448   2HB   LYS  60          HB1       LYS  60  -8.172  -7.270  -5.145
  449   1HG   LYS  60          HG2       LYS  60  -9.405  -5.432  -4.050
  450   2HG   LYS  60          HG1       LYS  60 -10.645  -5.522  -5.305
  451   1HD   LYS  60          HD2       LYS  60 -11.081  -7.885  -4.687
  452   2HD   LYS  60          HD1       LYS  60  -9.881  -7.757  -3.403
  453   1HE   LYS  60          HE2       LYS  60 -11.834  -7.318  -2.213
  454   2HE   LYS  60          HE1       LYS  60 -11.363  -5.679  -2.662
  455   1HZ   LYS  60          HZ1       LYS  60 -13.219  -5.474  -3.815
  456   2HZ   LYS  60          HZ2       LYS  60 -13.710  -7.018  -3.305
  457   3HZ   LYS  60          HZ3       LYS  60 -12.843  -6.835  -4.754
  458    H    GLN  61           HN       GLN  61  -7.967  -6.830  -8.795
  459    HA   GLN  61           HA       GLN  61  -5.374  -7.955  -8.393
  460   1HB   GLN  61          HB2       GLN  61  -7.015  -8.826 -10.079
  461   2HB   GLN  61          HB1       GLN  61  -6.761  -7.361 -11.027
  462   1HG   GLN  61          HG2       GLN  61  -4.399  -7.888 -11.295
  463   2HG   GLN  61          HG1       GLN  61  -4.557  -9.285 -10.231
  464   1HE2  GLN  61          HE21      GLN  61  -3.645  -9.542 -12.953
  465   2HE2  GLN  61          HE22      GLN  61  -4.819 -10.411 -13.817
  466    H    ARG  62           HN       ARG  62  -6.560  -4.971  -9.974
  467    HA   ARG  62           HA       ARG  62  -4.071  -4.151 -10.950
  468   1HB   ARG  62          HB2       ARG  62  -6.153  -3.070 -11.686
  469   2HB   ARG  62          HB1       ARG  62  -6.437  -2.466 -10.055
  470   1HG   ARG  62          HG2       ARG  62  -4.489  -1.039 -10.165
  471   2HG   ARG  62          HG1       ARG  62  -3.988  -1.754 -11.698
  472   1HD   ARG  62          HD2       ARG  62  -5.072   0.367 -12.157
  473   2HD   ARG  62          HD1       ARG  62  -6.118  -0.933 -12.721
  474    HE   ARG  62           HE       ARG  62  -6.806  -0.255 -10.057
  475   1HH1  ARG  62          HH21      ARG  62  -6.423   2.423 -11.599
  476   2HH1  ARG  62          HH22      ARG  62  -8.055   2.739 -12.085
  477   1HH2  ARG  62          HH11      ARG  62  -9.156  -0.481 -11.420
  478   2HH2  ARG  62          HH12      ARG  62  -9.602   1.096 -11.982
  479    H    ILE  63           HN       ILE  63  -5.664  -3.475  -7.865
  480    HA   ILE  63           HA       ILE  63  -3.627  -1.818  -6.847
  481    HB   ILE  63           HB       ILE  63  -5.619  -3.568  -5.428
  482   1HG1  ILE  63          HG12      ILE  63  -5.525  -0.555  -5.563
  483   2HG1  ILE  63          HG11      ILE  63  -6.352  -1.517  -6.786
  484   1HG2  ILE  63          HG21      ILE  63  -5.048  -2.113  -3.410
  485   2HG2  ILE  63          HG22      ILE  63  -3.605  -1.622  -4.298
  486   3HG2  ILE  63          HG23      ILE  63  -3.835  -3.313  -3.856
  487   1HD1  ILE  63          HD11      ILE  63  -6.912  -1.780  -3.824
  488   2HD1  ILE  63          HD12      ILE  63  -7.845  -2.463  -5.157
  489   3HD1  ILE  63          HD13      ILE  63  -7.833  -0.719  -4.890
  490    H    SER  64           HN       SER  64  -3.993  -5.313  -6.684
  491    HA   SER  64           HA       SER  64  -1.719  -5.770  -5.053
  492   1HB   SER  64          HB2       SER  64  -2.876  -7.485  -7.270
  493   2HB   SER  64          HB1       SER  64  -1.690  -8.030  -6.087
  494    HG   SER  64           HG       SER  64  -3.652  -6.874  -4.759
  495    H    GLU  65           HN       GLU  65  -2.107  -5.306  -8.612
  496    HA   GLU  65           HA       GLU  65   0.606  -5.807  -9.222
  497   1HB   GLU  65          HB2       GLU  65  -1.524  -4.210 -10.666
  498   2HB   GLU  65          HB1       GLU  65   0.091  -4.485 -11.323
  499   1HG   GLU  65          HG2       GLU  65  -0.254  -6.921 -11.167
  500   2HG   GLU  65          HG1       GLU  65  -1.867  -6.653 -10.511
  501    H    ILE  66           HN       ILE  66  -1.138  -2.829  -8.406
  502    HA   ILE  66           HA       ILE  66   0.986  -1.035  -8.814
  503    HB   ILE  66           HB       ILE  66  -1.389  -0.939  -6.941
  504   1HG1  ILE  66          HG12      ILE  66  -0.753   0.539  -9.517
  505   2HG1  ILE  66          HG11      ILE  66  -1.752  -0.912  -9.429
  506   1HG2  ILE  66          HG21      ILE  66  -0.850   1.542  -6.832
  507   2HG2  ILE  66          HG22      ILE  66   0.717   1.155  -7.537
  508   3HG2  ILE  66          HG23      ILE  66   0.278   0.511  -5.956
  509   1HD1  ILE  66          HD11      ILE  66  -3.295   0.271  -7.878
  510   2HD1  ILE  66          HD12      ILE  66  -3.179   1.080  -9.441
  511   3HD1  ILE  66          HD13      ILE  66  -2.316   1.729  -8.046
  512    H    LEU  67           HN       LEU  67  -0.020  -2.792  -5.903
  513    HA   LEU  67           HA       LEU  67   1.961  -1.773  -4.191
  514   1HB   LEU  67          HB2       LEU  67   0.138  -3.026  -3.212
  515   2HB   LEU  67          HB1       LEU  67   0.491  -4.426  -4.217
  516    HG   LEU  67           HG       LEU  67   2.708  -4.660  -3.027
  517   1HD1  LEU  67          HD11      LEU  67   3.220  -2.540  -2.132
  518   2HD1  LEU  67          HD12      LEU  67   2.676  -3.426  -0.712
  519   3HD1  LEU  67          HD13      LEU  67   1.585  -2.297  -1.513
  520   1HD2  LEU  67          HD21      LEU  67   0.541  -5.843  -2.366
  521   2HD2  LEU  67          HD22      LEU  67   0.379  -4.636  -1.091
  522   3HD2  LEU  67          HD23      LEU  67   1.767  -5.723  -1.104
  523    H    GLN  68           HN       GLN  68   1.963  -4.487  -6.428
  524    HA   GLN  68           HA       GLN  68   4.549  -5.443  -5.739
  525   1HB   GLN  68          HB2       GLN  68   2.928  -6.751  -7.082
  526   2HB   GLN  68          HB1       GLN  68   3.101  -5.588  -8.398
  527   1HG   GLN  68          HG2       GLN  68   5.439  -6.132  -8.663
  528   2HG   GLN  68          HG1       GLN  68   5.418  -7.137  -7.214
  529   1HE2  GLN  68          HE21      GLN  68   6.259  -8.391  -9.528
  530   2HE2  GLN  68          HE22      GLN  68   5.056  -9.439 -10.107
  531    H    GLU  69           HN       GLU  69   3.551  -3.192  -8.403
  532    HA   GLU  69           HA       GLU  69   6.153  -2.746  -9.316
  533   1HB   GLU  69          HB2       GLU  69   3.698  -0.987  -9.430
  534   2HB   GLU  69          HB1       GLU  69   5.207  -0.609 -10.263
  535   1HG   GLU  69          HG2       GLU  69   5.093  -2.760 -11.461
  536   2HG   GLU  69          HG1       GLU  69   3.586  -3.141 -10.631
  537    H    THR  70           HN       THR  70   4.337  -0.883  -6.865
  538    HA   THR  70           HA       THR  70   6.272   1.118  -6.482
  539    HB   THR  70           HB       THR  70   4.349  -0.050  -4.506
  540    HG1  THR  70           HG1      THR  70   4.216   2.207  -6.200
  541   1HG2  THR  70          HG21      THR  70   5.999   1.160  -3.277
  542   2HG2  THR  70          HG22      THR  70   4.616   2.243  -3.443
  543   3HG2  THR  70          HG23      THR  70   6.030   2.452  -4.478
  544    H    TRP  71           HN       TRP  71   5.734  -1.910  -4.852
  545    HA   TRP  71           HA       TRP  71   7.798  -1.834  -3.033
  546   1HB   TRP  71          HB2       TRP  71   5.849  -3.344  -3.039
  547   2HB   TRP  71          HB1       TRP  71   6.548  -4.195  -4.404
  548    HD1  TRP  71           HD1      TRP  71   7.341  -6.425  -3.545
  549    HE1  TRP  71           HE1      TRP  71   8.741  -7.271  -1.561
  550    HE3  TRP  71           HE3      TRP  71   7.894  -2.066  -0.870
  551    HZ2  TRP  71           HZ2      TRP  71   9.915  -6.268   0.828
  552    HZ3  TRP  71           HZ3      TRP  71   9.147  -2.070   1.249
  553    HH2  TRP  71           HH2      TRP  71  10.152  -4.161   2.110
  554    H    GLU  72           HN       GLU  72   7.784  -2.939  -6.356
  555    HA   GLU  72           HA       GLU  72  10.492  -3.864  -6.282
  556   1HB   GLU  72          HB2       GLU  72   8.583  -3.390  -8.577
  557   2HB   GLU  72          HB1       GLU  72  10.223  -4.001  -8.803
  558   1HG   GLU  72          HG2       GLU  72   9.739  -5.890  -7.302
  559   2HG   GLU  72          HG1       GLU  72   8.106  -5.284  -7.051
  560    H    SER  73           HN       SER  73   9.149  -0.698  -6.679
  561    HA   SER  73           HA       SER  73  11.686   0.237  -7.907
  562   1HB   SER  73          HB2       SER  73  10.414   2.317  -8.408
  563   2HB   SER  73          HB1       SER  73   9.693   0.890  -9.146
  564    HG   SER  73           HG       SER  73   8.803   1.341  -6.609
  565    H    ALA  74           HN       ALA  74  11.093  -0.421  -4.989
  566    HA   ALA  74           HA       ALA  74  10.846   1.704  -3.352
  567   1HB   ALA  74          HB1       ALA  74  12.624  -0.694  -3.025
  568   2HB   ALA  74          HB2       ALA  74  10.919  -0.569  -2.587
  569   3HB   ALA  74          HB3       ALA  74  12.127   0.385  -1.722
  570    H    ASP  75           HN       ASP  75  13.875   0.886  -5.007
  571    HA   ASP  75           HA       ASP  75  15.528   2.557  -3.386
  572   1HB   ASP  75          HB2       ASP  75  15.883   1.414  -6.149
  573   2HB   ASP  75          HB1       ASP  75  17.126   2.354  -5.324
  574    H    ASP  76           HN       ASP  76  13.341   3.340  -5.984
  575    HA   ASP  76           HA       ASP  76  14.718   5.872  -6.590
  576   1HB   ASP  76          HB2       ASP  76  12.276   4.509  -7.724
  577   2HB   ASP  76          HB1       ASP  76  12.802   6.119  -8.214
  578    H    TRP  77           HN       TRP  77  11.553   4.866  -5.248
  579    HA   TRP  77           HA       TRP  77  10.937   7.682  -4.674
  580   1HB   TRP  77          HB2       TRP  77   8.759   7.021  -4.143
  581   2HB   TRP  77          HB1       TRP  77   9.224   6.086  -5.549
  582    HD1  TRP  77           HD1      TRP  77   9.207   3.468  -5.325
  583    HE1  TRP  77           HE1      TRP  77   8.659   1.845  -3.425
  584    HE3  TRP  77           HE3      TRP  77   8.954   6.724  -1.291
  585    HZ2  TRP  77           HZ2      TRP  77   8.196   1.864  -0.631
  586    HZ3  TRP  77           HZ3      TRP  77   8.460   5.837   0.932
  587    HH2  TRP  77           HH2      TRP  77   8.089   3.437   1.273
  588    H    PHE  78           HN       PHE  78  12.287   5.029  -2.871
  589    HA   PHE  78           HA       PHE  78  11.480   6.267  -0.323
  590   1HB   PHE  78          HB2       PHE  78  11.509   3.817  -0.388
  591   2HB   PHE  78          HB1       PHE  78  13.216   3.847  -0.824
  592    HD1  PHE  78           HD1      PHE  78  10.979   5.429   1.765
  593    HD2  PHE  78           HD2      PHE  78  14.762   3.530   0.942
  594    HE1  PHE  78           HE1      PHE  78  11.617   5.644   4.140
  595    HE2  PHE  78           HE2      PHE  78  15.375   3.743   3.326
  596    HZ   PHE  78           HZ       PHE  78  13.806   4.798   4.927
  597    H    VAL  79           HN       VAL  79  12.610   7.694   0.727
  598    HA   VAL  79           HA       VAL  79  15.475   8.029   0.096
  599    HB   VAL  79           HB       VAL  79  14.932  10.496   0.760
  600   1HG1  VAL  79          HG11      VAL  79  15.604  10.032  -1.476
  601   2HG1  VAL  79          HG12      VAL  79  14.073  10.893  -1.635
  602   3HG1  VAL  79          HG13      VAL  79  14.122   9.139  -1.816
  603   1HG2  VAL  79          HG21      VAL  79  12.666  11.203   0.447
  604   2HG2  VAL  79          HG22      VAL  79  12.586   9.811   1.523
  605   3HG2  VAL  79          HG23      VAL  79  12.185   9.627  -0.189
  606    H    SER  80           HN       SER  80  16.840   8.228   1.977
  607    HA   SER  80           HA       SER  80  15.453   8.247   4.609
  608   1HB   SER  80          HB2       SER  80  17.353   6.807   5.377
  609   2HB   SER  80          HB1       SER  80  16.364   6.015   4.147
  610    HG   SER  80           HG       SER  80  18.972   6.922   4.048
  611    H    GLU  81           HN       GLU  81  16.222   9.604   6.101
  612    HA   GLU  81           HA       GLU  81  17.766  11.827   5.382
  613   1HB   GLU  81          HB2       GLU  81  16.238  11.830   7.305
  614   2HB   GLU  81          HB1       GLU  81  17.280  10.685   8.147
  615   1HG   GLU  81          HG2       GLU  81  19.113  12.306   8.156
  616   2HG   GLU  81          HG1       GLU  81  18.140  13.442   7.223
  Start of MODEL    8
    1   1H    MET   1          HT1       MET   1 -13.473   4.577  -1.139
    2   2H    MET   1          HT2       MET   1 -14.318   4.109   0.258
    3   3H    MET   1          HT3       MET   1 -14.908   3.685  -1.277
    4    HA   MET   1           HA       MET   1 -13.940   1.747  -0.429
    5   1HB   MET   1          HB2       MET   1 -13.388   2.330  -2.790
    6   2HB   MET   1          HB1       MET   1 -11.911   3.112  -2.228
    7   1HG   MET   1          HG2       MET   1 -11.120   0.980  -1.289
    8   2HG   MET   1          HG1       MET   1 -12.608   0.191  -1.806
    9   1HE   MET   1          HE1       MET   1 -10.361   2.910  -4.003
   10   2HE   MET   1          HE2       MET   1  -9.096   1.709  -4.251
   11   3HE   MET   1          HE3       MET   1  -9.590   2.134  -2.613
   12    H    ARG   2           HN       ARG   2 -12.448   0.782   0.981
   13    HA   ARG   2           HA       ARG   2 -10.428   2.580   2.212
   14   1HB   ARG   2          HB2       ARG   2 -12.205   0.528   3.569
   15   2HB   ARG   2          HB1       ARG   2 -10.868   1.366   4.358
   16   1HG   ARG   2          HG2       ARG   2 -11.942   3.538   3.883
   17   2HG   ARG   2          HG1       ARG   2 -13.280   2.703   3.092
   18   1HD   ARG   2          HD2       ARG   2 -13.829   1.553   5.188
   19   2HD   ARG   2          HD1       ARG   2 -12.470   2.333   5.993
   20    HE   ARG   2           HE       ARG   2 -14.255   4.248   4.820
   21   1HH1  ARG   2          HH21      ARG   2 -12.877   4.415   7.542
   22   2HH1  ARG   2          HH22      ARG   2 -14.232   4.334   8.618
   23   1HH2  ARG   2          HH11      ARG   2 -16.418   3.150   6.202
   24   2HH2  ARG   2          HH12      ARG   2 -16.236   3.617   7.859
   25    H    ILE   3           HN       ILE   3  -8.416   1.813   2.337
   26    HA   ILE   3           HA       ILE   3  -7.920  -1.035   1.616
   27    HB   ILE   3           HB       ILE   3  -6.268   1.435   1.063
   28   1HG1  ILE   3          HG12      ILE   3  -7.569  -0.466  -0.896
   29   2HG1  ILE   3          HG11      ILE   3  -8.396   0.974  -0.300
   30   1HG2  ILE   3          HG21      ILE   3  -4.936  -0.255  -0.318
   31   2HG2  ILE   3          HG22      ILE   3  -5.782  -1.512   0.585
   32   3HG2  ILE   3          HG23      ILE   3  -4.745  -0.365   1.432
   33   1HD1  ILE   3          HD11      ILE   3  -5.675   1.002  -1.634
   34   2HD1  ILE   3          HD12      ILE   3  -6.632   2.405  -1.160
   35   3HD1  ILE   3          HD13      ILE   3  -7.192   1.354  -2.460
   36    H    GLU   4           HN       GLU   4  -6.929  -2.180   3.199
   37    HA   GLU   4           HA       GLU   4  -5.253  -0.734   5.198
   38   1HB   GLU   4          HB2       GLU   4  -7.075  -3.112   5.689
   39   2HB   GLU   4          HB1       GLU   4  -6.024  -2.359   6.890
   40   1HG   GLU   4          HG2       GLU   4  -7.225  -0.221   6.604
   41   2HG   GLU   4          HG1       GLU   4  -8.277  -0.972   5.407
   42    H    VAL   5           HN       VAL   5  -3.238  -1.399   5.394
   43    HA   VAL   5           HA       VAL   5  -2.488  -4.067   4.293
   44    HB   VAL   5           HB       VAL   5  -0.717  -1.622   4.398
   45   1HG1  VAL   5          HG11      VAL   5   0.656  -2.928   2.835
   46   2HG1  VAL   5          HG12      VAL   5  -0.523  -4.239   2.877
   47   3HG1  VAL   5          HG13      VAL   5   0.398  -3.835   4.326
   48   1HG2  VAL   5          HG21      VAL   5  -1.153  -1.680   1.848
   49   2HG2  VAL   5          HG22      VAL   5  -2.417  -0.999   2.871
   50   3HG2  VAL   5          HG23      VAL   5  -2.578  -2.636   2.248
   51    H    THR   6           HN       THR   6  -1.334  -5.414   5.542
   52    HA   THR   6           HA       THR   6  -0.246  -4.370   8.103
   53    HB   THR   6           HB       THR   6  -0.759  -6.734   8.962
   54    HG1  THR   6           HG1      THR   6  -2.491  -6.619   6.723
   55   1HG2  THR   6          HG21      THR   6  -3.126  -4.988   8.223
   56   2HG2  THR   6          HG22      THR   6  -2.029  -4.640   9.559
   57   3HG2  THR   6          HG23      THR   6  -3.019  -6.100   9.587
   58    H    ILE   7           HN       ILE   7   1.735  -4.885   8.580
   59    HA   ILE   7           HA       ILE   7   3.245  -6.711   6.794
   60    HB   ILE   7           HB       ILE   7   3.981  -4.173   8.239
   61   1HG1  ILE   7          HG12      ILE   7   4.246  -4.979   5.322
   62   2HG1  ILE   7          HG11      ILE   7   2.871  -4.091   5.976
   63   1HG2  ILE   7          HG21      ILE   7   5.725  -6.363   7.073
   64   2HG2  ILE   7          HG22      ILE   7   5.910  -5.508   8.604
   65   3HG2  ILE   7          HG23      ILE   7   6.292  -4.693   7.090
   66   1HD1  ILE   7          HD11      ILE   7   4.169  -2.184   6.454
   67   2HD1  ILE   7          HD12      ILE   7   4.812  -2.730   4.904
   68   3HD1  ILE   7          HD13      ILE   7   5.685  -3.084   6.395
   69    H    ALA   8           HN       ALA   8   4.285  -8.398   7.744
   70    HA   ALA   8           HA       ALA   8   3.752  -9.070  10.430
   71   1HB   ALA   8          HB1       ALA   8   5.819 -10.120   8.482
   72   2HB   ALA   8          HB2       ALA   8   4.208 -10.782   8.767
   73   3HB   ALA   8          HB3       ALA   8   5.438 -10.878  10.029
   74    H    LYS   9           HN       LYS   9   4.711  -8.654  12.163
   75    HA   LYS   9           HA       LYS   9   6.642  -6.655  12.451
   76   1HB   LYS   9          HB2       LYS   9   6.497  -7.004  14.797
   77   2HB   LYS   9          HB1       LYS   9   4.920  -7.497  14.179
   78   1HG   LYS   9          HG2       LYS   9   5.700  -9.872  14.163
   79   2HG   LYS   9          HG1       LYS   9   7.219  -9.351  14.889
   80   1HD   LYS   9          HD2       LYS   9   5.886  -8.344  16.774
   81   2HD   LYS   9          HD1       LYS   9   4.453  -9.118  16.093
   82   1HE   LYS   9          HE2       LYS   9   6.971 -10.518  17.039
   83   2HE   LYS   9          HE1       LYS   9   5.395 -10.554  17.830
   84   1HZ   LYS   9          HZ1       LYS   9   5.610 -12.527  16.551
   85   2HZ   LYS   9          HZ2       LYS   9   6.102 -11.668  15.172
   86   3HZ   LYS   9          HZ3       LYS   9   4.506 -11.531  15.737
   87    H    THR  10           HN       THR  10   7.065 -10.020  11.877
   88    HA   THR  10           HA       THR  10   9.684 -10.367  12.890
   89    HB   THR  10           HB       THR  10   9.810 -12.130  11.053
   90    HG1  THR  10           HG1      THR  10   8.384 -11.935   9.556
   91   1HG2  THR  10          HG21      THR  10   7.540 -12.064  13.051
   92   2HG2  THR  10          HG22      THR  10   9.125 -12.814  13.240
   93   3HG2  THR  10          HG23      THR  10   7.951 -13.503  12.119
   94    H    SER  11           HN       SER  11   8.478  -8.352  10.437
   95    HA   SER  11           HA       SER  11  11.190  -8.056   9.243
   96   1HB   SER  11          HB2       SER  11   9.530  -9.002   7.658
   97   2HB   SER  11          HB1       SER  11   8.515  -7.584   7.904
   98    HG   SER  11           HG       SER  11  11.088  -6.915   7.362
   99    HA   PRO  12           HA       PRO  12   9.988  -3.946  11.077
  100   1HB   PRO  12          HB2       PRO  12  12.640  -3.749  12.197
  101   2HB   PRO  12          HB1       PRO  12  11.119  -3.971  13.080
  102   1HG   PRO  12          HG2       PRO  12  13.152  -5.855  12.896
  103   2HG   PRO  12          HG1       PRO  12  11.473  -6.200  13.345
  104   1HD   PRO  12          HD2       PRO  12  12.853  -6.639  10.722
  105   2HD   PRO  12          HD1       PRO  12  11.548  -7.568  11.485
  106    H    LEU  13           HN       LEU  13  10.098  -2.126  10.123
  107    HA   LEU  13           HA       LEU  13  12.244  -1.747   8.121
  108   1HB   LEU  13          HB2       LEU  13   9.645  -0.215   8.264
  109   2HB   LEU  13          HB1       LEU  13  10.733  -0.396   6.892
  110    HG   LEU  13           HG       LEU  13   9.015  -2.573   8.120
  111   1HD1  LEU  13          HD11      LEU  13   7.764  -1.002   6.690
  112   2HD1  LEU  13          HD12      LEU  13   7.921  -2.567   5.894
  113   3HD1  LEU  13          HD13      LEU  13   8.945  -1.222   5.398
  114   1HD2  LEU  13          HD21      LEU  13  10.968  -3.706   7.404
  115   2HD2  LEU  13          HD22      LEU  13  11.187  -2.645   6.015
  116   3HD2  LEU  13          HD23      LEU  13   9.889  -3.837   6.019
  117    HA   PRO  14           HA       PRO  14  14.059   1.371  10.630
  118   1HB   PRO  14          HB2       PRO  14  14.239   3.461   8.621
  119   2HB   PRO  14          HB1       PRO  14  15.524   2.396   9.208
  120   1HG   PRO  14          HG2       PRO  14  14.002   2.238   6.729
  121   2HG   PRO  14          HG1       PRO  14  15.476   1.378   7.190
  122   1HD   PRO  14          HD2       PRO  14  12.949   0.208   6.950
  123   2HD   PRO  14          HD1       PRO  14  14.310  -0.495   7.842
  124    H    ALA  15           HN       ALA  15  13.685   3.232  11.745
  125    HA   ALA  15           HA       ALA  15  11.064   3.884  12.409
  126   1HB   ALA  15          HB1       ALA  15  13.511   5.591  12.841
  127   2HB   ALA  15          HB2       ALA  15  13.069   4.198  13.828
  128   3HB   ALA  15          HB3       ALA  15  12.018   5.617  13.783
  129    H    GLY  16           HN       GLY  16  10.914   4.258   9.680
  130   1HA   GLY  16          HA2       GLY  16   9.851   6.893   9.462
  131   2HA   GLY  16          HA1       GLY  16  11.395   6.819   8.653
  132    H    ALA  17           HN       ALA  17  10.773   3.861   8.226
  133    HA   ALA  17           HA       ALA  17   9.900   4.153   5.523
  134   1HB   ALA  17          HB1       ALA  17  10.742   1.892   7.279
  135   2HB   ALA  17          HB2       ALA  17  11.415   2.413   5.737
  136   3HB   ALA  17          HB3       ALA  17   9.896   1.515   5.776
  137    H    ILE  18           HN       ILE  18   8.106   2.892   8.326
  138    HA   ILE  18           HA       ILE  18   5.967   1.939   6.794
  139    HB   ILE  18           HB       ILE  18   6.065   3.061   9.598
  140   1HG1  ILE  18          HG12      ILE  18   7.232   0.827   8.815
  141   2HG1  ILE  18          HG11      ILE  18   6.309   0.852  10.311
  142   1HG2  ILE  18          HG21      ILE  18   3.797   3.354   9.037
  143   2HG2  ILE  18          HG22      ILE  18   3.826   1.758   9.789
  144   3HG2  ILE  18          HG23      ILE  18   3.761   1.904   8.033
  145   1HD1  ILE  18          HD11      ILE  18   4.531  -0.352   9.396
  146   2HD1  ILE  18          HD12      ILE  18   5.910  -1.079   8.573
  147   3HD1  ILE  18          HD13      ILE  18   4.922   0.120   7.744
  148    H    ASP  19           HN       ASP  19   6.441   5.110   8.347
  149    HA   ASP  19           HA       ASP  19   4.033   6.237   7.336
  150   1HB   ASP  19          HB2       ASP  19   5.159   8.452   7.800
  151   2HB   ASP  19          HB1       ASP  19   5.102   7.367   9.187
  152    H    ALA  20           HN       ALA  20   7.279   5.986   5.967
  153    HA   ALA  20           HA       ALA  20   6.692   7.701   3.803
  154   1HB   ALA  20          HB1       ALA  20   8.772   7.078   2.916
  155   2HB   ALA  20          HB2       ALA  20   8.684   5.455   3.605
  156   3HB   ALA  20          HB3       ALA  20   8.994   6.839   4.649
  157    H    LEU  21           HN       LEU  21   6.439   4.183   4.203
  158    HA   LEU  21           HA       LEU  21   5.745   3.518   1.584
  159   1HB   LEU  21          HB2       LEU  21   6.452   1.845   3.170
  160   2HB   LEU  21          HB1       LEU  21   5.112   2.227   4.242
  161    HG   LEU  21           HG       LEU  21   3.546   1.489   2.452
  162   1HD1  LEU  21          HD11      LEU  21   4.851   1.736   0.444
  163   2HD1  LEU  21          HD12      LEU  21   4.574   0.011   0.655
  164   3HD1  LEU  21          HD13      LEU  21   6.130   0.710   1.088
  165   1HD2  LEU  21          HD21      LEU  21   5.604  -0.567   3.277
  166   2HD2  LEU  21          HD22      LEU  21   3.946  -0.907   2.782
  167   3HD2  LEU  21          HD23      LEU  21   4.256  -0.019   4.275
  168    H    ALA  22           HN       ALA  22   3.726   4.311   4.379
  169    HA   ALA  22           HA       ALA  22   1.210   4.022   3.082
  170   1HB   ALA  22          HB1       ALA  22   2.050   5.780   5.405
  171   2HB   ALA  22          HB2       ALA  22   1.330   4.173   5.514
  172   3HB   ALA  22          HB3       ALA  22   0.382   5.525   4.895
  173    H    GLY  23           HN       GLY  23   3.454   6.757   3.273
  174   1HA   GLY  23          HA2       GLY  23   1.685   8.592   1.978
  175   2HA   GLY  23          HA1       GLY  23   3.448   8.736   2.177
  176    H    GLU  24           HN       GLU  24   4.328   6.489   0.740
  177    HA   GLU  24           HA       GLU  24   4.020   7.440  -1.904
  178   1HB   GLU  24          HB2       GLU  24   6.051   6.229  -1.012
  179   2HB   GLU  24          HB1       GLU  24   5.113   4.737  -1.033
  180   1HG   GLU  24          HG2       GLU  24   6.413   4.858  -3.078
  181   2HG   GLU  24          HG1       GLU  24   4.713   5.089  -3.484
  182    H    LEU  25           HN       LEU  25   2.581   4.697  -0.192
  183    HA   LEU  25           HA       LEU  25   1.311   3.566  -2.449
  184   1HB   LEU  25          HB2       LEU  25   0.583   3.431   0.475
  185   2HB   LEU  25          HB1       LEU  25  -0.250   2.512  -0.775
  186    HG   LEU  25           HG       LEU  25   2.731   2.355  -0.246
  187   1HD1  LEU  25          HD11      LEU  25   1.354   1.509   1.645
  188   2HD1  LEU  25          HD12      LEU  25   2.234   0.211   0.840
  189   3HD1  LEU  25          HD13      LEU  25   0.514   0.437   0.528
  190   1HD2  LEU  25          HD21      LEU  25   2.478   1.581  -2.448
  191   2HD2  LEU  25          HD22      LEU  25   0.846   0.977  -2.155
  192   3HD2  LEU  25          HD23      LEU  25   2.241   0.091  -1.543
  193    H    SER  26           HN       SER  26   0.186   5.998  -0.151
  194    HA   SER  26           HA       SER  26  -2.484   6.133  -1.058
  195   1HB   SER  26          HB2       SER  26  -2.567   8.276   0.099
  196   2HB   SER  26          HB1       SER  26  -1.681   7.104   1.070
  197    HG   SER  26           HG       SER  26  -0.840   9.429  -0.088
  198    H    ARG  27           HN       ARG  27   0.386   8.056  -2.009
  199    HA   ARG  27           HA       ARG  27  -0.971   9.762  -3.804
  200   1HB   ARG  27          HB2       ARG  27   1.892   8.792  -3.736
  201   2HB   ARG  27          HB1       ARG  27   1.305  10.013  -4.866
  202   1HG   ARG  27          HG2       ARG  27   0.563  11.414  -2.969
  203   2HG   ARG  27          HG1       ARG  27   1.163  10.198  -1.840
  204   1HD   ARG  27          HD2       ARG  27   3.440  10.487  -2.715
  205   2HD   ARG  27          HD1       ARG  27   2.854  11.676  -3.876
  206    HE   ARG  27           HE       ARG  27   3.211  12.075  -0.999
  207   1HH1  ARG  27          HH21      ARG  27   3.368  13.580  -3.956
  208   2HH1  ARG  27          HH22      ARG  27   2.610  15.061  -3.474
  209   1HH2  ARG  27          HH11      ARG  27   1.600  13.849  -0.388
  210   2HH2  ARG  27          HH12      ARG  27   1.609  15.213  -1.456
  211    H    ARG  28           HN       ARG  28   0.559   6.587  -4.324
  212    HA   ARG  28           HA       ARG  28   0.164   6.477  -7.116
  213   1HB   ARG  28          HB2       ARG  28   0.395   4.297  -5.040
  214   2HB   ARG  28          HB1       ARG  28   0.344   3.992  -6.779
  215   1HG   ARG  28          HG2       ARG  28   2.298   5.468  -7.096
  216   2HG   ARG  28          HG1       ARG  28   2.358   5.762  -5.361
  217   1HD   ARG  28          HD2       ARG  28   3.956   4.059  -5.698
  218   2HD   ARG  28          HD1       ARG  28   2.533   3.196  -5.125
  219    HE   ARG  28           HE       ARG  28   2.439   2.144  -7.186
  220   1HH1  ARG  28          HH21      ARG  28   4.175   5.127  -7.419
  221   2HH1  ARG  28          HH22      ARG  28   4.689   4.863  -9.052
  222   1HH2  ARG  28          HH11      ARG  28   3.147   1.770  -9.319
  223   2HH2  ARG  28          HH12      ARG  28   4.108   2.963 -10.126
  224    H    ILE  29           HN       ILE  29  -1.863   5.563  -4.405
  225    HA   ILE  29           HA       ILE  29  -3.932   4.331  -5.906
  226    HB   ILE  29           HB       ILE  29  -3.899   5.598  -3.170
  227   1HG1  ILE  29          HG12      ILE  29  -2.599   3.423  -3.747
  228   2HG1  ILE  29          HG11      ILE  29  -3.639   3.413  -2.330
  229   1HG2  ILE  29          HG21      ILE  29  -6.133   4.205  -4.646
  230   2HG2  ILE  29          HG22      ILE  29  -6.171   5.764  -3.823
  231   3HG2  ILE  29          HG23      ILE  29  -6.077   4.273  -2.884
  232   1HD1  ILE  29          HD11      ILE  29  -4.390   2.305  -5.066
  233   2HD1  ILE  29          HD12      ILE  29  -5.405   2.266  -3.631
  234   3HD1  ILE  29          HD13      ILE  29  -3.906   1.354  -3.671
  235    H    GLN  30           HN       GLN  30  -3.481   7.639  -4.757
  236    HA   GLN  30           HA       GLN  30  -5.999   8.659  -5.666
  237   1HB   GLN  30          HB2       GLN  30  -3.347  10.012  -5.102
  238   2HB   GLN  30          HB1       GLN  30  -4.771  10.901  -5.635
  239   1HG   GLN  30          HG2       GLN  30  -6.014  10.204  -3.665
  240   2HG   GLN  30          HG1       GLN  30  -4.703   9.143  -3.156
  241   1HE2  GLN  30          HE21      GLN  30  -5.657  11.276  -1.484
  242   2HE2  GLN  30          HE22      GLN  30  -4.420  12.431  -1.349
  243    H    TYR  31           HN       TYR  31  -2.850   8.419  -7.386
  244    HA   TYR  31           HA       TYR  31  -3.846   9.822  -9.650
  245   1HB   TYR  31          HB2       TYR  31  -1.508   7.956  -9.256
  246   2HB   TYR  31          HB1       TYR  31  -1.937   8.549 -10.858
  247    HD1  TYR  31           HD1      TYR  31  -2.236  11.149 -11.113
  248    HD2  TYR  31           HD2      TYR  31  -0.134   9.272  -7.866
  249    HE1  TYR  31           HE1      TYR  31  -1.061  13.277 -10.639
  250    HE2  TYR  31           HE2      TYR  31   1.035  11.404  -7.393
  251    HH   TYR  31           HH       TYR  31   1.655  13.479  -8.673
  252    H    ALA  32           HN       ALA  32  -3.858   6.409  -8.729
  253    HA   ALA  32           HA       ALA  32  -4.803   5.451 -11.234
  254   1HB   ALA  32          HB1       ALA  32  -4.809   4.260  -8.464
  255   2HB   ALA  32          HB2       ALA  32  -3.707   3.909  -9.795
  256   3HB   ALA  32          HB3       ALA  32  -5.391   3.394  -9.886
  257    H    PHE  33           HN       PHE  33  -6.384   6.452  -8.254
  258    HA   PHE  33           HA       PHE  33  -9.053   6.100  -9.524
  259   1HB   PHE  33          HB2       PHE  33  -8.238   5.909  -6.622
  260   2HB   PHE  33          HB1       PHE  33  -9.902   5.872  -7.205
  261    HD1  PHE  33           HD1      PHE  33 -10.679   4.018  -8.683
  262    HD2  PHE  33           HD2      PHE  33  -6.781   4.013  -6.881
  263    HE1  PHE  33           HE1      PHE  33 -10.456   1.595  -9.168
  264    HE2  PHE  33           HE2      PHE  33  -6.557   1.591  -7.364
  265    HZ   PHE  33           HZ       PHE  33  -8.395   0.381  -8.508
  266    HA   PRO  34           HA       PRO  34  -8.486  10.611  -8.755
  267   1HB   PRO  34          HB2       PRO  34 -10.056  11.141 -11.133
  268   2HB   PRO  34          HB1       PRO  34  -8.336  11.446 -10.854
  269   1HG   PRO  34          HG2       PRO  34  -9.402   9.525 -12.576
  270   2HG   PRO  34          HG1       PRO  34  -7.729   9.595 -12.004
  271   1HD   PRO  34          HD2       PRO  34  -9.931   7.797 -11.135
  272   2HD   PRO  34          HD1       PRO  34  -8.173   7.554 -11.061
  273    H    ASP  35           HN       ASP  35 -11.309   8.744  -9.615
  274    HA   ASP  35           HA       ASP  35 -13.216  10.736  -8.691
  275   1HB   ASP  35          HB2       ASP  35 -13.488   8.048 -10.014
  276   2HB   ASP  35          HB1       ASP  35 -14.874   8.988  -9.466
  277    H    ASN  36           HN       ASN  36 -11.588   8.088  -7.144
  278    HA   ASN  36           HA       ASN  36 -13.819   7.897  -5.177
  279   1HB   ASN  36          HB2       ASN  36 -11.901   5.755  -6.040
  280   2HB   ASN  36          HB1       ASN  36 -13.097   5.600  -4.757
  281   1HD2  ASN  36          HD21      ASN  36 -12.760   4.538  -7.758
  282   2HD2  ASN  36          HD22      ASN  36 -14.336   4.718  -8.362
  283    H    GLU  37           HN       GLU  37 -13.224   8.414  -2.981
  284    HA   GLU  37           HA       GLU  37 -10.671   9.321  -2.284
  285   1HB   GLU  37          HB2       GLU  37 -12.927   8.190  -0.622
  286   2HB   GLU  37          HB1       GLU  37 -11.596   9.171  -0.022
  287   1HG   GLU  37          HG2       GLU  37 -12.362  11.072  -1.447
  288   2HG   GLU  37          HG1       GLU  37 -13.690  10.069  -2.039
  289    H    GLY  38           HN       GLY  38  -8.893   8.076  -1.877
  290   1HA   GLY  38          HA2       GLY  38  -9.243   5.197  -1.120
  291   2HA   GLY  38          HA1       GLY  38  -7.888   5.712  -1.881
  292    H    HIS  39           HN       HIS  39  -8.740   4.747   1.128
  293    HA   HIS  39           HA       HIS  39  -6.876   6.636   2.431
  294   1HB   HIS  39          HB2       HIS  39  -9.167   6.650   3.377
  295   2HB   HIS  39          HB1       HIS  39  -9.047   4.918   3.678
  296    HD1  HIS  39           HD1      HIS  39  -7.087   8.080   4.565
  297    HD2  HIS  39           HD2      HIS  39  -8.042   4.359   6.186
  298    HE1  HIS  39           HE1      HIS  39  -6.117   8.047   6.906
  299    H    VAL  40           HN       VAL  40  -4.925   5.652   2.934
  300    HA   VAL  40           HA       VAL  40  -4.821   2.707   2.959
  301    HB   VAL  40           HB       VAL  40  -2.660   4.721   2.326
  302   1HG1  VAL  40          HG11      VAL  40  -2.764   1.705   2.415
  303   2HG1  VAL  40          HG12      VAL  40  -1.587   2.785   3.161
  304   3HG1  VAL  40          HG13      VAL  40  -1.589   2.556   1.414
  305   1HG2  VAL  40          HG21      VAL  40  -4.229   2.853   0.515
  306   2HG2  VAL  40          HG22      VAL  40  -2.979   3.989   0.009
  307   3HG2  VAL  40          HG23      VAL  40  -4.514   4.590   0.644
  308    H    SER  41           HN       SER  41  -4.202   1.721   4.743
  309    HA   SER  41           HA       SER  41  -2.761   3.262   6.825
  310   1HB   SER  41          HB2       SER  41  -5.030   2.977   7.641
  311   2HB   SER  41          HB1       SER  41  -5.013   1.266   7.227
  312    HG   SER  41           HG       SER  41  -4.586   1.736   9.472
  313    H    VAL  42           HN       VAL  42  -1.094   2.283   7.845
  314    HA   VAL  42           HA       VAL  42  -0.517  -0.520   7.122
  315    HB   VAL  42           HB       VAL  42   1.516   1.735   7.186
  316   1HG1  VAL  42          HG11      VAL  42   1.762  -1.230   6.619
  317   2HG1  VAL  42          HG12      VAL  42   2.508  -0.332   7.940
  318   3HG1  VAL  42          HG13      VAL  42   3.037  -0.061   6.280
  319   1HG2  VAL  42          HG21      VAL  42   0.848   0.105   4.737
  320   2HG2  VAL  42          HG22      VAL  42   1.577   1.708   4.841
  321   3HG2  VAL  42          HG23      VAL  42  -0.143   1.501   5.154
  322    H    ARG  43           HN       ARG  43  -0.103  -1.775   8.791
  323    HA   ARG  43           HA       ARG  43   1.079  -0.612  11.197
  324   1HB   ARG  43          HB2       ARG  43  -1.487  -2.222  11.346
  325   2HB   ARG  43          HB1       ARG  43  -0.653  -1.425  12.681
  326   1HG   ARG  43          HG2       ARG  43  -1.022   0.770  11.495
  327   2HG   ARG  43          HG1       ARG  43  -2.026  -0.100  10.332
  328   1HD   ARG  43          HD2       ARG  43  -2.501   0.018  13.321
  329   2HD   ARG  43          HD1       ARG  43  -3.406   0.913  12.104
  330    HE   ARG  43           HE       ARG  43  -3.546  -1.786  11.399
  331   1HH1  ARG  43          HH11      ARG  43  -4.556   0.378  13.900
  332   2HH1  ARG  43          HH12      ARG  43  -5.904  -0.594  14.387
  333   1HH2  ARG  43          HH21      ARG  43  -5.270  -3.098  12.074
  334   2HH2  ARG  43          HH22      ARG  43  -6.309  -2.564  13.353
  335    H    TYR  44           HN       TYR  44   1.799  -2.288  12.736
  336    HA   TYR  44           HA       TYR  44   2.735  -4.682  11.328
  337   1HB   TYR  44          HB2       TYR  44   3.203  -3.675  14.153
  338   2HB   TYR  44          HB1       TYR  44   3.883  -5.162  13.507
  339    HD1  TYR  44           HD1      TYR  44   5.135  -4.863  11.148
  340    HD2  TYR  44           HD2      TYR  44   4.519  -1.751  14.048
  341    HE1  TYR  44           HE1      TYR  44   7.057  -3.606  10.213
  342    HE2  TYR  44           HE2      TYR  44   6.433  -0.496  13.110
  343    HH   TYR  44           HH       TYR  44   8.241  -0.651  11.750
  344    H    ALA  45           HN       ALA  45   2.111  -6.724  11.670
  345    HA   ALA  45           HA       ALA  45   0.095  -7.292  13.727
  346   1HB   ALA  45          HB1       ALA  45  -1.002  -6.722  11.478
  347   2HB   ALA  45          HB2       ALA  45  -1.427  -8.276  12.195
  348   3HB   ALA  45          HB3       ALA  45  -0.265  -8.204  10.870
  349    H    ALA  46           HN       ALA  46  -0.229  -9.739  13.862
  350    HA   ALA  46           HA       ALA  46   2.297 -10.963  14.140
  351   1HB   ALA  46          HB1       ALA  46   1.040 -13.063  14.529
  352   2HB   ALA  46          HB2       ALA  46  -0.431 -12.284  13.949
  353   3HB   ALA  46          HB3       ALA  46   0.336 -11.725  15.435
  354    H    ALA  47           HN       ALA  47   0.137 -10.739  11.395
  355    HA   ALA  47           HA       ALA  47   2.152 -12.231   9.836
  356   1HB   ALA  47          HB1       ALA  47   0.522 -13.590   8.759
  357   2HB   ALA  47          HB2       ALA  47  -0.810 -12.689   9.483
  358   3HB   ALA  47          HB3       ALA  47   0.210 -13.718  10.490
  359    H    ASN  48           HN       ASN  48   2.213 -11.813   7.609
  360    HA   ASN  48           HA       ASN  48   1.545  -9.119   6.829
  361   1HB   ASN  48          HB2       ASN  48   3.523 -10.453   5.976
  362   2HB   ASN  48          HB1       ASN  48   2.381 -11.443   5.069
  363   1HD2  ASN  48          HD21      ASN  48   2.533 -10.782   2.925
  364   2HD2  ASN  48          HD22      ASN  48   2.523  -9.166   2.406
  365    H    ASN  49           HN       ASN  49  -0.414  -8.475   6.037
  366    HA   ASN  49           HA       ASN  49  -2.043 -10.323   4.469
  367   1HB   ASN  49          HB2       ASN  49  -3.073  -9.073   7.028
  368   2HB   ASN  49          HB1       ASN  49  -4.050  -9.941   5.850
  369   1HD2  ASN  49          HD21      ASN  49  -2.609 -12.167   5.230
  370   2HD2  ASN  49          HD22      ASN  49  -2.257 -13.080   6.616
  371    H    LEU  50           HN       LEU  50  -3.551  -9.276   3.148
  372    HA   LEU  50           HA       LEU  50  -3.483  -6.315   3.127
  373   1HB   LEU  50          HB2       LEU  50  -2.102  -7.254   1.281
  374   2HB   LEU  50          HB1       LEU  50  -3.483  -8.209   0.749
  375    HG   LEU  50           HG       LEU  50  -4.771  -6.099   0.385
  376   1HD1  LEU  50          HD11      LEU  50  -3.206  -4.003   0.234
  377   2HD1  LEU  50          HD12      LEU  50  -2.220  -4.888   1.398
  378   3HD1  LEU  50          HD13      LEU  50  -3.893  -4.480   1.785
  379   1HD2  LEU  50          HD21      LEU  50  -3.660  -7.054  -1.542
  380   2HD2  LEU  50          HD22      LEU  50  -2.110  -6.369  -1.050
  381   3HD2  LEU  50          HD23      LEU  50  -3.409  -5.310  -1.596
  382    H    SER  51           HN       SER  51  -5.563  -5.554   3.428
  383    HA   SER  51           HA       SER  51  -7.819  -7.294   2.579
  384   1HB   SER  51          HB2       SER  51  -8.984  -5.973   4.531
  385   2HB   SER  51          HB1       SER  51  -7.972  -7.367   4.895
  386    HG   SER  51           HG       SER  51  -6.381  -6.057   5.563
  387    H    VAL  52           HN       VAL  52  -9.247  -6.313   1.203
  388    HA   VAL  52           HA       VAL  52  -9.215  -3.367   0.996
  389    HB   VAL  52           HB       VAL  52  -9.571  -5.342  -1.275
  390   1HG1  VAL  52          HG11      VAL  52 -10.913  -3.356  -1.627
  391   2HG1  VAL  52          HG12      VAL  52  -9.478  -3.230  -2.645
  392   3HG1  VAL  52          HG13      VAL  52  -9.576  -2.314  -1.140
  393   1HG2  VAL  52          HG21      VAL  52  -7.429  -4.279  -2.073
  394   2HG2  VAL  52          HG22      VAL  52  -7.240  -5.236  -0.604
  395   3HG2  VAL  52          HG23      VAL  52  -7.304  -3.476  -0.508
  396    H    ILE  53           HN       ILE  53 -11.192  -2.479   1.390
  397    HA   ILE  53           HA       ILE  53 -13.597  -4.198   1.075
  398    HB   ILE  53           HB       ILE  53 -13.097  -2.100   3.201
  399   1HG1  ILE  53          HG12      ILE  53 -13.412  -5.100   3.538
  400   2HG1  ILE  53          HG11      ILE  53 -11.839  -4.312   3.427
  401   1HG2  ILE  53          HG21      ILE  53 -15.423  -2.111   2.749
  402   2HG2  ILE  53          HG22      ILE  53 -15.250  -3.218   4.110
  403   3HG2  ILE  53          HG23      ILE  53 -15.451  -3.852   2.477
  404   1HD1  ILE  53          HD11      ILE  53 -13.830  -3.242   5.402
  405   2HD1  ILE  53          HD12      ILE  53 -12.067  -3.259   5.477
  406   3HD1  ILE  53          HD13      ILE  53 -12.977  -4.737   5.782
  407    H    GLY  54           HN       GLY  54 -15.169  -3.410  -0.171
  408   1HA   GLY  54          HA2       GLY  54 -16.624  -1.734  -1.001
  409   2HA   GLY  54          HA1       GLY  54 -15.441  -0.509  -0.541
  410    H    ALA  55           HN       ALA  55 -14.097  -3.205  -2.169
  411    HA   ALA  55           HA       ALA  55 -14.023  -1.663  -4.707
  412   1HB   ALA  55          HB1       ALA  55 -11.738  -2.060  -4.936
  413   2HB   ALA  55          HB2       ALA  55 -11.768  -3.469  -3.873
  414   3HB   ALA  55          HB3       ALA  55 -11.882  -1.849  -3.191
  415    H    THR  56           HN       THR  56 -13.542  -2.881  -6.610
  416    HA   THR  56           HA       THR  56 -15.010  -5.438  -6.865
  417    HB   THR  56           HB       THR  56 -14.799  -4.934  -9.223
  418    HG1  THR  56           HG1      THR  56 -13.296  -3.644  -9.855
  419   1HG2  THR  56          HG21      THR  56 -16.100  -2.817  -9.278
  420   2HG2  THR  56          HG22      THR  56 -15.692  -2.545  -7.584
  421   3HG2  THR  56          HG23      THR  56 -16.688  -3.929  -8.042
  422    H    LYS  57           HN       LYS  57 -14.093  -7.159  -7.979
  423    HA   LYS  57           HA       LYS  57 -11.605  -8.004  -7.076
  424   1HB   LYS  57          HB2       LYS  57 -13.124  -8.908  -9.550
  425   2HB   LYS  57          HB1       LYS  57 -11.834  -9.809  -8.765
  426   1HG   LYS  57          HG2       LYS  57 -13.201  -9.996  -6.706
  427   2HG   LYS  57          HG1       LYS  57 -14.490  -9.066  -7.478
  428   1HD   LYS  57          HD2       LYS  57 -14.704 -10.807  -9.210
  429   2HD   LYS  57          HD1       LYS  57 -13.405 -11.729  -8.451
  430   1HE   LYS  57          HE2       LYS  57 -14.731 -11.966  -6.405
  431   2HE   LYS  57          HE1       LYS  57 -16.013 -10.972  -7.096
  432   1HZ   LYS  57          HZ1       LYS  57 -16.754 -13.082  -7.541
  433   2HZ   LYS  57          HZ2       LYS  57 -15.196 -13.707  -7.801
  434   3HZ   LYS  57          HZ3       LYS  57 -15.929 -12.726  -8.979
  435    H    GLU  58           HN       GLU  58 -12.375  -6.418 -10.240
  436    HA   GLU  58           HA       GLU  58  -9.749  -6.779 -11.272
  437   1HB   GLU  58          HB2       GLU  58 -11.972  -4.846 -11.950
  438   2HB   GLU  58          HB1       GLU  58 -10.446  -4.921 -12.832
  439   1HG   GLU  58          HG2       GLU  58 -12.010  -6.300 -14.030
  440   2HG   GLU  58          HG1       GLU  58 -10.895  -7.386 -13.207
  441    H    ASP  59           HN       ASP  59 -11.280  -4.237  -9.342
  442    HA   ASP  59           HA       ASP  59  -9.165  -2.370  -9.519
  443   1HB   ASP  59          HB2       ASP  59 -11.275  -2.839  -7.397
  444   2HB   ASP  59          HB1       ASP  59 -10.134  -1.495  -7.341
  445    H    LYS  60           HN       LYS  60  -9.934  -4.986  -7.295
  446    HA   LYS  60           HA       LYS  60  -7.749  -4.593  -5.532
  447   1HB   LYS  60          HB2       LYS  60  -9.734  -5.982  -4.947
  448   2HB   LYS  60          HB1       LYS  60  -9.220  -7.176  -6.138
  449   1HG   LYS  60          HG2       LYS  60  -7.103  -7.502  -4.906
  450   2HG   LYS  60          HG1       LYS  60  -7.615  -6.304  -3.715
  451   1HD   LYS  60          HD2       LYS  60  -9.557  -7.701  -3.132
  452   2HD   LYS  60          HD1       LYS  60  -9.074  -8.887  -4.346
  453   1HE   LYS  60          HE2       LYS  60  -7.039  -9.389  -3.158
  454   2HE   LYS  60          HE1       LYS  60  -7.302  -8.051  -2.039
  455   1HZ   LYS  60          HZ1       LYS  60  -9.317  -9.152  -1.267
  456   2HZ   LYS  60          HZ2       LYS  60  -7.951 -10.138  -1.043
  457   3HZ   LYS  60          HZ3       LYS  60  -9.028 -10.450  -2.320
  458    H    GLN  61           HN       GLN  61  -7.929  -6.565  -8.531
  459    HA   GLN  61           HA       GLN  61  -5.347  -7.714  -8.126
  460   1HB   GLN  61          HB2       GLN  61  -6.960  -7.186 -10.639
  461   2HB   GLN  61          HB1       GLN  61  -5.419  -8.045 -10.632
  462   1HG   GLN  61          HG2       GLN  61  -6.344  -9.711  -9.074
  463   2HG   GLN  61          HG1       GLN  61  -7.887  -8.860  -9.070
  464   1HE2  GLN  61          HE21      GLN  61  -7.634 -11.594  -9.966
  465   2HE2  GLN  61          HE22      GLN  61  -7.978 -11.628 -11.627
  466    H    ARG  62           HN       ARG  62  -6.482  -4.734  -9.758
  467    HA   ARG  62           HA       ARG  62  -3.965  -3.970 -10.742
  468   1HB   ARG  62          HB2       ARG  62  -6.028  -2.870 -11.500
  469   2HB   ARG  62          HB1       ARG  62  -6.279  -2.207  -9.885
  470   1HG   ARG  62          HG2       ARG  62  -4.241  -0.890 -10.047
  471   2HG   ARG  62          HG1       ARG  62  -3.829  -1.638 -11.589
  472   1HD   ARG  62          HD2       ARG  62  -6.330  -0.010 -11.092
  473   2HD   ARG  62          HD1       ARG  62  -4.863   0.618 -11.842
  474    HE   ARG  62           HE       ARG  62  -5.407  -1.526 -13.390
  475   1HH1  ARG  62          HH21      ARG  62  -6.076   1.466 -13.996
  476   2HH1  ARG  62          HH22      ARG  62  -7.706   1.305 -14.559
  477   1HH2  ARG  62          HH11      ARG  62  -8.081  -1.921 -13.342
  478   2HH2  ARG  62          HH12      ARG  62  -8.843  -0.617 -14.188
  479    H    ILE  63           HN       ILE  63  -5.572  -3.240  -7.689
  480    HA   ILE  63           HA       ILE  63  -3.514  -1.605  -6.682
  481    HB   ILE  63           HB       ILE  63  -5.581  -3.275  -5.290
  482   1HG1  ILE  63          HG12      ILE  63  -5.312  -0.272  -5.498
  483   2HG1  ILE  63          HG11      ILE  63  -6.238  -1.235  -6.648
  484   1HG2  ILE  63          HG21      ILE  63  -3.870  -3.132  -3.659
  485   2HG2  ILE  63          HG22      ILE  63  -4.954  -1.796  -3.275
  486   3HG2  ILE  63          HG23      ILE  63  -3.446  -1.488  -4.136
  487   1HD1  ILE  63          HD11      ILE  63  -6.721  -1.101  -3.656
  488   2HD1  ILE  63          HD12      ILE  63  -7.624  -2.108  -4.787
  489   3HD1  ILE  63          HD13      ILE  63  -7.721  -0.351  -4.899
  490    H    SER  64           HN       SER  64  -3.960  -5.101  -6.514
  491    HA   SER  64           HA       SER  64  -1.684  -5.624  -4.902
  492   1HB   SER  64          HB2       SER  64  -2.931  -7.282  -7.115
  493   2HB   SER  64          HB1       SER  64  -1.722  -7.876  -5.979
  494    HG   SER  64           HG       SER  64  -4.263  -6.789  -5.304
  495    H    GLU  65           HN       GLU  65  -2.102  -5.192  -8.475
  496    HA   GLU  65           HA       GLU  65   0.598  -5.719  -9.100
  497   1HB   GLU  65          HB2       GLU  65  -1.507  -4.097 -10.551
  498   2HB   GLU  65          HB1       GLU  65   0.104  -4.397 -11.204
  499   1HG   GLU  65          HG2       GLU  65  -0.284  -6.827 -11.056
  500   2HG   GLU  65          HG1       GLU  65  -1.895  -6.532 -10.403
  501    H    ILE  66           HN       ILE  66  -1.086  -2.692  -8.308
  502    HA   ILE  66           HA       ILE  66   1.099  -0.978  -8.755
  503    HB   ILE  66           HB       ILE  66  -1.223  -0.726  -6.829
  504   1HG1  ILE  66          HG12      ILE  66  -0.659   0.616  -9.494
  505   2HG1  ILE  66          HG11      ILE  66  -1.675  -0.814  -9.314
  506   1HG2  ILE  66          HG21      ILE  66   0.538   0.716  -6.001
  507   2HG2  ILE  66          HG22      ILE  66  -0.590   1.736  -6.886
  508   3HG2  ILE  66          HG23      ILE  66   0.931   1.255  -7.633
  509   1HD1  ILE  66          HD11      ILE  66  -2.951   1.365  -9.360
  510   2HD1  ILE  66          HD12      ILE  66  -2.171   1.786  -7.838
  511   3HD1  ILE  66          HD13      ILE  66  -3.241   0.388  -7.921
  512    H    LEU  67           HN       LEU  67   0.085  -2.697  -5.838
  513    HA   LEU  67           HA       LEU  67   2.092  -1.689  -4.138
  514   1HB   LEU  67          HB2       LEU  67   0.281  -2.872  -3.106
  515   2HB   LEU  67          HB1       LEU  67   0.531  -4.285  -4.121
  516    HG   LEU  67           HG       LEU  67   2.761  -4.645  -2.991
  517   1HD1  LEU  67          HD11      LEU  67   2.933  -3.429  -0.714
  518   2HD1  LEU  67          HD12      LEU  67   1.799  -2.261  -1.389
  519   3HD1  LEU  67          HD13      LEU  67   3.373  -2.507  -2.148
  520   1HD2  LEU  67          HD21      LEU  67   0.623  -5.755  -2.269
  521   2HD2  LEU  67          HD22      LEU  67   0.425  -4.483  -1.063
  522   3HD2  LEU  67          HD23      LEU  67   1.807  -5.578  -0.973
  523    H    GLN  68           HN       GLN  68   2.028  -4.479  -6.324
  524    HA   GLN  68           HA       GLN  68   4.604  -5.433  -5.615
  525   1HB   GLN  68          HB2       GLN  68   3.008  -5.720  -8.168
  526   2HB   GLN  68          HB1       GLN  68   4.561  -6.513  -7.898
  527   1HG   GLN  68          HG2       GLN  68   2.180  -6.814  -6.045
  528   2HG   GLN  68          HG1       GLN  68   2.559  -7.948  -7.341
  529   1HE2  GLN  68          HE21      GLN  68   2.593  -8.568  -4.450
  530   2HE2  GLN  68          HE22      GLN  68   4.186  -9.016  -4.075
  531    H    GLU  69           HN       GLU  69   3.640  -3.244  -8.314
  532    HA   GLU  69           HA       GLU  69   6.248  -2.837  -9.234
  533   1HB   GLU  69          HB2       GLU  69   3.817  -1.047  -9.374
  534   2HB   GLU  69          HB1       GLU  69   5.312  -0.762 -10.267
  535   1HG   GLU  69          HG2       GLU  69   5.087  -2.969 -11.349
  536   2HG   GLU  69          HG1       GLU  69   3.591  -3.252 -10.461
  537    H    THR  70           HN       THR  70   4.431  -0.958  -6.817
  538    HA   THR  70           HA       THR  70   6.312   1.094  -6.457
  539    HB   THR  70           HB       THR  70   4.504  -0.145  -4.409
  540    HG1  THR  70           HG1      THR  70   4.163   1.775  -6.414
  541   1HG2  THR  70          HG21      THR  70   6.134   1.222  -3.304
  542   2HG2  THR  70          HG22      THR  70   4.651   2.170  -3.400
  543   3HG2  THR  70          HG23      THR  70   5.973   2.487  -4.522
  544    H    TRP  71           HN       TRP  71   5.844  -1.924  -4.823
  545    HA   TRP  71           HA       TRP  71   7.908  -1.797  -3.001
  546   1HB   TRP  71          HB2       TRP  71   5.975  -3.290  -2.924
  547   2HB   TRP  71          HB1       TRP  71   6.609  -4.165  -4.305
  548    HD1  TRP  71           HD1      TRP  71   7.417  -6.395  -3.471
  549    HE1  TRP  71           HE1      TRP  71   8.852  -7.253  -1.519
  550    HE3  TRP  71           HE3      TRP  71   8.097  -2.038  -0.829
  551    HZ2  TRP  71           HZ2      TRP  71  10.094  -6.262   0.843
  552    HZ3  TRP  71           HZ3      TRP  71   9.394  -2.050   1.263
  553    HH2  TRP  71           HH2      TRP  71  10.387  -4.153   2.113
  554    H    GLU  72           HN       GLU  72   7.901  -3.004  -6.295
  555    HA   GLU  72           HA       GLU  72  10.603  -3.936  -6.190
  556   1HB   GLU  72          HB2       GLU  72   8.708  -3.483  -8.500
  557   2HB   GLU  72          HB1       GLU  72  10.338  -4.123  -8.704
  558   1HG   GLU  72          HG2       GLU  72   9.816  -5.986  -7.187
  559   2HG   GLU  72          HG1       GLU  72   8.192  -5.346  -6.944
  560    H    SER  73           HN       SER  73   9.252  -0.783  -6.673
  561    HA   SER  73           HA       SER  73  11.787   0.128  -7.917
  562   1HB   SER  73          HB2       SER  73   9.028   1.348  -7.836
  563   2HB   SER  73          HB1       SER  73  10.452   2.237  -8.372
  564    HG   SER  73           HG       SER  73   9.547  -0.247  -9.417
  565    H    ALA  74           HN       ALA  74  11.168  -0.483  -5.006
  566    HA   ALA  74           HA       ALA  74  10.913   1.659  -3.385
  567   1HB   ALA  74          HB1       ALA  74  12.702  -0.729  -3.021
  568   2HB   ALA  74          HB2       ALA  74  10.985  -0.629  -2.628
  569   3HB   ALA  74          HB3       ALA  74  12.153   0.347  -1.735
  570    H    ASP  75           HN       ASP  75  13.941   0.768  -5.000
  571    HA   ASP  75           HA       ASP  75  15.622   2.406  -3.402
  572   1HB   ASP  75          HB2       ASP  75  17.260   2.132  -5.205
  573   2HB   ASP  75          HB1       ASP  75  16.498   0.600  -4.784
  574    H    ASP  76           HN       ASP  76  13.405   3.257  -5.941
  575    HA   ASP  76           HA       ASP  76  14.795   5.786  -6.533
  576   1HB   ASP  76          HB2       ASP  76  12.336   4.448  -7.665
  577   2HB   ASP  76          HB1       ASP  76  12.884   6.052  -8.153
  578    H    TRP  77           HN       TRP  77  11.623   4.790  -5.189
  579    HA   TRP  77           HA       TRP  77  11.023   7.610  -4.620
  580   1HB   TRP  77          HB2       TRP  77   8.838   6.971  -4.120
  581   2HB   TRP  77          HB1       TRP  77   9.310   5.994  -5.495
  582    HD1  TRP  77           HD1      TRP  77   9.309   3.385  -5.185
  583    HE1  TRP  77           HE1      TRP  77   8.708   1.814  -3.261
  584    HE3  TRP  77           HE3      TRP  77   8.957   6.754  -1.262
  585    HZ2  TRP  77           HZ2      TRP  77   8.166   1.915  -0.485
  586    HZ3  TRP  77           HZ3      TRP  77   8.398   5.930   0.968
  587    HH2  TRP  77           HH2      TRP  77   8.009   3.541   1.369
  588    H    PHE  78           HN       PHE  78  12.340   4.941  -2.820
  589    HA   PHE  78           HA       PHE  78  11.542   6.176  -0.273
  590   1HB   PHE  78          HB2       PHE  78  11.543   3.731  -0.348
  591   2HB   PHE  78          HB1       PHE  78  13.242   3.738  -0.807
  592    HD1  PHE  78           HD1      PHE  78  11.110   5.401   1.841
  593    HD2  PHE  78           HD2      PHE  78  14.755   3.267   0.952
  594    HE1  PHE  78           HE1      PHE  78  11.774   5.514   4.219
  595    HE2  PHE  78           HE2      PHE  78  15.393   3.388   3.335
  596    HZ   PHE  78           HZ       PHE  78  13.907   4.506   4.969
  597    H    VAL  79           HN       VAL  79  12.665   7.615   0.742
  598    HA   VAL  79           HA       VAL  79  15.528   7.974   0.092
  599    HB   VAL  79           HB       VAL  79  13.754  10.197   1.104
  600   1HG1  VAL  79          HG11      VAL  79  16.208  10.521   0.904
  601   2HG1  VAL  79          HG12      VAL  79  15.310  11.579  -0.182
  602   3HG1  VAL  79          HG13      VAL  79  16.104  10.138  -0.814
  603   1HG2  VAL  79          HG21      VAL  79  12.462   9.292  -0.755
  604   2HG2  VAL  79          HG22      VAL  79  13.912   9.201  -1.761
  605   3HG2  VAL  79          HG23      VAL  79  13.263  10.771  -1.294
  606    H    SER  80           HN       SER  80  16.917   7.972   1.965
  607    HA   SER  80           HA       SER  80  15.537   7.915   4.600
  608   1HB   SER  80          HB2       SER  80  17.350   6.393   5.320
  609   2HB   SER  80          HB1       SER  80  16.469   5.700   3.957
  610    HG   SER  80           HG       SER  80  19.047   6.762   4.099
  611    H    GLU  81           HN       GLU  81  16.333   9.157   6.166
  612    HA   GLU  81           HA       GLU  81  17.703  11.488   5.666
  613   1HB   GLU  81          HB2       GLU  81  16.435  10.924   7.754
  614   2HB   GLU  81          HB1       GLU  81  17.817   9.960   8.274
  615   1HG   GLU  81          HG2       GLU  81  18.019  12.143   9.285
  616   2HG   GLU  81          HG1       GLU  81  19.250  12.019   8.031
  Start of MODEL    9
    1   1H    MET   1          HT1       MET   1 -14.440   4.107   0.056
    2   2H    MET   1          HT2       MET   1 -14.082   4.115  -1.605
    3   3H    MET   1          HT3       MET   1 -13.011   4.833  -0.499
    4    HA   MET   1           HA       MET   1 -13.660   1.965  -0.263
    5   1HB   MET   1          HB2       MET   1 -11.578   3.229  -2.061
    6   2HB   MET   1          HB1       MET   1 -11.643   1.515  -1.661
    7   1HG   MET   1          HG2       MET   1 -14.070   1.610  -2.567
    8   2HG   MET   1          HG1       MET   1 -13.582   3.137  -3.305
    9   1HE   MET   1          HE1       MET   1 -10.411   2.062  -5.325
   10   2HE   MET   1          HE2       MET   1 -10.253   2.024  -3.571
   11   3HE   MET   1          HE3       MET   1 -11.167   3.322  -4.342
   12    H    ARG   2           HN       ARG   2 -12.236   0.975   1.195
   13    HA   ARG   2           HA       ARG   2 -10.184   2.732   2.409
   14   1HB   ARG   2          HB2       ARG   2 -12.115   2.364   3.954
   15   2HB   ARG   2          HB1       ARG   2 -11.835   0.625   3.846
   16   1HG   ARG   2          HG2       ARG   2  -9.623   0.857   4.808
   17   2HG   ARG   2          HG1       ARG   2  -9.747   2.616   4.770
   18   1HD   ARG   2          HD2       ARG   2 -10.228   1.938   7.022
   19   2HD   ARG   2          HD1       ARG   2 -11.758   2.409   6.291
   20    HE   ARG   2           HE       ARG   2 -11.389  -0.363   5.907
   21   1HH1  ARG   2          HH21      ARG   2 -13.138   1.854   7.682
   22   2HH1  ARG   2          HH22      ARG   2 -13.467   0.814   9.028
   23   1HH2  ARG   2          HH11      ARG   2 -11.292  -1.673   7.981
   24   2HH2  ARG   2          HH12      ARG   2 -12.420  -1.181   9.197
   25    H    ILE   3           HN       ILE   3  -8.198   1.929   2.451
   26    HA   ILE   3           HA       ILE   3  -7.786  -0.934   1.725
   27    HB   ILE   3           HB       ILE   3  -6.098   1.496   1.106
   28   1HG1  ILE   3          HG12      ILE   3  -6.572   0.443  -1.293
   29   2HG1  ILE   3          HG11      ILE   3  -7.965  -0.269  -0.487
   30   1HG2  ILE   3          HG21      ILE   3  -5.622  -1.466   0.761
   31   2HG2  ILE   3          HG22      ILE   3  -4.575  -0.274   1.530
   32   3HG2  ILE   3          HG23      ILE   3  -4.780  -0.265  -0.221
   33   1HD1  ILE   3          HD11      ILE   3  -7.359   2.700  -0.385
   34   2HD1  ILE   3          HD12      ILE   3  -8.860   1.888   0.053
   35   3HD1  ILE   3          HD13      ILE   3  -8.364   1.969  -1.632
   36    H    GLU   4           HN       GLU   4  -6.793  -2.104   3.288
   37    HA   GLU   4           HA       GLU   4  -5.082  -0.673   5.263
   38   1HB   GLU   4          HB2       GLU   4  -6.947  -3.009   5.793
   39   2HB   GLU   4          HB1       GLU   4  -5.868  -2.267   6.976
   40   1HG   GLU   4          HG2       GLU   4  -7.025  -0.107   6.681
   41   2HG   GLU   4          HG1       GLU   4  -8.106  -0.846   5.502
   42    H    VAL   5           HN       VAL   5  -3.093  -1.373   5.467
   43    HA   VAL   5           HA       VAL   5  -2.382  -4.059   4.392
   44    HB   VAL   5           HB       VAL   5  -0.590  -1.625   4.484
   45   1HG1  VAL   5          HG11      VAL   5  -0.386  -4.217   2.921
   46   2HG1  VAL   5          HG12      VAL   5   0.479  -3.894   4.422
   47   3HG1  VAL   5          HG13      VAL   5   0.817  -2.931   2.985
   48   1HG2  VAL   5          HG21      VAL   5  -2.467  -2.641   2.344
   49   2HG2  VAL   5          HG22      VAL   5  -1.024  -1.727   1.918
   50   3HG2  VAL   5          HG23      VAL   5  -2.261  -0.995   2.935
   51    H    THR   6           HN       THR   6  -1.302  -5.426   5.663
   52    HA   THR   6           HA       THR   6  -0.230  -4.426   8.248
   53    HB   THR   6           HB       THR   6  -0.932  -6.453   9.295
   54    HG1  THR   6           HG1      THR   6  -0.530  -7.581   7.124
   55   1HG2  THR   6          HG21      THR   6  -3.353  -6.356   9.014
   56   2HG2  THR   6          HG22      THR   6  -3.166  -5.565   7.448
   57   3HG2  THR   6          HG23      THR   6  -2.694  -4.722   8.924
   58    H    ILE   7           HN       ILE   7   1.773  -4.899   8.713
   59    HA   ILE   7           HA       ILE   7   3.281  -6.770   6.978
   60    HB   ILE   7           HB       ILE   7   3.972  -4.162   8.311
   61   1HG1  ILE   7          HG12      ILE   7   4.466  -5.168   5.486
   62   2HG1  ILE   7          HG11      ILE   7   3.020  -4.280   5.965
   63   1HG2  ILE   7          HG21      ILE   7   5.807  -6.425   7.496
   64   2HG2  ILE   7          HG22      ILE   7   5.906  -5.369   8.906
   65   3HG2  ILE   7          HG23      ILE   7   6.362  -4.758   7.317
   66   1HD1  ILE   7          HD11      ILE   7   4.222  -2.310   6.399
   67   2HD1  ILE   7          HD12      ILE   7   5.005  -2.942   4.952
   68   3HD1  ILE   7          HD13      ILE   7   5.763  -3.161   6.529
   69    H    ALA   8           HN       ALA   8   4.288  -8.453   7.979
   70    HA   ALA   8           HA       ALA   8   3.740  -9.059  10.682
   71   1HB   ALA   8          HB1       ALA   8   5.690 -10.184   8.674
   72   2HB   ALA   8          HB2       ALA   8   4.146 -10.866   9.185
   73   3HB   ALA   8          HB3       ALA   8   5.513 -10.849  10.297
   74    H    LYS   9           HN       LYS   9   4.708  -8.619  12.418
   75    HA   LYS   9           HA       LYS   9   6.662  -6.643  12.665
   76   1HB   LYS   9          HB2       LYS   9   5.052  -7.170  14.480
   77   2HB   LYS   9          HB1       LYS   9   5.832  -8.727  14.718
   78   1HG   LYS   9          HG2       LYS   9   7.937  -7.578  15.365
   79   2HG   LYS   9          HG1       LYS   9   7.148  -6.013  15.140
   80   1HD   LYS   9          HD2       LYS   9   5.539  -6.517  16.892
   81   2HD   LYS   9          HD1       LYS   9   6.198  -8.144  17.070
   82   1HE   LYS   9          HE2       LYS   9   8.406  -7.132  17.676
   83   2HE   LYS   9          HE1       LYS   9   7.645  -5.542  17.632
   84   1HZ   LYS   9          HZ1       LYS   9   7.746  -6.539  19.876
   85   2HZ   LYS   9          HZ2       LYS   9   6.720  -7.784  19.341
   86   3HZ   LYS   9          HZ3       LYS   9   6.166  -6.178  19.373
   87    H    THR  10           HN       THR  10   7.031 -10.042  12.192
   88    HA   THR  10           HA       THR  10   9.646 -10.391  13.214
   89    HB   THR  10           HB       THR  10   9.708 -12.241  11.436
   90    HG1  THR  10           HG1      THR  10   7.621 -12.663  10.556
   91   1HG2  THR  10          HG21      THR  10   7.452 -12.109  13.456
   92   2HG2  THR  10          HG22      THR  10   9.088 -12.701  13.743
   93   3HG2  THR  10          HG23      THR  10   8.005 -13.587  12.670
   94    H    SER  11           HN       SER  11   8.464  -8.472  10.673
   95    HA   SER  11           HA       SER  11  11.168  -8.298   9.438
   96   1HB   SER  11          HB2       SER  11   9.350  -9.291   7.979
   97   2HB   SER  11          HB1       SER  11   8.547  -7.725   8.048
   98    HG   SER  11           HG       SER  11  10.439  -8.447   6.415
   99    HA   PRO  12           HA       PRO  12  10.085  -4.081  11.098
  100   1HB   PRO  12          HB2       PRO  12  12.764  -3.907  12.165
  101   2HB   PRO  12          HB1       PRO  12  11.249  -4.031  13.077
  102   1HG   PRO  12          HG2       PRO  12  13.205  -5.992  12.979
  103   2HG   PRO  12          HG1       PRO  12  11.513  -6.261  13.431
  104   1HD   PRO  12          HD2       PRO  12  12.884  -6.844  10.830
  105   2HD   PRO  12          HD1       PRO  12  11.567  -7.716  11.637
  106    H    LEU  13           HN       LEU  13  10.210  -2.312  10.068
  107    HA   LEU  13           HA       LEU  13  12.345  -2.016   8.035
  108   1HB   LEU  13          HB2       LEU  13   9.695  -0.561   8.134
  109   2HB   LEU  13          HB1       LEU  13  10.806  -0.685   6.770
  110    HG   LEU  13           HG       LEU  13   9.223  -2.962   8.008
  111   1HD1  LEU  13          HD11      LEU  13   8.023  -3.023   5.902
  112   2HD1  LEU  13          HD12      LEU  13   9.058  -1.768   5.224
  113   3HD1  LEU  13          HD13      LEU  13   7.941  -1.379   6.533
  114   1HD2  LEU  13          HD21      LEU  13  10.168  -4.191   5.933
  115   2HD2  LEU  13          HD22      LEU  13  11.259  -3.945   7.293
  116   3HD2  LEU  13          HD23      LEU  13  11.369  -2.901   5.876
  117    HA   PRO  14           HA       PRO  14  14.120   1.214  10.377
  118   1HB   PRO  14          HB2       PRO  14  14.227   3.249   8.295
  119   2HB   PRO  14          HB1       PRO  14  15.550   2.227   8.884
  120   1HG   PRO  14          HG2       PRO  14  13.913   1.934   6.471
  121   2HG   PRO  14          HG1       PRO  14  15.469   1.188   6.866
  122   1HD   PRO  14          HD2       PRO  14  13.072  -0.193   6.780
  123   2HD   PRO  14          HD1       PRO  14  14.476  -0.711   7.734
  124    H    ALA  15           HN       ALA  15  13.678   2.994  11.502
  125    HA   ALA  15           HA       ALA  15  11.047   3.591  12.145
  126   1HB   ALA  15          HB1       ALA  15  11.930   5.212  13.619
  127   2HB   ALA  15          HB2       ALA  15  13.366   5.443  12.622
  128   3HB   ALA  15          HB3       ALA  15  13.142   3.936  13.507
  129    H    GLY  16           HN       GLY  16  10.856   4.001   9.425
  130   1HA   GLY  16          HA2       GLY  16   9.786   6.632   9.242
  131   2HA   GLY  16          HA1       GLY  16  11.323   6.583   8.432
  132    H    ALA  17           HN       ALA  17  10.713   3.615   7.901
  133    HA   ALA  17           HA       ALA  17   9.838   4.042   5.222
  134   1HB   ALA  17          HB1       ALA  17  11.359   2.298   5.326
  135   2HB   ALA  17          HB2       ALA  17   9.848   1.388   5.316
  136   3HB   ALA  17          HB3       ALA  17  10.695   1.680   6.836
  137    H    ILE  18           HN       ILE  18   8.042   2.687   7.951
  138    HA   ILE  18           HA       ILE  18   5.891   1.779   6.389
  139    HB   ILE  18           HB       ILE  18   5.962   2.829   9.223
  140   1HG1  ILE  18          HG12      ILE  18   7.244   0.667   8.385
  141   2HG1  ILE  18          HG11      ILE  18   6.340   0.628   9.886
  142   1HG2  ILE  18          HG21      ILE  18   3.688   3.025   8.587
  143   2HG2  ILE  18          HG22      ILE  18   3.786   1.458   9.389
  144   3HG2  ILE  18          HG23      ILE  18   3.743   1.545   7.628
  145   1HD1  ILE  18          HD11      ILE  18   5.973  -1.334   8.296
  146   2HD1  ILE  18          HD12      ILE  18   5.107  -0.203   7.259
  147   3HD1  ILE  18          HD13      ILE  18   4.518  -0.532   8.886
  148    H    ASP  19           HN       ASP  19   6.416   4.902   8.014
  149    HA   ASP  19           HA       ASP  19   4.025   6.113   7.056
  150   1HB   ASP  19          HB2       ASP  19   6.663   7.334   7.936
  151   2HB   ASP  19          HB1       ASP  19   5.244   8.290   7.509
  152    H    ALA  20           HN       ALA  20   7.245   5.804   5.636
  153    HA   ALA  20           HA       ALA  20   6.647   7.507   3.467
  154   1HB   ALA  20          HB1       ALA  20   8.739   6.944   2.649
  155   2HB   ALA  20          HB2       ALA  20   8.570   5.241   3.074
  156   3HB   ALA  20          HB3       ALA  20   8.939   6.429   4.322
  157    H    LEU  21           HN       LEU  21   6.267   4.016   3.931
  158    HA   LEU  21           HA       LEU  21   5.513   3.319   1.343
  159   1HB   LEU  21          HB2       LEU  21   6.172   1.627   2.889
  160   2HB   LEU  21          HB1       LEU  21   4.959   2.127   4.062
  161    HG   LEU  21           HG       LEU  21   3.184   1.387   2.540
  162   1HD1  LEU  21          HD11      LEU  21   3.899  -0.045   0.560
  163   2HD1  LEU  21          HD12      LEU  21   5.515   0.622   0.771
  164   3HD1  LEU  21          HD13      LEU  21   4.167   1.687   0.368
  165   1HD2  LEU  21          HD21      LEU  21   3.445  -0.942   2.925
  166   2HD2  LEU  21          HD22      LEU  21   4.378  -0.161   4.201
  167   3HD2  LEU  21          HD23      LEU  21   5.202  -0.842   2.797
  168    H    ALA  22           HN       ALA  22   3.521   4.175   4.163
  169    HA   ALA  22           HA       ALA  22   0.979   3.900   2.919
  170   1HB   ALA  22          HB1       ALA  22   0.107   4.947   4.828
  171   2HB   ALA  22          HB2       ALA  22   1.547   5.939   5.056
  172   3HB   ALA  22          HB3       ALA  22   1.592   4.219   5.442
  173    H    GLY  23           HN       GLY  23   3.190   6.665   3.061
  174   1HA   GLY  23          HA2       GLY  23   1.384   8.487   1.769
  175   2HA   GLY  23          HA1       GLY  23   3.148   8.627   1.949
  176    H    GLU  24           HN       GLU  24   3.960   6.329   0.470
  177    HA   GLU  24           HA       GLU  24   3.568   7.283  -2.166
  178   1HB   GLU  24          HB2       GLU  24   4.873   4.816  -1.014
  179   2HB   GLU  24          HB1       GLU  24   4.573   4.898  -2.755
  180   1HG   GLU  24          HG2       GLU  24   6.055   7.019  -1.182
  181   2HG   GLU  24          HG1       GLU  24   6.816   5.713  -2.077
  182    H    LEU  25           HN       LEU  25   2.060   4.642  -0.365
  183    HA   LEU  25           HA       LEU  25   0.687   3.591  -2.580
  184   1HB   LEU  25          HB2       LEU  25   0.137   3.422   0.375
  185   2HB   LEU  25          HB1       LEU  25  -0.878   2.609  -0.814
  186    HG   LEU  25           HG       LEU  25   2.127   2.235  -0.627
  187   1HD1  LEU  25          HD11      LEU  25   1.562   0.049   0.442
  188   2HD1  LEU  25          HD12      LEU  25  -0.126   0.555   0.512
  189   3HD1  LEU  25          HD13      LEU  25   1.094   1.431   1.432
  190   1HD2  LEU  25          HD21      LEU  25  -0.068   1.060  -2.322
  191   2HD2  LEU  25          HD22      LEU  25   1.258   0.003  -1.839
  192   3HD2  LEU  25          HD23      LEU  25   1.594   1.463  -2.758
  193    H    SER  26           HN       SER  26  -0.311   6.033  -0.208
  194    HA   SER  26           HA       SER  26  -2.982   6.275  -1.075
  195   1HB   SER  26          HB2       SER  26  -1.131   8.280   0.217
  196   2HB   SER  26          HB1       SER  26  -2.848   8.567  -0.052
  197    HG   SER  26           HG       SER  26  -1.555   6.857   1.723
  198    H    ARG  27           HN       ARG  27  -0.050   8.057  -2.120
  199    HA   ARG  27           HA       ARG  27  -1.395   9.787  -3.916
  200   1HB   ARG  27          HB2       ARG  27   1.430   8.691  -3.934
  201   2HB   ARG  27          HB1       ARG  27   0.853   9.915  -5.065
  202   1HG   ARG  27          HG2       ARG  27   0.251  11.374  -3.151
  203   2HG   ARG  27          HG1       ARG  27   0.889  10.159  -2.044
  204   1HD   ARG  27          HD2       ARG  27   3.110  10.364  -3.080
  205   2HD   ARG  27          HD1       ARG  27   2.481  11.561  -4.210
  206    HE   ARG  27           HE       ARG  27   2.671  13.136  -2.526
  207   1HH1  ARG  27          HH11      ARG  27   4.785  11.646  -1.123
  208   2HH1  ARG  27          HH12      ARG  27   4.136  11.420   0.466
  209   1HH2  ARG  27          HH21      ARG  27   0.873  12.111  -0.484
  210   2HH2  ARG  27          HH22      ARG  27   1.918  11.683   0.828
  211    H    ARG  28           HN       ARG  28  -0.073   6.535  -4.309
  212    HA   ARG  28           HA       ARG  28  -0.530   6.290  -7.082
  213   1HB   ARG  28          HB2       ARG  28  -0.397   4.241  -4.866
  214   2HB   ARG  28          HB1       ARG  28  -0.514   3.819  -6.571
  215   1HG   ARG  28          HG2       ARG  28   1.646   5.716  -5.668
  216   2HG   ARG  28          HG1       ARG  28   1.860   3.985  -5.422
  217   1HD   ARG  28          HD2       ARG  28   1.606   3.563  -7.804
  218   2HD   ARG  28          HD1       ARG  28   1.221   5.251  -8.107
  219    HE   ARG  28           HE       ARG  28   3.491   5.749  -7.964
  220   1HH1  ARG  28          HH11      ARG  28   3.419   2.558  -8.510
  221   2HH1  ARG  28          HH12      ARG  28   4.819   2.118  -7.589
  222   1HH2  ARG  28          HH21      ARG  28   5.067   5.189  -5.997
  223   2HH2  ARG  28          HH22      ARG  28   5.753   3.608  -6.169
  224    H    ILE  29           HN       ILE  29  -2.560   5.621  -4.275
  225    HA   ILE  29           HA       ILE  29  -4.692   4.367  -5.642
  226    HB   ILE  29           HB       ILE  29  -4.592   5.861  -3.020
  227   1HG1  ILE  29          HG12      ILE  29  -3.325   3.601  -3.484
  228   2HG1  ILE  29          HG11      ILE  29  -4.258   3.777  -2.004
  229   1HG2  ILE  29          HG21      ILE  29  -6.879   5.966  -3.650
  230   2HG2  ILE  29          HG22      ILE  29  -6.770   4.559  -2.594
  231   3HG2  ILE  29          HG23      ILE  29  -6.851   4.345  -4.342
  232   1HD1  ILE  29          HD11      ILE  29  -4.513   1.632  -3.569
  233   2HD1  ILE  29          HD12      ILE  29  -5.661   2.667  -4.413
  234   3HD1  ILE  29          HD13      ILE  29  -5.895   2.302  -2.704
  235    H    GLN  30           HN       GLN  30  -4.207   7.712  -4.631
  236    HA   GLN  30           HA       GLN  30  -6.699   8.725  -5.568
  237   1HB   GLN  30          HB2       GLN  30  -5.400  10.007  -3.983
  238   2HB   GLN  30          HB1       GLN  30  -4.029  10.072  -5.088
  239   1HG   GLN  30          HG2       GLN  30  -5.226  11.475  -6.625
  240   2HG   GLN  30          HG1       GLN  30  -6.747  11.223  -5.768
  241   1HE2  GLN  30          HE21      GLN  30  -4.460  11.426  -3.373
  242   2HE2  GLN  30          HE22      GLN  30  -4.537  13.090  -3.051
  243    H    TYR  31           HN       TYR  31  -3.550   8.382  -7.254
  244    HA   TYR  31           HA       TYR  31  -4.469   9.754  -9.552
  245   1HB   TYR  31          HB2       TYR  31  -2.063   9.390  -9.166
  246   2HB   TYR  31          HB1       TYR  31  -2.299   7.646  -9.289
  247    HD1  TYR  31           HD1      TYR  31  -2.856   6.591 -11.437
  248    HD2  TYR  31           HD2      TYR  31  -2.145  10.816 -11.135
  249    HE1  TYR  31           HE1      TYR  31  -2.645   6.730 -13.903
  250    HE2  TYR  31           HE2      TYR  31  -1.932  10.956 -13.603
  251    HH   TYR  31           HH       TYR  31  -1.378   8.438 -15.546
  252    H    ALA  32           HN       ALA  32  -4.544   6.352  -8.599
  253    HA   ALA  32           HA       ALA  32  -5.523   5.399 -11.091
  254   1HB   ALA  32          HB1       ALA  32  -5.673   4.199  -8.323
  255   2HB   ALA  32          HB2       ALA  32  -4.422   3.909  -9.529
  256   3HB   ALA  32          HB3       ALA  32  -6.068   3.344  -9.814
  257    H    PHE  33           HN       PHE  33  -7.050   6.491  -8.119
  258    HA   PHE  33           HA       PHE  33  -9.739   6.190  -9.354
  259   1HB   PHE  33          HB2       PHE  33  -8.905   6.042  -6.457
  260   2HB   PHE  33          HB1       PHE  33 -10.566   5.984  -7.046
  261    HD1  PHE  33           HD1      PHE  33 -11.338   4.112  -8.478
  262    HD2  PHE  33           HD2      PHE  33  -7.422   4.155  -6.714
  263    HE1  PHE  33           HE1      PHE  33 -11.090   1.693  -8.966
  264    HE2  PHE  33           HE2      PHE  33  -7.175   1.736  -7.200
  265    HZ   PHE  33           HZ       PHE  33  -9.011   0.506  -8.326
  266    HA   PRO  34           HA       PRO  34  -9.037  10.698  -8.688
  267   1HB   PRO  34          HB2       PRO  34 -10.664  11.214 -11.031
  268   2HB   PRO  34          HB1       PRO  34  -8.930  11.483 -10.815
  269   1HG   PRO  34          HG2       PRO  34 -10.104   9.546 -12.453
  270   2HG   PRO  34          HG1       PRO  34  -8.408   9.600 -11.950
  271   1HD   PRO  34          HD2       PRO  34 -10.596   7.849 -10.966
  272   2HD   PRO  34          HD1       PRO  34  -8.837   7.595 -10.929
  273    H    ASP  35           HN       ASP  35 -11.928   8.844  -9.251
  274    HA   ASP  35           HA       ASP  35 -13.678  10.984  -8.255
  275   1HB   ASP  35          HB2       ASP  35 -15.505   9.574  -9.050
  276   2HB   ASP  35          HB1       ASP  35 -14.310   9.864 -10.312
  277    H    ASN  36           HN       ASN  36 -12.076   8.330  -6.762
  278    HA   ASN  36           HA       ASN  36 -14.290   8.127  -4.779
  279   1HB   ASN  36          HB2       ASN  36 -12.373   5.975  -5.632
  280   2HB   ASN  36          HB1       ASN  36 -13.572   5.824  -4.356
  281   1HD2  ASN  36          HD21      ASN  36 -15.848   6.919  -5.362
  282   2HD2  ASN  36          HD22      ASN  36 -16.310   6.166  -6.812
  283    H    GLU  37           HN       GLU  37 -13.679   8.673  -2.597
  284    HA   GLU  37           HA       GLU  37 -11.131   9.565  -1.918
  285   1HB   GLU  37          HB2       GLU  37 -13.196  10.185  -0.820
  286   2HB   GLU  37          HB1       GLU  37 -13.455   8.527  -0.301
  287   1HG   GLU  37          HG2       GLU  37 -11.401   8.639   1.086
  288   2HG   GLU  37          HG1       GLU  37 -11.140  10.309   0.572
  289    H    GLY  38           HN       GLY  38  -9.340   8.315  -1.490
  290   1HA   GLY  38          HA2       GLY  38  -9.710   5.452  -0.696
  291   2HA   GLY  38          HA1       GLY  38  -8.367   5.931  -1.493
  292    H    HIS  39           HN       HIS  39  -9.091   4.959   1.521
  293    HA   HIS  39           HA       HIS  39  -7.156   6.819   2.763
  294   1HB   HIS  39          HB2       HIS  39  -9.365   5.158   4.017
  295   2HB   HIS  39          HB1       HIS  39  -8.162   6.066   4.935
  296    HD1  HIS  39           HD1      HIS  39  -8.078   8.739   4.287
  297    HD2  HIS  39           HD2      HIS  39 -11.568   6.676   3.321
  298    HE1  HIS  39           HE1      HIS  39  -9.864  10.492   3.909
  299    H    VAL  40           HN       VAL  40  -5.189   5.819   3.162
  300    HA   VAL  40           HA       VAL  40  -5.106   2.880   3.173
  301    HB   VAL  40           HB       VAL  40  -2.957   4.874   2.462
  302   1HG1  VAL  40          HG11      VAL  40  -3.077   1.852   2.494
  303   2HG1  VAL  40          HG12      VAL  40  -1.946   2.893   3.358
  304   3HG1  VAL  40          HG13      VAL  40  -1.852   2.754   1.604
  305   1HG2  VAL  40          HG21      VAL  40  -4.331   2.923   0.603
  306   2HG2  VAL  40          HG22      VAL  40  -3.402   4.360   0.194
  307   3HG2  VAL  40          HG23      VAL  40  -5.016   4.525   0.885
  308    H    SER  41           HN       SER  41  -4.420   1.883   4.942
  309    HA   SER  41           HA       SER  41  -2.905   3.421   6.975
  310   1HB   SER  41          HB2       SER  41  -5.139   3.153   7.878
  311   2HB   SER  41          HB1       SER  41  -5.154   1.442   7.458
  312    HG   SER  41           HG       SER  41  -4.358   1.180   9.382
  313    H    VAL  42           HN       VAL  42  -1.216   2.446   7.945
  314    HA   VAL  42           HA       VAL  42  -0.662  -0.365   7.213
  315    HB   VAL  42           HB       VAL  42   1.441   1.823   7.294
  316   1HG1  VAL  42          HG11      VAL  42   2.353  -0.366   7.746
  317   2HG1  VAL  42          HG12      VAL  42   2.779   0.061   6.089
  318   3HG1  VAL  42          HG13      VAL  42   1.461  -1.069   6.396
  319   1HG2  VAL  42          HG21      VAL  42  -0.177   2.158   5.420
  320   2HG2  VAL  42          HG22      VAL  42   0.189   0.532   4.853
  321   3HG2  VAL  42          HG23      VAL  42   1.446   1.765   4.856
  322    H    ARG  43           HN       ARG  43  -0.176  -1.618   8.855
  323    HA   ARG  43           HA       ARG  43   1.058  -0.488  11.241
  324   1HB   ARG  43          HB2       ARG  43  -0.697  -1.454  12.728
  325   2HB   ARG  43          HB1       ARG  43  -1.301  -0.152  11.702
  326   1HG   ARG  43          HG2       ARG  43  -2.111  -1.878  10.076
  327   2HG   ARG  43          HG1       ARG  43  -1.628  -3.130  11.223
  328   1HD   ARG  43          HD2       ARG  43  -4.018  -2.617  11.476
  329   2HD   ARG  43          HD1       ARG  43  -3.129  -2.144  12.922
  330    HE   ARG  43           HE       ARG  43  -3.142   0.136  11.441
  331   1HH1  ARG  43          HH21      ARG  43  -5.733  -1.273  10.373
  332   2HH1  ARG  43          HH22      ARG  43  -6.928  -0.460  11.327
  333   1HH2  ARG  43          HH11      ARG  43  -4.633   0.844  13.574
  334   2HH2  ARG  43          HH12      ARG  43  -6.306   0.737  13.140
  335    H    TYR  44           HN       TYR  44   1.722  -2.204  12.800
  336    HA   TYR  44           HA       TYR  44   2.564  -4.622  11.361
  337   1HB   TYR  44          HB2       TYR  44   3.115  -3.759  14.211
  338   2HB   TYR  44          HB1       TYR  44   3.810  -5.163  13.407
  339    HD1  TYR  44           HD1      TYR  44   3.811  -1.497  13.634
  340    HD2  TYR  44           HD2      TYR  44   5.455  -4.921  11.644
  341    HE1  TYR  44           HE1      TYR  44   5.623  -0.084  12.714
  342    HE2  TYR  44           HE2      TYR  44   7.278  -3.520  10.717
  343    HH   TYR  44           HH       TYR  44   8.421  -1.266  11.476
  344    H    ALA  45           HN       ALA  45   1.925  -6.654  11.751
  345    HA   ALA  45           HA       ALA  45  -0.043  -7.183  13.856
  346   1HB   ALA  45          HB1       ALA  45  -0.556  -8.079  11.019
  347   2HB   ALA  45          HB2       ALA  45  -1.201  -6.559  11.639
  348   3HB   ALA  45          HB3       ALA  45  -1.665  -8.086  12.391
  349    H    ALA  46           HN       ALA  46  -0.396  -9.620  14.016
  350    HA   ALA  46           HA       ALA  46   2.101 -10.885  14.213
  351   1HB   ALA  46          HB1       ALA  46  -0.656 -12.144  14.071
  352   2HB   ALA  46          HB2       ALA  46   0.185 -11.648  15.538
  353   3HB   ALA  46          HB3       ALA  46   0.811 -12.985  14.573
  354    H    ALA  47           HN       ALA  47  -0.061 -10.624  11.464
  355    HA   ALA  47           HA       ALA  47   1.931 -12.151   9.903
  356   1HB   ALA  47          HB1       ALA  47  -1.064 -12.580   9.800
  357   2HB   ALA  47          HB2       ALA  47   0.134 -13.721  10.415
  358   3HB   ALA  47          HB3       ALA  47   0.106 -13.311   8.700
  359    H    ASN  48           HN       ASN  48   2.064 -11.686   7.693
  360    HA   ASN  48           HA       ASN  48   1.453  -8.972   6.924
  361   1HB   ASN  48          HB2       ASN  48   3.419 -10.373   6.098
  362   2HB   ASN  48          HB1       ASN  48   2.256 -11.253   5.108
  363   1HD2  ASN  48          HD21      ASN  48   3.693 -10.242   3.305
  364   2HD2  ASN  48          HD22      ASN  48   3.261  -8.692   2.765
  365    H    ASN  49           HN       ASN  49  -0.432  -8.259   5.995
  366    HA   ASN  49           HA       ASN  49  -2.084 -10.095   4.439
  367   1HB   ASN  49          HB2       ASN  49  -2.715 -10.279   6.919
  368   2HB   ASN  49          HB1       ASN  49  -3.325  -8.635   6.766
  369   1HD2  ASN  49          HD21      ASN  49  -5.483  -9.765   7.255
  370   2HD2  ASN  49          HD22      ASN  49  -6.329 -10.443   5.949
  371    H    LEU  50           HN       LEU  50  -3.563  -9.035   3.076
  372    HA   LEU  50           HA       LEU  50  -3.442  -6.077   3.001
  373   1HB   LEU  50          HB2       LEU  50  -2.063  -7.037   1.180
  374   2HB   LEU  50          HB1       LEU  50  -3.426  -8.025   0.668
  375    HG   LEU  50           HG       LEU  50  -4.731  -5.950   0.205
  376   1HD1  LEU  50          HD11      LEU  50  -2.202  -4.647   1.173
  377   2HD1  LEU  50          HD12      LEU  50  -3.876  -4.299   1.609
  378   3HD1  LEU  50          HD13      LEU  50  -3.262  -3.821   0.031
  379   1HD2  LEU  50          HD21      LEU  50  -2.030  -5.958  -1.186
  380   2HD2  LEU  50          HD22      LEU  50  -3.543  -5.322  -1.831
  381   3HD2  LEU  50          HD23      LEU  50  -3.353  -7.057  -1.579
  382    H    SER  51           HN       SER  51  -5.516  -5.280   3.286
  383    HA   SER  51           HA       SER  51  -7.798  -7.000   2.457
  384   1HB   SER  51          HB2       SER  51  -7.610  -6.878   4.896
  385   2HB   SER  51          HB1       SER  51  -7.608  -5.118   4.818
  386    HG   SER  51           HG       SER  51  -9.692  -5.129   4.392
  387    H    VAL  52           HN       VAL  52  -9.195  -6.027   1.045
  388    HA   VAL  52           HA       VAL  52  -9.118  -3.085   0.791
  389    HB   VAL  52           HB       VAL  52  -9.519  -5.091  -1.449
  390   1HG1  VAL  52          HG11      VAL  52  -9.468  -2.055  -1.420
  391   2HG1  VAL  52          HG12      VAL  52 -10.862  -3.070  -1.781
  392   3HG1  VAL  52          HG13      VAL  52  -9.485  -3.043  -2.880
  393   1HG2  VAL  52          HG21      VAL  52  -7.242  -3.199  -0.777
  394   2HG2  VAL  52          HG22      VAL  52  -7.389  -4.075  -2.302
  395   3HG2  VAL  52          HG23      VAL  52  -7.174  -4.962  -0.792
  396    H    ILE  53           HN       ILE  53 -11.064  -2.158   1.213
  397    HA   ILE  53           HA       ILE  53 -13.505  -3.840   1.006
  398    HB   ILE  53           HB       ILE  53 -12.894  -1.607   2.962
  399   1HG1  ILE  53          HG12      ILE  53 -13.359  -4.539   3.565
  400   2HG1  ILE  53          HG11      ILE  53 -11.743  -3.875   3.310
  401   1HG2  ILE  53          HG21      ILE  53 -15.246  -1.609   2.437
  402   2HG2  ILE  53          HG22      ILE  53 -15.054  -2.404   3.999
  403   3HG2  ILE  53          HG23      ILE  53 -15.323  -3.369   2.547
  404   1HD1  ILE  53          HD11      ILE  53 -13.702  -2.747   5.323
  405   2HD1  ILE  53          HD12      ILE  53 -11.989  -2.362   5.164
  406   3HD1  ILE  53          HD13      ILE  53 -12.485  -3.957   5.730
  407    H    GLY  54           HN       GLY  54 -15.043  -3.105  -0.338
  408   1HA   GLY  54          HA2       GLY  54 -16.464  -1.461  -1.275
  409   2HA   GLY  54          HA1       GLY  54 -15.279  -0.225  -0.856
  410    H    ALA  55           HN       ALA  55 -13.902  -2.988  -2.352
  411    HA   ALA  55           HA       ALA  55 -13.807  -1.546  -4.950
  412   1HB   ALA  55          HB1       ALA  55 -11.687  -1.612  -3.423
  413   2HB   ALA  55          HB2       ALA  55 -11.521  -1.933  -5.149
  414   3HB   ALA  55          HB3       ALA  55 -11.538  -3.272  -4.003
  415    H    THR  56           HN       THR  56 -13.212  -2.841  -6.781
  416    HA   THR  56           HA       THR  56 -14.660  -5.415  -6.976
  417    HB   THR  56           HB       THR  56 -14.447  -4.998  -9.337
  418    HG1  THR  56           HG1      THR  56 -12.500  -4.011  -9.505
  419   1HG2  THR  56          HG21      THR  56 -15.338  -2.594  -7.731
  420   2HG2  THR  56          HG22      THR  56 -16.339  -3.932  -8.294
  421   3HG2  THR  56          HG23      THR  56 -15.660  -2.790  -9.453
  422    H    LYS  57           HN       LYS  57 -13.748  -7.138  -8.048
  423    HA   LYS  57           HA       LYS  57 -11.273  -7.981  -7.116
  424   1HB   LYS  57          HB2       LYS  57 -12.779  -8.932  -9.572
  425   2HB   LYS  57          HB1       LYS  57 -11.504  -9.822  -8.750
  426   1HG   LYS  57          HG2       LYS  57 -12.905  -9.943  -6.700
  427   2HG   LYS  57          HG1       LYS  57 -14.181  -9.044  -7.534
  428   1HD   LYS  57          HD2       LYS  57 -14.324 -10.824  -9.229
  429   2HD   LYS  57          HD1       LYS  57 -13.047 -11.717  -8.406
  430   1HE   LYS  57          HE2       LYS  57 -14.440 -11.954  -6.416
  431   2HE   LYS  57          HE1       LYS  57 -15.699 -10.957  -7.150
  432   1HZ   LYS  57          HZ1       LYS  57 -15.081 -13.730  -7.578
  433   2HZ   LYS  57          HZ2       LYS  57 -15.250 -12.855  -9.024
  434   3HZ   LYS  57          HZ3       LYS  57 -16.515 -12.881  -7.890
  435    H    GLU  58           HN       GLU  58 -12.015  -6.493 -10.323
  436    HA   GLU  58           HA       GLU  58  -9.402  -6.910 -11.376
  437   1HB   GLU  58          HB2       GLU  58 -11.496  -6.364 -12.688
  438   2HB   GLU  58          HB1       GLU  58 -11.365  -4.717 -12.076
  439   1HG   GLU  58          HG2       GLU  58 -10.297  -4.752 -14.228
  440   2HG   GLU  58          HG1       GLU  58  -9.018  -4.656 -13.020
  441    H    ASP  59           HN       ASP  59 -10.904  -4.327  -9.480
  442    HA   ASP  59           HA       ASP  59  -8.789  -2.464  -9.688
  443   1HB   ASP  59          HB2       ASP  59 -10.945  -2.901  -7.615
  444   2HB   ASP  59          HB1       ASP  59  -9.778  -1.584  -7.506
  445    H    LYS  60           HN       LYS  60  -9.594  -5.008  -7.393
  446    HA   LYS  60           HA       LYS  60  -7.397  -4.608  -5.643
  447   1HB   LYS  60          HB2       LYS  60  -9.391  -5.916  -4.983
  448   2HB   LYS  60          HB1       LYS  60  -8.984  -7.141  -6.182
  449   1HG   LYS  60          HG2       LYS  60  -6.857  -7.586  -5.009
  450   2HG   LYS  60          HG1       LYS  60  -7.261  -6.356  -3.810
  451   1HD   LYS  60          HD2       LYS  60  -9.190  -7.620  -3.076
  452   2HD   LYS  60          HD1       LYS  60  -8.986  -8.780  -4.388
  453   1HE   LYS  60          HE2       LYS  60  -6.820  -9.477  -3.452
  454   2HE   LYS  60          HE1       LYS  60  -6.993  -8.295  -2.154
  455   1HZ   LYS  60          HZ1       LYS  60  -8.033  -9.885  -1.034
  456   2HZ   LYS  60          HZ2       LYS  60  -8.136 -10.896  -2.395
  457   3HZ   LYS  60          HZ3       LYS  60  -9.329  -9.718  -2.116
  458    H    GLN  61           HN       GLN  61  -7.626  -6.601  -8.600
  459    HA   GLN  61           HA       GLN  61  -5.062  -7.801  -8.216
  460   1HB   GLN  61          HB2       GLN  61  -6.695  -7.224 -10.706
  461   2HB   GLN  61          HB1       GLN  61  -5.177  -8.121 -10.724
  462   1HG   GLN  61          HG2       GLN  61  -6.113  -9.792  -9.203
  463   2HG   GLN  61          HG1       GLN  61  -7.617  -8.881  -9.097
  464   1HE2  GLN  61          HE21      GLN  61  -7.579 -11.581 -10.053
  465   2HE2  GLN  61          HE22      GLN  61  -7.990 -11.563 -11.700
  466    H    ARG  62           HN       ARG  62  -6.173  -4.810  -9.847
  467    HA   ARG  62           HA       ARG  62  -3.657  -4.082 -10.853
  468   1HB   ARG  62          HB2       ARG  62  -5.744  -2.989 -11.596
  469   2HB   ARG  62          HB1       ARG  62  -5.952  -2.288  -9.994
  470   1HG   ARG  62          HG2       ARG  62  -3.866  -1.021 -10.250
  471   2HG   ARG  62          HG1       ARG  62  -3.592  -1.752 -11.830
  472   1HD   ARG  62          HD2       ARG  62  -5.695  -0.763 -12.653
  473   2HD   ARG  62          HD1       ARG  62  -5.968  -0.027 -11.076
  474    HE   ARG  62           HE       ARG  62  -4.431   1.614 -11.646
  475   1HH1  ARG  62          HH11      ARG  62  -4.639  -0.742 -14.124
  476   2HH1  ARG  62          HH12      ARG  62  -3.264  -0.161 -15.004
  477   1HH2  ARG  62          HH21      ARG  62  -2.402   2.205 -12.621
  478   2HH2  ARG  62          HH22      ARG  62  -1.996   1.504 -14.152
  479    H    ILE  63           HN       ILE  63  -5.222  -3.309  -7.767
  480    HA   ILE  63           HA       ILE  63  -3.124  -1.698  -6.790
  481    HB   ILE  63           HB       ILE  63  -5.164  -3.323  -5.302
  482   1HG1  ILE  63          HG12      ILE  63  -4.914  -0.326  -5.618
  483   2HG1  ILE  63          HG11      ILE  63  -5.868  -1.321  -6.716
  484   1HG2  ILE  63          HG21      ILE  63  -3.373  -3.087  -3.749
  485   2HG2  ILE  63          HG22      ILE  63  -4.479  -1.768  -3.368
  486   3HG2  ILE  63          HG23      ILE  63  -3.017  -1.452  -4.303
  487   1HD1  ILE  63          HD11      ILE  63  -7.168  -2.166  -4.755
  488   2HD1  ILE  63          HD12      ILE  63  -7.330  -0.424  -4.983
  489   3HD1  ILE  63          HD13      ILE  63  -6.269  -1.055  -3.723
  490    H    SER  64           HN       SER  64  -3.581  -5.198  -6.579
  491    HA   SER  64           HA       SER  64  -1.309  -5.710  -4.953
  492   1HB   SER  64          HB2       SER  64  -1.435  -7.982  -5.763
  493   2HB   SER  64          HB1       SER  64  -3.089  -7.398  -5.604
  494    HG   SER  64           HG       SER  64  -1.525  -7.465  -7.978
  495    H    GLU  65           HN       GLU  65  -1.688  -5.316  -8.532
  496    HA   GLU  65           HA       GLU  65   1.014  -5.883  -9.133
  497   1HB   GLU  65          HB2       GLU  65  -1.072  -4.264 -10.612
  498   2HB   GLU  65          HB1       GLU  65   0.538  -4.588 -11.258
  499   1HG   GLU  65          HG2       GLU  65   0.137  -7.008 -11.084
  500   2HG   GLU  65          HG1       GLU  65  -1.465  -6.703 -10.414
  501    H    ILE  66           HN       ILE  66  -0.655  -2.844  -8.376
  502    HA   ILE  66           HA       ILE  66   1.512  -1.115  -8.835
  503    HB   ILE  66           HB       ILE  66  -0.829  -0.895  -6.933
  504   1HG1  ILE  66          HG12      ILE  66  -0.258   0.470  -9.584
  505   2HG1  ILE  66          HG11      ILE  66  -1.230  -0.991  -9.430
  506   1HG2  ILE  66          HG21      ILE  66   1.354   1.071  -7.660
  507   2HG2  ILE  66          HG22      ILE  66   0.828   0.582  -6.049
  508   3HG2  ILE  66          HG23      ILE  66  -0.215   1.589  -7.048
  509   1HD1  ILE  66          HD11      ILE  66  -2.460   1.299  -9.458
  510   2HD1  ILE  66          HD12      ILE  66  -1.885   1.464  -7.801
  511   3HD1  ILE  66          HD13      ILE  66  -2.936   0.119  -8.240
  512    H    LEU  67           HN       LEU  67   0.485  -2.782  -5.885
  513    HA   LEU  67           HA       LEU  67   2.481  -1.742  -4.190
  514   1HB   LEU  67          HB2       LEU  67   0.610  -2.919  -3.200
  515   2HB   LEU  67          HB1       LEU  67   0.959  -4.366  -4.138
  516    HG   LEU  67           HG       LEU  67   3.169  -4.544  -2.906
  517   1HD1  LEU  67          HD11      LEU  67   3.622  -2.393  -2.042
  518   2HD1  LEU  67          HD12      LEU  67   3.075  -3.279  -0.623
  519   3HD1  LEU  67          HD13      LEU  67   1.972  -2.183  -1.453
  520   1HD2  LEU  67          HD21      LEU  67   0.706  -4.535  -1.138
  521   2HD2  LEU  67          HD22      LEU  67   2.164  -5.502  -0.916
  522   3HD2  LEU  67          HD23      LEU  67   1.101  -5.813  -2.288
  523    H    GLN  68           HN       GLN  68   2.435  -4.551  -6.330
  524    HA   GLN  68           HA       GLN  68   5.012  -5.511  -5.611
  525   1HB   GLN  68          HB2       GLN  68   3.393  -5.766  -8.153
  526   2HB   GLN  68          HB1       GLN  68   4.954  -6.556  -7.919
  527   1HG   GLN  68          HG2       GLN  68   4.111  -7.784  -6.011
  528   2HG   GLN  68          HG1       GLN  68   2.591  -6.895  -6.053
  529   1HE2  GLN  68          HE21      GLN  68   2.905  -9.825  -6.324
  530   2HE2  GLN  68          HE22      GLN  68   2.290 -10.229  -7.853
  531    H    GLU  69           HN       GLU  69   4.029  -3.295  -8.287
  532    HA   GLU  69           HA       GLU  69   6.622  -2.900  -9.239
  533   1HB   GLU  69          HB2       GLU  69   4.159  -1.159  -9.376
  534   2HB   GLU  69          HB1       GLU  69   5.645  -0.814 -10.263
  535   1HG   GLU  69          HG2       GLU  69   5.509  -3.023 -11.353
  536   2HG   GLU  69          HG1       GLU  69   4.024  -3.369 -10.469
  537    H    THR  70           HN       THR  70   4.831  -0.925  -6.839
  538    HA   THR  70           HA       THR  70   6.782   1.080  -6.542
  539    HB   THR  70           HB       THR  70   4.891  -0.002  -4.485
  540    HG1  THR  70           HG1      THR  70   4.057   2.266  -5.319
  541   1HG2  THR  70          HG21      THR  70   6.568   2.500  -4.601
  542   2HG2  THR  70          HG22      THR  70   6.559   1.263  -3.343
  543   3HG2  THR  70          HG23      THR  70   5.175   2.340  -3.532
  544    H    TRP  71           HN       TRP  71   6.233  -1.887  -4.823
  545    HA   TRP  71           HA       TRP  71   8.306  -1.769  -3.007
  546   1HB   TRP  71          HB2       TRP  71   6.327  -3.245  -2.969
  547   2HB   TRP  71          HB1       TRP  71   7.025  -4.158  -4.293
  548    HD1  TRP  71           HD1      TRP  71   7.733  -6.372  -3.330
  549    HE1  TRP  71           HE1      TRP  71   9.080  -7.184  -1.299
  550    HE3  TRP  71           HE3      TRP  71   8.432  -1.926  -0.830
  551    HZ2  TRP  71           HZ2      TRP  71  10.271  -6.132   1.058
  552    HZ3  TRP  71           HZ3      TRP  71   9.666  -1.893   1.302
  553    HH2  TRP  71           HH2      TRP  71  10.580  -3.985   2.257
  554    H    GLU  72           HN       GLU  72   8.263  -3.023  -6.290
  555    HA   GLU  72           HA       GLU  72  10.959  -3.958  -6.191
  556   1HB   GLU  72          HB2       GLU  72   9.049  -3.521  -8.488
  557   2HB   GLU  72          HB1       GLU  72  10.701  -4.086  -8.731
  558   1HG   GLU  72          HG2       GLU  72  10.301  -6.031  -7.339
  559   2HG   GLU  72          HG1       GLU  72   8.698  -5.440  -6.904
  560    H    SER  73           HN       SER  73   9.634  -0.781  -6.648
  561    HA   SER  73           HA       SER  73  12.170   0.103  -7.901
  562   1HB   SER  73          HB2       SER  73  10.391   0.848  -9.243
  563   2HB   SER  73          HB1       SER  73   9.388   1.253  -7.855
  564    HG   SER  73           HG       SER  73  10.187   3.170  -8.473
  565    H    ALA  74           HN       ALA  74  11.560  -0.476  -4.967
  566    HA   ALA  74           HA       ALA  74  11.347   1.704  -3.376
  567   1HB   ALA  74          HB1       ALA  74  13.030  -0.755  -3.009
  568   2HB   ALA  74          HB2       ALA  74  11.341  -0.533  -2.550
  569   3HB   ALA  74          HB3       ALA  74  12.607   0.379  -1.726
  570    H    ASP  75           HN       ASP  75  14.374   0.617  -4.908
  571    HA   ASP  75           HA       ASP  75  16.127   2.227  -3.385
  572   1HB   ASP  75          HB2       ASP  75  16.355   1.052  -6.155
  573   2HB   ASP  75          HB1       ASP  75  17.676   1.899  -5.350
  574    H    ASP  76           HN       ASP  76  13.992   3.064  -5.992
  575    HA   ASP  76           HA       ASP  76  15.439   5.551  -6.615
  576   1HB   ASP  76          HB2       ASP  76  12.939   4.276  -7.726
  577   2HB   ASP  76          HB1       ASP  76  13.495   5.882  -8.197
  578    H    TRP  77           HN       TRP  77  12.314   4.608  -5.153
  579    HA   TRP  77           HA       TRP  77  11.892   7.456  -4.460
  580   1HB   TRP  77          HB2       TRP  77   9.644   7.018  -4.132
  581   2HB   TRP  77          HB1       TRP  77  10.093   6.120  -5.562
  582    HD1  TRP  77           HD1      TRP  77   9.842   3.501  -5.502
  583    HE1  TRP  77           HE1      TRP  77   8.825   1.877  -3.806
  584    HE3  TRP  77           HE3      TRP  77   9.488   6.559  -1.322
  585    HZ2  TRP  77           HZ2      TRP  77   7.965   1.828  -1.111
  586    HZ3  TRP  77           HZ3      TRP  77   8.544   5.641   0.750
  587    HH2  TRP  77           HH2      TRP  77   7.780   3.302   0.863
  588    H    PHE  78           HN       PHE  78  12.912   4.562  -2.799
  589    HA   PHE  78           HA       PHE  78  12.083   5.731  -0.225
  590   1HB   PHE  78          HB2       PHE  78  12.002   3.277  -0.366
  591   2HB   PHE  78          HB1       PHE  78  13.724   3.241  -0.744
  592    HD1  PHE  78           HD1      PHE  78  11.436   4.835   1.814
  593    HD2  PHE  78           HD2      PHE  78  15.216   2.883   1.065
  594    HE1  PHE  78           HE1      PHE  78  12.016   4.993   4.211
  595    HE2  PHE  78           HE2      PHE  78  15.761   3.041   3.469
  596    HZ   PHE  78           HZ       PHE  78  14.167   4.097   5.041
  597    H    VAL  79           HN       VAL  79  13.262   6.963   0.945
  598    HA   VAL  79           HA       VAL  79  16.130   7.331   0.313
  599    HB   VAL  79           HB       VAL  79  15.136   9.314  -0.454
  600   1HG1  VAL  79          HG11      VAL  79  12.841   8.855   0.163
  601   2HG1  VAL  79          HG12      VAL  79  13.269  10.445   0.800
  602   3HG1  VAL  79          HG13      VAL  79  13.215   9.052   1.879
  603   1HG2  VAL  79          HG21      VAL  79  16.826   9.666   1.465
  604   2HG2  VAL  79          HG22      VAL  79  15.425  10.050   2.466
  605   3HG2  VAL  79          HG23      VAL  79  15.793  11.032   1.048
  606    H    SER  80           HN       SER  80  17.511   7.787   2.212
  607    HA   SER  80           HA       SER  80  16.203   7.413   4.832
  608   1HB   SER  80          HB2       SER  80  17.082   5.188   3.957
  609   2HB   SER  80          HB1       SER  80  18.698   5.888   4.035
  610    HG   SER  80           HG       SER  80  18.102   6.412   6.288
  611    H    GLU  81           HN       GLU  81  17.118   8.543   6.453
  612    HA   GLU  81           HA       GLU  81  19.730   9.852   6.027
  613   1HB   GLU  81          HB2       GLU  81  17.984  11.457   5.300
  614   2HB   GLU  81          HB1       GLU  81  17.223  11.323   6.885
  615   1HG   GLU  81          HG2       GLU  81  19.268  12.167   7.960
  616   2HG   GLU  81          HG1       GLU  81  20.064  12.264   6.390
  Start of MODEL   10
    1   1H    MET   1          HT1       MET   1 -13.743   4.631   0.144
    2   2H    MET   1          HT2       MET   1 -14.915   3.931  -0.867
    3   3H    MET   1          HT3       MET   1 -13.547   4.682  -1.540
    4    HA   MET   1           HA       MET   1 -13.851   2.019  -0.456
    5   1HB   MET   1          HB2       MET   1 -13.312   2.597  -2.828
    6   2HB   MET   1          HB1       MET   1 -11.792   3.297  -2.275
    7   1HG   MET   1          HG2       MET   1 -11.090   1.134  -1.367
    8   2HG   MET   1          HG1       MET   1 -12.637   0.422  -1.818
    9   1HE   MET   1          HE1       MET   1  -9.376   1.916  -2.739
   10   2HE   MET   1          HE2       MET   1 -10.182   2.946  -3.919
   11   3HE   MET   1          HE3       MET   1  -9.130   1.645  -4.469
   12    H    ARG   2           HN       ARG   2 -12.334   1.002   0.914
   13    HA   ARG   2           HA       ARG   2 -10.261   2.763   2.101
   14   1HB   ARG   2          HB2       ARG   2 -10.672   1.718   4.271
   15   2HB   ARG   2          HB1       ARG   2 -12.133   2.492   3.661
   16   1HG   ARG   2          HG2       ARG   2 -12.842   0.243   2.755
   17   2HG   ARG   2          HG1       ARG   2 -11.472  -0.460   3.615
   18   1HD   ARG   2          HD2       ARG   2 -13.680   1.165   4.907
   19   2HD   ARG   2          HD1       ARG   2 -13.574  -0.592   4.938
   20    HE   ARG   2           HE       ARG   2 -11.180   0.141   5.964
   21   1HH1  ARG   2          HH21      ARG   2 -12.533   2.757   6.737
   22   2HH1  ARG   2          HH22      ARG   2 -13.082   2.406   8.342
   23   1HH2  ARG   2          HH11      ARG   2 -12.711  -1.024   8.007
   24   2HH2  ARG   2          HH12      ARG   2 -13.180   0.266   9.062
   25    H    ILE   3           HN       ILE   3  -8.289   1.931   2.241
   26    HA   ILE   3           HA       ILE   3  -7.865  -0.941   1.545
   27    HB   ILE   3           HB       ILE   3  -6.099   1.461   1.020
   28   1HG1  ILE   3          HG12      ILE   3  -7.517  -0.318  -0.975
   29   2HG1  ILE   3          HG11      ILE   3  -8.228   1.179  -0.372
   30   1HG2  ILE   3          HG21      ILE   3  -4.869  -0.287  -0.385
   31   2HG2  ILE   3          HG22      ILE   3  -5.789  -1.500   0.506
   32   3HG2  ILE   3          HG23      ILE   3  -4.688  -0.423   1.364
   33   1HD1  ILE   3          HD11      ILE   3  -6.831   1.259  -2.577
   34   2HD1  ILE   3          HD12      ILE   3  -5.434   1.180  -1.505
   35   3HD1  ILE   3          HD13      ILE   3  -6.576   2.517  -1.368
   36    H    GLU   4           HN       GLU   4  -6.956  -2.090   3.169
   37    HA   GLU   4           HA       GLU   4  -5.265  -0.665   5.161
   38   1HB   GLU   4          HB2       GLU   4  -7.128  -3.007   5.678
   39   2HB   GLU   4          HB1       GLU   4  -6.055  -2.269   6.868
   40   1HG   GLU   4          HG2       GLU   4  -7.216  -0.111   6.581
   41   2HG   GLU   4          HG1       GLU   4  -8.292  -0.846   5.393
   42    H    VAL   5           HN       VAL   5  -3.280  -1.359   5.366
   43    HA   VAL   5           HA       VAL   5  -2.564  -4.047   4.298
   44    HB   VAL   5           HB       VAL   5  -0.857  -1.555   4.332
   45   1HG1  VAL   5          HG11      VAL   5  -0.431  -4.309   3.139
   46   2HG1  VAL   5          HG12      VAL   5   0.457  -3.609   4.492
   47   3HG1  VAL   5          HG13      VAL   5   0.631  -2.927   2.876
   48   1HG2  VAL   5          HG21      VAL   5  -2.959  -1.889   2.642
   49   2HG2  VAL   5          HG22      VAL   5  -1.745  -2.811   1.763
   50   3HG2  VAL   5          HG23      VAL   5  -1.457  -1.118   2.140
   51    H    THR   6           HN       THR   6  -1.486  -5.397   5.599
   52    HA   THR   6           HA       THR   6  -0.392  -4.344   8.156
   53    HB   THR   6           HB       THR   6  -0.923  -6.645   9.059
   54    HG1  THR   6           HG1      THR   6  -2.766  -6.810   6.957
   55   1HG2  THR   6          HG21      THR   6  -2.301  -4.649   9.555
   56   2HG2  THR   6          HG22      THR   6  -3.287  -6.108   9.453
   57   3HG2  THR   6          HG23      THR   6  -3.261  -4.966   8.110
   58    H    ILE   7           HN       ILE   7   1.599  -4.866   8.636
   59    HA   ILE   7           HA       ILE   7   3.080  -6.732   6.869
   60    HB   ILE   7           HB       ILE   7   3.816  -4.151   8.232
   61   1HG1  ILE   7          HG12      ILE   7   4.246  -5.136   5.391
   62   2HG1  ILE   7          HG11      ILE   7   2.851  -4.191   5.903
   63   1HG2  ILE   7          HG21      ILE   7   5.615  -6.394   7.258
   64   2HG2  ILE   7          HG22      ILE   7   5.683  -5.533   8.794
   65   3HG2  ILE   7          HG23      ILE   7   6.186  -4.725   7.311
   66   1HD1  ILE   7          HD11      ILE   7   5.650  -3.198   6.434
   67   2HD1  ILE   7          HD12      ILE   7   4.150  -2.277   6.336
   68   3HD1  ILE   7          HD13      ILE   7   4.880  -2.930   4.871
   69    H    ALA   8           HN       ALA   8   4.079  -8.430   7.835
   70    HA   ALA   8           HA       ALA   8   3.547  -9.074  10.530
   71   1HB   ALA   8          HB1       ALA   8   5.284 -10.876  10.120
   72   2HB   ALA   8          HB2       ALA   8   5.507 -10.177   8.515
   73   3HB   ALA   8          HB3       ALA   8   3.942 -10.846   8.976
   74    H    LYS   9           HN       LYS   9   4.533  -8.658  12.258
   75    HA   LYS   9           HA       LYS   9   6.496  -6.695  12.521
   76   1HB   LYS   9          HB2       LYS   9   4.882  -7.219  14.320
   77   2HB   LYS   9          HB1       LYS   9   5.624  -8.797  14.535
   78   1HG   LYS   9          HG2       LYS   9   7.739  -7.718  15.236
   79   2HG   LYS   9          HG1       LYS   9   7.002  -6.126  15.028
   80   1HD   LYS   9          HD2       LYS   9   5.385  -6.563  16.755
   81   2HD   LYS   9          HD1       LYS   9   5.877  -8.254  16.862
   82   1HE   LYS   9          HE2       LYS   9   6.892  -7.029  18.703
   83   2HE   LYS   9          HE1       LYS   9   8.157  -7.493  17.565
   84   1HZ   LYS   9          HZ1       LYS   9   6.820  -4.844  17.692
   85   2HZ   LYS   9          HZ2       LYS   9   8.025  -5.289  16.580
   86   3HZ   LYS   9          HZ3       LYS   9   8.388  -5.190  18.236
   87    H    THR  10           HN       THR  10   6.856 -10.095  12.014
   88    HA   THR  10           HA       THR  10   9.470 -10.462  13.033
   89    HB   THR  10           HB       THR  10   9.524 -12.338  11.325
   90    HG1  THR  10           HG1      THR  10   8.087 -11.265   9.863
   91   1HG2  THR  10          HG21      THR  10   8.033 -13.701  12.568
   92   2HG2  THR  10          HG22      THR  10   6.967 -12.346  12.932
   93   3HG2  THR  10          HG23      THR  10   8.545 -12.459  13.708
   94    H    SER  11           HN       SER  11   8.314  -8.535  10.493
   95    HA   SER  11           HA       SER  11  11.018  -8.390   9.252
   96   1HB   SER  11          HB2       SER  11   8.283  -8.077   8.006
   97   2HB   SER  11          HB1       SER  11   9.777  -7.601   7.206
   98    HG   SER  11           HG       SER  11   8.725  -9.943   7.155
   99    HA   PRO  12           HA       PRO  12   9.977  -4.192  10.983
  100   1HB   PRO  12          HB2       PRO  12  12.657  -4.047  12.066
  101   2HB   PRO  12          HB1       PRO  12  11.137  -4.181  12.969
  102   1HG   PRO  12          HG2       PRO  12  13.078  -6.149  12.849
  103   2HG   PRO  12          HG1       PRO  12  11.379  -6.426  13.265
  104   1HD   PRO  12          HD2       PRO  12  12.787  -6.921  10.662
  105   2HD   PRO  12          HD1       PRO  12  11.481  -7.841  11.436
  106    H    LEU  13           HN       LEU  13  10.102  -2.408   9.987
  107    HA   LEU  13           HA       LEU  13  12.222  -2.092   7.945
  108   1HB   LEU  13          HB2       LEU  13   9.609  -0.581   8.092
  109   2HB   LEU  13          HB1       LEU  13  10.688  -0.765   6.709
  110    HG   LEU  13           HG       LEU  13   9.069  -2.976   8.010
  111   1HD1  LEU  13          HD11      LEU  13   8.847  -1.655   5.283
  112   2HD1  LEU  13          HD12      LEU  13   7.704  -1.477   6.614
  113   3HD1  LEU  13          HD13      LEU  13   7.903  -3.040   5.824
  114   1HD2  LEU  13          HD21      LEU  13   9.919  -4.248   5.929
  115   2HD2  LEU  13          HD22      LEU  13  11.073  -3.999   7.236
  116   3HD2  LEU  13          HD23      LEU  13  11.136  -2.980   5.800
  117    HA   PRO  14           HA       PRO  14  14.088   1.076  10.319
  118   1HB   PRO  14          HB2       PRO  14  14.259   3.097   8.233
  119   2HB   PRO  14          HB1       PRO  14  15.547   2.047   8.846
  120   1HG   PRO  14          HG2       PRO  14  13.991   1.802   6.392
  121   2HG   PRO  14          HG1       PRO  14  15.469   0.954   6.867
  122   1HD   PRO  14          HD2       PRO  14  12.937  -0.217   6.703
  123   2HD   PRO  14          HD1       PRO  14  14.304  -0.885   7.612
  124    H    ALA  15           HN       ALA  15  13.718   2.931  11.412
  125    HA   ALA  15           HA       ALA  15  11.108   3.599  12.082
  126   1HB   ALA  15          HB1       ALA  15  13.244   3.947  13.397
  127   2HB   ALA  15          HB2       ALA  15  12.051   5.243  13.498
  128   3HB   ALA  15          HB3       ALA  15  13.468   5.426  12.464
  129    H    GLY  16           HN       GLY  16  10.879   3.930   9.371
  130   1HA   GLY  16          HA2       GLY  16   9.824   6.565   9.119
  131   2HA   GLY  16          HA1       GLY  16  11.358   6.476   8.299
  132    H    ALA  17           HN       ALA  17  10.705   3.506   7.936
  133    HA   ALA  17           HA       ALA  17   9.818   3.731   5.230
  134   1HB   ALA  17          HB1       ALA  17  10.647   1.528   7.058
  135   2HB   ALA  17          HB2       ALA  17  11.290   1.964   5.476
  136   3HB   ALA  17          HB3       ALA  17   9.755   1.100   5.595
  137    H    ILE  18           HN       ILE  18   8.011   2.619   8.079
  138    HA   ILE  18           HA       ILE  18   5.843   1.699   6.558
  139    HB   ILE  18           HB       ILE  18   5.936   2.857   9.348
  140   1HG1  ILE  18          HG12      ILE  18   7.163   0.640   8.617
  141   2HG1  ILE  18          HG11      ILE  18   6.220   0.662  10.096
  142   1HG2  ILE  18          HG21      ILE  18   3.717   1.463   9.506
  143   2HG2  ILE  18          HG22      ILE  18   3.663   1.681   7.758
  144   3HG2  ILE  18          HG23      ILE  18   3.666   3.087   8.822
  145   1HD1  ILE  18          HD11      ILE  18   4.529  -0.647   9.210
  146   2HD1  ILE  18          HD12      ILE  18   5.913  -1.284   8.326
  147   3HD1  ILE  18          HD13      ILE  18   4.837  -0.122   7.556
  148    H    ASP  19           HN       ASP  19   6.418   4.858   8.083
  149    HA   ASP  19           HA       ASP  19   4.054   6.089   7.105
  150   1HB   ASP  19          HB2       ASP  19   6.715   7.268   7.970
  151   2HB   ASP  19          HB1       ASP  19   5.318   8.249   7.533
  152    H    ALA  20           HN       ALA  20   7.283   5.774   5.686
  153    HA   ALA  20           HA       ALA  20   6.683   7.490   3.528
  154   1HB   ALA  20          HB1       ALA  20   8.751   6.890   2.640
  155   2HB   ALA  20          HB2       ALA  20   8.636   5.229   3.221
  156   3HB   ALA  20          HB3       ALA  20   8.987   6.534   4.349
  157    H    LEU  21           HN       LEU  21   6.349   3.998   3.946
  158    HA   LEU  21           HA       LEU  21   5.612   3.317   1.347
  159   1HB   LEU  21          HB2       LEU  21   6.297   1.632   2.888
  160   2HB   LEU  21          HB1       LEU  21   5.072   2.105   4.058
  161    HG   LEU  21           HG       LEU  21   3.318   1.347   2.520
  162   1HD1  LEU  21          HD11      LEU  21   4.067  -0.079   0.552
  163   2HD1  LEU  21          HD12      LEU  21   5.678   0.596   0.781
  164   3HD1  LEU  21          HD13      LEU  21   4.333   1.651   0.353
  165   1HD2  LEU  21          HD21      LEU  21   3.667  -1.011   2.841
  166   2HD2  LEU  21          HD22      LEU  21   4.428  -0.180   4.198
  167   3HD2  LEU  21          HD23      LEU  21   5.417  -0.798   2.874
  168    H    ALA  22           HN       ALA  22   3.613   4.147   4.160
  169    HA   ALA  22           HA       ALA  22   1.075   3.880   2.907
  170   1HB   ALA  22          HB1       ALA  22   0.217   5.163   4.769
  171   2HB   ALA  22          HB2       ALA  22   1.826   5.782   5.141
  172   3HB   ALA  22          HB3       ALA  22   1.458   4.076   5.393
  173    H    GLY  23           HN       GLY  23   3.306   6.630   3.082
  174   1HA   GLY  23          HA2       GLY  23   1.510   8.462   1.813
  175   2HA   GLY  23          HA1       GLY  23   3.273   8.610   1.998
  176    H    GLU  24           HN       GLU  24   4.120   6.368   0.496
  177    HA   GLU  24           HA       GLU  24   3.787   7.379  -2.116
  178   1HB   GLU  24          HB2       GLU  24   5.437   5.409  -0.830
  179   2HB   GLU  24          HB1       GLU  24   4.664   4.600  -2.191
  180   1HG   GLU  24          HG2       GLU  24   6.135   7.244  -2.399
  181   2HG   GLU  24          HG1       GLU  24   6.836   5.679  -2.781
  182    H    LEU  25           HN       LEU  25   2.290   4.628  -0.472
  183    HA   LEU  25           HA       LEU  25   0.919   3.635  -2.714
  184   1HB   LEU  25          HB2       LEU  25   0.297   3.450   0.229
  185   2HB   LEU  25          HB1       LEU  25  -0.642   2.612  -1.002
  186    HG   LEU  25           HG       LEU  25   2.360   2.301  -0.695
  187   1HD1  LEU  25          HD11      LEU  25   1.323   1.496   1.337
  188   2HD1  LEU  25          HD12      LEU  25   1.742   0.091   0.360
  189   3HD1  LEU  25          HD13      LEU  25   0.073   0.656   0.424
  190   1HD2  LEU  25          HD21      LEU  25   0.223   0.918  -2.334
  191   2HD2  LEU  25          HD22      LEU  25   1.709   0.073  -1.909
  192   3HD2  LEU  25          HD23      LEU  25   1.784   1.540  -2.869
  193    H    SER  26           HN       SER  26  -0.084   6.047  -0.323
  194    HA   SER  26           HA       SER  26  -2.752   6.302  -1.187
  195   1HB   SER  26          HB2       SER  26  -2.792   8.357   0.050
  196   2HB   SER  26          HB1       SER  26  -1.771   7.226   0.932
  197    HG   SER  26           HG       SER  26  -0.391   8.816   0.807
  198    H    ARG  27           HN       ARG  27   0.171   8.120  -2.222
  199    HA   ARG  27           HA       ARG  27  -1.210   9.855  -3.990
  200   1HB   ARG  27          HB2       ARG  27   1.141  10.244  -3.322
  201   2HB   ARG  27          HB1       ARG  27   1.625   8.802  -4.220
  202   1HG   ARG  27          HG2       ARG  27   0.933   9.765  -6.307
  203   2HG   ARG  27          HG1       ARG  27   0.145  11.116  -5.494
  204   1HD   ARG  27          HD2       ARG  27   2.296  11.948  -4.709
  205   2HD   ARG  27          HD1       ARG  27   3.121  10.547  -5.386
  206    HE   ARG  27           HE       ARG  27   2.938  11.514  -7.505
  207   1HH1  ARG  27          HH21      ARG  27   2.574  13.961  -5.387
  208   2HH1  ARG  27          HH22      ARG  27   1.511  14.944  -6.337
  209   1HH2  ARG  27          HH11      ARG  27   0.856  12.462  -8.665
  210   2HH2  ARG  27          HH12      ARG  27   0.540  14.097  -8.188
  211    H    ARG  28           HN       ARG  28   0.135   6.622  -4.445
  212    HA   ARG  28           HA       ARG  28  -0.323   6.395  -7.222
  213   1HB   ARG  28          HB2       ARG  28  -0.215   4.347  -5.007
  214   2HB   ARG  28          HB1       ARG  28  -0.337   3.929  -6.709
  215   1HG   ARG  28          HG2       ARG  28   1.852   5.757  -5.738
  216   2HG   ARG  28          HG1       ARG  28   2.028   4.010  -5.612
  217   1HD   ARG  28          HD2       ARG  28   1.517   3.882  -8.095
  218   2HD   ARG  28          HD1       ARG  28   1.629   5.639  -8.140
  219    HE   ARG  28           HE       ARG  28   3.837   3.760  -7.764
  220   1HH1  ARG  28          HH11      ARG  28   3.701   6.353  -5.947
  221   2HH1  ARG  28          HH12      ARG  28   4.821   7.357  -6.806
  222   1HH2  ARG  28          HH21      ARG  28   4.868   5.345  -9.628
  223   2HH2  ARG  28          HH22      ARG  28   5.482   6.787  -8.891
  224    H    ILE  29           HN       ILE  29  -2.362   5.621  -4.425
  225    HA   ILE  29           HA       ILE  29  -4.482   4.415  -5.862
  226    HB   ILE  29           HB       ILE  29  -4.404   5.722  -3.142
  227   1HG1  ILE  29          HG12      ILE  29  -3.102   3.640  -3.353
  228   2HG1  ILE  29          HG11      ILE  29  -4.508   3.384  -2.338
  229   1HG2  ILE  29          HG21      ILE  29  -6.691   5.892  -3.801
  230   2HG2  ILE  29          HG22      ILE  29  -6.589   4.445  -2.797
  231   3HG2  ILE  29          HG23      ILE  29  -6.666   4.295  -4.553
  232   1HD1  ILE  29          HD11      ILE  29  -3.904   2.315  -5.064
  233   2HD1  ILE  29          HD12      ILE  29  -5.593   2.632  -4.674
  234   3HD1  ILE  29          HD13      ILE  29  -4.654   1.517  -3.688
  235    H    GLN  30           HN       GLN  30  -4.045   7.742  -4.746
  236    HA   GLN  30           HA       GLN  30  -6.578   8.722  -5.665
  237   1HB   GLN  30          HB2       GLN  30  -3.944  10.120  -5.142
  238   2HB   GLN  30          HB1       GLN  30  -5.389  10.975  -5.667
  239   1HG   GLN  30          HG2       GLN  30  -6.592  10.261  -3.664
  240   2HG   GLN  30          HG1       GLN  30  -5.227   9.273  -3.151
  241   1HE2  GLN  30          HE21      GLN  30  -6.312  11.482  -1.590
  242   2HE2  GLN  30          HE22      GLN  30  -5.095  12.660  -1.480
  243    H    TYR  31           HN       TYR  31  -3.432   8.474  -7.353
  244    HA   TYR  31           HA       TYR  31  -4.377   9.843  -9.645
  245   1HB   TYR  31          HB2       TYR  31  -1.979   9.554  -9.301
  246   2HB   TYR  31          HB1       TYR  31  -2.155   7.800  -9.359
  247    HD1  TYR  31           HD1      TYR  31  -2.660   6.646 -11.461
  248    HD2  TYR  31           HD2      TYR  31  -2.146  10.909 -11.331
  249    HE1  TYR  31           HE1      TYR  31  -2.453   6.696 -13.931
  250    HE2  TYR  31           HE2      TYR  31  -1.938  10.957 -13.803
  251    HH   TYR  31           HH       TYR  31  -2.635   8.170 -15.760
  252    H    ALA  32           HN       ALA  32  -4.397   6.436  -8.692
  253    HA   ALA  32           HA       ALA  32  -5.361   5.465 -11.179
  254   1HB   ALA  32          HB1       ALA  32  -5.449   4.288  -8.398
  255   2HB   ALA  32          HB2       ALA  32  -4.257   3.963  -9.656
  256   3HB   ALA  32          HB3       ALA  32  -5.922   3.415  -9.855
  257    H    PHE  33           HN       PHE  33  -6.903   6.495  -8.184
  258    HA   PHE  33           HA       PHE  33  -9.584   6.226  -9.444
  259   1HB   PHE  33          HB2       PHE  33  -8.784   6.051  -6.538
  260   2HB   PHE  33          HB1       PHE  33 -10.444   6.051  -7.133
  261    HD1  PHE  33           HD1      PHE  33  -7.300   4.151  -6.941
  262    HD2  PHE  33           HD2      PHE  33 -11.343   4.157  -8.392
  263    HE1  PHE  33           HE1      PHE  33  -7.143   1.719  -7.392
  264    HE2  PHE  33           HE2      PHE  33 -11.185   1.725  -8.842
  265    HZ   PHE  33           HZ       PHE  33  -9.083   0.508  -8.346
  266    HA   PRO  34           HA       PRO  34  -8.923  10.727  -8.690
  267   1HB   PRO  34          HB2       PRO  34 -10.503  11.288 -11.048
  268   2HB   PRO  34          HB1       PRO  34  -8.772  11.553 -10.791
  269   1HG   PRO  34          HG2       PRO  34  -9.888   9.664 -12.506
  270   2HG   PRO  34          HG1       PRO  34  -8.215   9.678 -11.926
  271   1HD   PRO  34          HD2       PRO  34 -10.494   7.971 -11.047
  272   2HD   PRO  34          HD1       PRO  34  -8.749   7.644 -11.013
  273    H    ASP  35           HN       ASP  35 -11.741   8.827  -9.389
  274    HA   ASP  35           HA       ASP  35 -13.643  10.851  -8.494
  275   1HB   ASP  35          HB2       ASP  35 -13.980   8.105  -9.683
  276   2HB   ASP  35          HB1       ASP  35 -15.322   9.137  -9.196
  277    H    ASN  36           HN       ASN  36 -11.970   8.229  -6.920
  278    HA   ASN  36           HA       ASN  36 -14.183   8.052  -4.932
  279   1HB   ASN  36          HB2       ASN  36 -12.197   5.902  -5.628
  280   2HB   ASN  36          HB1       ASN  36 -13.569   5.765  -4.535
  281   1HD2  ASN  36          HD21      ASN  36 -15.744   6.605  -5.753
  282   2HD2  ASN  36          HD22      ASN  36 -15.961   5.931  -7.295
  283    H    GLU  37           HN       GLU  37 -13.568   8.627  -2.744
  284    HA   GLU  37           HA       GLU  37 -11.009   9.517  -2.084
  285   1HB   GLU  37          HB2       GLU  37 -13.128  10.058  -0.956
  286   2HB   GLU  37          HB1       GLU  37 -13.180   8.414  -0.321
  287   1HG   GLU  37          HG2       GLU  37 -12.209   9.845   1.374
  288   2HG   GLU  37          HG1       GLU  37 -10.928   8.821   0.736
  289    H    GLY  38           HN       GLY  38  -9.221   8.259  -1.732
  290   1HA   GLY  38          HA2       GLY  38  -9.563   5.378  -0.994
  291   2HA   GLY  38          HA1       GLY  38  -8.222   5.900  -1.770
  292    H    HIS  39           HN       HIS  39  -9.016   4.899   1.252
  293    HA   HIS  39           HA       HIS  39  -7.102   6.758   2.516
  294   1HB   HIS  39          HB2       HIS  39  -9.317   6.810   3.578
  295   2HB   HIS  39          HB1       HIS  39  -9.274   5.058   3.786
  296    HD1  HIS  39           HD1      HIS  39  -6.937   7.965   4.661
  297    HD2  HIS  39           HD2      HIS  39  -8.382   4.415   6.302
  298    HE1  HIS  39           HE1      HIS  39  -5.895   7.762   6.961
  299    H    VAL  40           HN       VAL  40  -5.140   5.779   2.942
  300    HA   VAL  40           HA       VAL  40  -5.030   2.839   2.958
  301    HB   VAL  40           HB       VAL  40  -2.920   4.885   2.251
  302   1HG1  VAL  40          HG11      VAL  40  -1.764   2.780   1.390
  303   2HG1  VAL  40          HG12      VAL  40  -2.936   1.864   2.335
  304   3HG1  VAL  40          HG13      VAL  40  -1.819   2.966   3.143
  305   1HG2  VAL  40          HG21      VAL  40  -3.310   4.271  -0.023
  306   2HG2  VAL  40          HG22      VAL  40  -4.920   4.516   0.660
  307   3HG2  VAL  40          HG23      VAL  40  -4.291   2.882   0.440
  308    H    SER  41           HN       SER  41  -4.351   1.856   4.733
  309    HA   SER  41           HA       SER  41  -2.856   3.401   6.775
  310   1HB   SER  41          HB2       SER  41  -5.143   3.110   7.602
  311   2HB   SER  41          HB1       SER  41  -5.057   1.377   7.299
  312    HG   SER  41           HG       SER  41  -4.604   1.950   9.491
  313    H    VAL  42           HN       VAL  42  -1.173   2.424   7.760
  314    HA   VAL  42           HA       VAL  42  -0.624  -0.392   7.051
  315    HB   VAL  42           HB       VAL  42   1.433   1.844   7.054
  316   1HG1  VAL  42          HG11      VAL  42   1.632  -1.100   6.349
  317   2HG1  VAL  42          HG12      VAL  42   2.355  -0.313   7.753
  318   3HG1  VAL  42          HG13      VAL  42   2.923   0.082   6.130
  319   1HG2  VAL  42          HG21      VAL  42   0.536   0.241   4.656
  320   2HG2  VAL  42          HG22      VAL  42   1.454   1.742   4.685
  321   3HG2  VAL  42          HG23      VAL  42  -0.259   1.749   5.101
  322    H    ARG  43           HN       ARG  43  -0.183  -1.622   8.739
  323    HA   ARG  43           HA       ARG  43   1.028  -0.446  11.125
  324   1HB   ARG  43          HB2       ARG  43  -1.298  -0.097  11.606
  325   2HB   ARG  43          HB1       ARG  43  -1.712  -1.735  11.103
  326   1HG   ARG  43          HG2       ARG  43  -0.549  -2.687  12.988
  327   2HG   ARG  43          HG1       ARG  43   0.142  -1.123  13.421
  328   1HD   ARG  43          HD2       ARG  43  -2.836  -1.650  13.350
  329   2HD   ARG  43          HD1       ARG  43  -1.864  -1.851  14.803
  330    HE   ARG  43           HE       ARG  43  -1.333   0.710  13.835
  331   1HH1  ARG  43          HH11      ARG  43  -4.209  -1.043  14.578
  332   2HH1  ARG  43          HH12      ARG  43  -4.975   0.276  15.398
  333   1HH2  ARG  43          HH21      ARG  43  -2.251   2.400  15.091
  334   2HH2  ARG  43          HH22      ARG  43  -3.866   2.223  15.692
  335    H    TYR  44           HN       TYR  44   1.732  -2.089  12.693
  336    HA   TYR  44           HA       TYR  44   2.651  -4.527  11.352
  337   1HB   TYR  44          HB2       TYR  44   3.113  -3.441  14.150
  338   2HB   TYR  44          HB1       TYR  44   3.790  -4.951  13.553
  339    HD1  TYR  44           HD1      TYR  44   5.060  -4.741  11.207
  340    HD2  TYR  44           HD2      TYR  44   4.423  -1.516  13.977
  341    HE1  TYR  44           HE1      TYR  44   6.982  -3.518  10.228
  342    HE2  TYR  44           HE2      TYR  44   6.341  -0.296  13.001
  343    HH   TYR  44           HH       TYR  44   8.660  -1.565  11.300
  344    H    ALA  45           HN       ALA  45   2.017  -6.553  11.738
  345    HA   ALA  45           HA       ALA  45   0.032  -7.079  13.835
  346   1HB   ALA  45          HB1       ALA  45  -1.225  -6.602  11.734
  347   2HB   ALA  45          HB2       ALA  45  -1.416  -8.269  12.279
  348   3HB   ALA  45          HB3       ALA  45  -0.331  -7.898  10.940
  349    H    ALA  46           HN       ALA  46  -0.268  -9.510  14.054
  350    HA   ALA  46           HA       ALA  46   2.257 -10.724  14.361
  351   1HB   ALA  46          HB1       ALA  46   0.075 -11.328  15.566
  352   2HB   ALA  46          HB2       ALA  46   1.088 -12.681  15.060
  353   3HB   ALA  46          HB3       ALA  46  -0.342 -12.249  14.121
  354    H    ALA  47           HN       ALA  47   0.099 -10.629  11.626
  355    HA   ALA  47           HA       ALA  47   2.095 -12.201  10.105
  356   1HB   ALA  47          HB1       ALA  47  -0.874 -12.649   9.804
  357   2HB   ALA  47          HB2       ALA  47   0.142 -13.636  10.854
  358   3HB   ALA  47          HB3       ALA  47   0.443 -13.599   9.118
  359    H    ASN  48           HN       ASN  48   2.158 -11.867   7.863
  360    HA   ASN  48           HA       ASN  48   1.505  -9.182   7.028
  361   1HB   ASN  48          HB2       ASN  48   3.508 -10.382   6.175
  362   2HB   ASN  48          HB1       ASN  48   2.452 -11.565   5.404
  363   1HD2  ASN  48          HD21      ASN  48   3.291  -8.081   5.382
  364   2HD2  ASN  48          HD22      ASN  48   2.775  -7.811   3.788
  365    H    ASN  49           HN       ASN  49  -0.434  -8.569   6.217
  366    HA   ASN  49           HA       ASN  49  -2.057 -10.445   4.666
  367   1HB   ASN  49          HB2       ASN  49  -3.039  -9.182   7.232
  368   2HB   ASN  49          HB1       ASN  49  -4.084  -9.924   6.026
  369   1HD2  ASN  49          HD21      ASN  49  -2.713 -10.625   8.924
  370   2HD2  ASN  49          HD22      ASN  49  -2.475 -12.296   8.743
  371    H    LEU  50           HN       LEU  50  -3.565  -9.407   3.322
  372    HA   LEU  50           HA       LEU  50  -3.444  -6.450   3.247
  373   1HB   LEU  50          HB2       LEU  50  -2.075  -7.538   1.436
  374   2HB   LEU  50          HB1       LEU  50  -3.523  -8.383   0.905
  375    HG   LEU  50           HG       LEU  50  -4.627  -6.118   0.595
  376   1HD1  LEU  50          HD11      LEU  50  -2.859  -4.255   0.220
  377   2HD1  LEU  50          HD12      LEU  50  -1.821  -5.231   1.256
  378   3HD1  LEU  50          HD13      LEU  50  -3.351  -4.610   1.872
  379   1HD2  LEU  50          HD21      LEU  50  -3.446  -5.665  -1.545
  380   2HD2  LEU  50          HD22      LEU  50  -3.741  -7.387  -1.316
  381   3HD2  LEU  50          HD23      LEU  50  -2.132  -6.721  -1.030
  382    H    SER  51           HN       SER  51  -5.509  -5.637   3.532
  383    HA   SER  51           HA       SER  51  -7.792  -7.342   2.694
  384   1HB   SER  51          HB2       SER  51  -7.468  -5.578   5.123
  385   2HB   SER  51          HB1       SER  51  -9.019  -6.209   4.577
  386    HG   SER  51           HG       SER  51  -7.837  -7.506   6.174
  387    H    VAL  52           HN       VAL  52  -9.170  -6.356   1.284
  388    HA   VAL  52           HA       VAL  52  -9.090  -3.410   1.043
  389    HB   VAL  52           HB       VAL  52  -9.458  -5.415  -1.205
  390   1HG1  VAL  52          HG11      VAL  52 -10.799  -3.399  -1.554
  391   2HG1  VAL  52          HG12      VAL  52  -9.401  -3.361  -2.627
  392   3HG1  VAL  52          HG13      VAL  52  -9.413  -2.381  -1.161
  393   1HG2  VAL  52          HG21      VAL  52  -7.316  -4.250  -2.007
  394   2HG2  VAL  52          HG22      VAL  52  -7.137  -5.350  -0.641
  395   3HG2  VAL  52          HG23      VAL  52  -7.177  -3.608  -0.370
  396    H    ILE  53           HN       ILE  53 -11.058  -2.499   1.408
  397    HA   ILE  53           HA       ILE  53 -13.474  -4.188   1.052
  398    HB   ILE  53           HB       ILE  53 -13.074  -2.117   3.227
  399   1HG1  ILE  53          HG12      ILE  53 -13.297  -4.440   4.604
  400   2HG1  ILE  53          HG11      ILE  53 -12.526  -5.083   3.157
  401   1HG2  ILE  53          HG21      ILE  53 -15.229  -4.181   2.691
  402   2HG2  ILE  53          HG22      ILE  53 -15.393  -2.435   2.502
  403   3HG2  ILE  53          HG23      ILE  53 -15.161  -3.130   4.105
  404   1HD1  ILE  53          HD11      ILE  53 -11.468  -2.775   4.817
  405   2HD1  ILE  53          HD12      ILE  53 -10.675  -3.487   3.414
  406   3HD1  ILE  53          HD13      ILE  53 -10.874  -4.432   4.887
  407    H    GLY  54           HN       GLY  54 -15.041  -3.358  -0.132
  408   1HA   GLY  54          HA2       GLY  54 -16.448  -1.665  -0.966
  409   2HA   GLY  54          HA1       GLY  54 -15.245  -0.457  -0.522
  410    H    ALA  55           HN       ALA  55 -13.895  -3.162  -2.111
  411    HA   ALA  55           HA       ALA  55 -13.813  -1.655  -4.672
  412   1HB   ALA  55          HB1       ALA  55 -11.554  -3.429  -3.778
  413   2HB   ALA  55          HB2       ALA  55 -11.680  -1.785  -3.157
  414   3HB   ALA  55          HB3       ALA  55 -11.526  -2.061  -4.892
  415    H    THR  56           HN       THR  56 -13.295  -2.907  -6.559
  416    HA   THR  56           HA       THR  56 -14.720  -5.501  -6.766
  417    HB   THR  56           HB       THR  56 -14.598  -5.028  -9.121
  418    HG1  THR  56           HG1      THR  56 -12.888  -3.016  -8.211
  419   1HG2  THR  56          HG21      THR  56 -15.508  -2.670  -7.451
  420   2HG2  THR  56          HG22      THR  56 -16.483  -4.050  -7.956
  421   3HG2  THR  56          HG23      THR  56 -15.913  -2.887  -9.153
  422    H    LYS  57           HN       LYS  57 -13.767  -7.171  -7.931
  423    HA   LYS  57           HA       LYS  57 -11.263  -7.959  -7.036
  424   1HB   LYS  57          HB2       LYS  57 -12.754  -8.905  -9.490
  425   2HB   LYS  57          HB1       LYS  57 -11.432  -9.763  -8.707
  426   1HG   LYS  57          HG2       LYS  57 -14.003  -9.005  -7.289
  427   2HG   LYS  57          HG1       LYS  57 -13.749 -10.565  -8.066
  428   1HD   LYS  57          HD2       LYS  57 -11.611 -10.717  -6.592
  429   2HD   LYS  57          HD1       LYS  57 -12.345  -9.418  -5.651
  430   1HE   LYS  57          HE2       LYS  57 -12.963 -11.554  -4.663
  431   2HE   LYS  57          HE1       LYS  57 -14.392 -10.811  -5.382
  432   1HZ   LYS  57          HZ1       LYS  57 -14.624 -12.534  -6.730
  433   2HZ   LYS  57          HZ2       LYS  57 -13.347 -13.315  -5.925
  434   3HZ   LYS  57          HZ3       LYS  57 -13.036 -12.375  -7.307
  435    H    GLU  58           HN       GLU  58 -12.022  -6.398 -10.205
  436    HA   GLU  58           HA       GLU  58  -9.393  -6.758 -11.232
  437   1HB   GLU  58          HB2       GLU  58 -11.400  -6.245 -12.621
  438   2HB   GLU  58          HB1       GLU  58 -11.424  -4.625 -11.924
  439   1HG   GLU  58          HG2       GLU  58  -9.164  -4.199 -12.796
  440   2HG   GLU  58          HG1       GLU  58  -9.107  -5.827 -13.470
  441    H    ASP  59           HN       ASP  59 -10.920  -4.204  -9.307
  442    HA   ASP  59           HA       ASP  59  -8.809  -2.336  -9.504
  443   1HB   ASP  59          HB2       ASP  59 -10.920  -2.795  -7.386
  444   2HB   ASP  59          HB1       ASP  59  -9.775  -1.457  -7.326
  445    H    LYS  60           HN       LYS  60  -9.591  -4.914  -7.241
  446    HA   LYS  60           HA       LYS  60  -7.392  -4.523  -5.492
  447   1HB   LYS  60          HB2       LYS  60  -9.363  -5.876  -4.847
  448   2HB   LYS  60          HB1       LYS  60  -8.939  -7.072  -6.071
  449   1HG   LYS  60          HG2       LYS  60  -6.790  -7.495  -4.914
  450   2HG   LYS  60          HG1       LYS  60  -7.218  -6.296  -3.693
  451   1HD   LYS  60          HD2       LYS  60  -9.102  -7.616  -2.960
  452   2HD   LYS  60          HD1       LYS  60  -8.902  -8.736  -4.309
  453   1HE   LYS  60          HE2       LYS  60  -7.958  -9.704  -2.256
  454   2HE   LYS  60          HE1       LYS  60  -6.679  -9.388  -3.427
  455   1HZ   LYS  60          HZ1       LYS  60  -7.090  -7.085  -1.874
  456   2HZ   LYS  60          HZ2       LYS  60  -5.701  -8.058  -1.977
  457   3HZ   LYS  60          HZ3       LYS  60  -6.904  -8.408  -0.828
  458    H    GLN  61           HN       GLN  61  -7.608  -6.528  -8.459
  459    HA   GLN  61           HA       GLN  61  -5.030  -7.684  -8.077
  460   1HB   GLN  61          HB2       GLN  61  -6.650  -7.110 -10.579
  461   2HB   GLN  61          HB1       GLN  61  -5.118  -7.978 -10.596
  462   1HG   GLN  61          HG2       GLN  61  -6.058  -9.689  -9.094
  463   2HG   GLN  61          HG1       GLN  61  -7.588  -8.813  -9.045
  464   1HE2  GLN  61          HE21      GLN  61  -7.188 -11.557 -10.109
  465   2HE2  GLN  61          HE22      GLN  61  -7.630 -11.496 -11.746
  466    H    ARG  62           HN       ARG  62  -6.178  -4.691  -9.685
  467    HA   ARG  62           HA       ARG  62  -3.684  -3.924 -10.684
  468   1HB   ARG  62          HB2       ARG  62  -5.793  -2.869 -11.413
  469   2HB   ARG  62          HB1       ARG  62  -6.012  -2.184  -9.807
  470   1HG   ARG  62          HG2       ARG  62  -5.115  -0.450 -11.218
  471   2HG   ARG  62          HG1       ARG  62  -3.831  -0.945 -10.126
  472   1HD   ARG  62          HD2       ARG  62  -2.741  -2.218 -11.842
  473   2HD   ARG  62          HD1       ARG  62  -4.138  -2.097 -12.908
  474    HE   ARG  62           HE       ARG  62  -3.380   0.507 -12.446
  475   1HH1  ARG  62          HH11      ARG  62  -2.216  -2.335 -14.003
  476   2HH1  ARG  62          HH12      ARG  62  -0.950  -1.522 -14.862
  477   1HH2  ARG  62          HH21      ARG  62  -1.568   1.558 -13.395
  478   2HH2  ARG  62          HH22      ARG  62  -0.580   0.680 -14.514
  479    H    ILE  63           HN       ILE  63  -5.254  -3.180  -7.597
  480    HA   ILE  63           HA       ILE  63  -3.180  -1.542  -6.618
  481    HB   ILE  63           HB       ILE  63  -5.181  -3.226  -5.134
  482   1HG1  ILE  63          HG12      ILE  63  -5.029  -0.220  -5.385
  483   2HG1  ILE  63          HG11      ILE  63  -5.936  -1.217  -6.522
  484   1HG2  ILE  63          HG21      ILE  63  -3.374  -2.960  -3.600
  485   2HG2  ILE  63          HG22      ILE  63  -4.536  -1.702  -3.178
  486   3HG2  ILE  63          HG23      ILE  63  -3.097  -1.295  -4.112
  487   1HD1  ILE  63          HD11      ILE  63  -7.344  -0.324  -4.649
  488   2HD1  ILE  63          HD12      ILE  63  -6.356  -1.252  -3.521
  489   3HD1  ILE  63          HD13      ILE  63  -7.330  -2.086  -4.733
  490    H    SER  64           HN       SER  64  -3.600  -5.032  -6.419
  491    HA   SER  64           HA       SER  64  -1.314  -5.519  -4.807
  492   1HB   SER  64          HB2       SER  64  -3.029  -7.258  -5.402
  493   2HB   SER  64          HB1       SER  64  -2.392  -7.264  -7.044
  494    HG   SER  64           HG       SER  64  -0.298  -7.526  -5.581
  495    H    GLU  65           HN       GLU  65  -1.739  -5.203  -8.390
  496    HA   GLU  65           HA       GLU  65   0.949  -5.709  -9.025
  497   1HB   GLU  65          HB2       GLU  65  -1.157  -4.053 -10.449
  498   2HB   GLU  65          HB1       GLU  65   0.437  -4.391 -11.128
  499   1HG   GLU  65          HG2       GLU  65  -1.471  -6.550 -10.200
  500   2HG   GLU  65          HG1       GLU  65  -1.374  -5.991 -11.869
  501    H    ILE  66           HN       ILE  66  -0.727  -2.699  -8.203
  502    HA   ILE  66           HA       ILE  66   1.427  -0.952  -8.629
  503    HB   ILE  66           HB       ILE  66  -0.916  -0.811  -6.730
  504   1HG1  ILE  66          HG12      ILE  66  -0.306   0.715  -9.279
  505   2HG1  ILE  66          HG11      ILE  66  -1.279  -0.753  -9.235
  506   1HG2  ILE  66          HG21      ILE  66   1.268   1.204  -7.300
  507   2HG2  ILE  66          HG22      ILE  66   0.736   0.598  -5.730
  508   3HG2  ILE  66          HG23      ILE  66  -0.308   1.661  -6.660
  509   1HD1  ILE  66          HD11      ILE  66  -1.981   1.557  -7.430
  510   2HD1  ILE  66          HD12      ILE  66  -3.022   0.284  -8.062
  511   3HD1  ILE  66          HD13      ILE  66  -2.475   1.578  -9.122
  512    H    LEU  67           HN       LEU  67   0.429  -2.693  -5.709
  513    HA   LEU  67           HA       LEU  67   2.435  -1.680  -4.019
  514   1HB   LEU  67          HB2       LEU  67   0.576  -2.889  -3.036
  515   2HB   LEU  67          HB1       LEU  67   0.936  -4.318  -3.993
  516    HG   LEU  67           HG       LEU  67   3.159  -4.483  -2.782
  517   1HD1  LEU  67          HD11      LEU  67   1.946  -2.153  -1.296
  518   2HD1  LEU  67          HD12      LEU  67   3.598  -2.348  -1.887
  519   3HD1  LEU  67          HD13      LEU  67   3.055  -3.248  -0.477
  520   1HD2  LEU  67          HD21      LEU  67   1.432  -5.950  -2.068
  521   2HD2  LEU  67          HD22      LEU  67   0.535  -4.647  -1.290
  522   3HD2  LEU  67          HD23      LEU  67   2.051  -5.215  -0.590
  523    H    GLN  68           HN       GLN  68   2.376  -4.437  -6.215
  524    HA   GLN  68           HA       GLN  68   4.952  -5.420  -5.530
  525   1HB   GLN  68          HB2       GLN  68   3.338  -5.589  -8.085
  526   2HB   GLN  68          HB1       GLN  68   4.875  -6.423  -7.845
  527   1HG   GLN  68          HG2       GLN  68   3.984  -7.683  -5.992
  528   2HG   GLN  68          HG1       GLN  68   2.505  -6.727  -5.987
  529   1HE2  GLN  68          HE21      GLN  68   2.180  -9.460  -6.226
  530   2HE2  GLN  68          HE22      GLN  68   1.740  -9.869  -7.813
  531    H    GLU  69           HN       GLU  69   3.978  -3.193  -8.202
  532    HA   GLU  69           HA       GLU  69   6.576  -2.773  -9.121
  533   1HB   GLU  69          HB2       GLU  69   4.100  -1.061  -9.277
  534   2HB   GLU  69          HB1       GLU  69   5.604  -0.650 -10.102
  535   1HG   GLU  69          HG2       GLU  69   5.558  -2.816 -11.277
  536   2HG   GLU  69          HG1       GLU  69   4.054  -3.233 -10.455
  537    H    THR  70           HN       THR  70   4.771  -0.808  -6.727
  538    HA   THR  70           HA       THR  70   6.716   1.199  -6.443
  539    HB   THR  70           HB       THR  70   4.830   0.128  -4.374
  540    HG1  THR  70           HG1      THR  70   4.008   0.969  -6.441
  541   1HG2  THR  70          HG21      THR  70   6.399   2.701  -4.558
  542   2HG2  THR  70          HG22      THR  70   6.536   1.463  -3.310
  543   3HG2  THR  70          HG23      THR  70   5.074   2.444  -3.423
  544    H    TRP  71           HN       TRP  71   6.185  -1.777  -4.736
  545    HA   TRP  71           HA       TRP  71   8.265  -1.656  -2.929
  546   1HB   TRP  71          HB2       TRP  71   6.290  -3.156  -2.906
  547   2HB   TRP  71          HB1       TRP  71   7.026  -4.065  -4.212
  548    HD1  TRP  71           HD1      TRP  71   7.709  -6.264  -3.186
  549    HE1  TRP  71           HE1      TRP  71   9.071  -7.027  -1.148
  550    HE3  TRP  71           HE3      TRP  71   8.430  -1.758  -0.787
  551    HZ2  TRP  71           HZ2      TRP  71  10.283  -5.924   1.170
  552    HZ3  TRP  71           HZ3      TRP  71   9.685  -1.681   1.327
  553    HH2  TRP  71           HH2      TRP  71  10.605  -3.753   2.320
  554    H    GLU  72           HN       GLU  72   8.200  -2.855  -6.224
  555    HA   GLU  72           HA       GLU  72  10.896  -3.792  -6.164
  556   1HB   GLU  72          HB2       GLU  72   8.965  -3.335  -8.441
  557   2HB   GLU  72          HB1       GLU  72  10.606  -3.934  -8.689
  558   1HG   GLU  72          HG2       GLU  72  10.152  -5.829  -7.182
  559   2HG   GLU  72          HG1       GLU  72   8.517  -5.236  -6.917
  560    H    SER  73           HN       SER  73   9.554  -0.614  -6.623
  561    HA   SER  73           HA       SER  73  12.091   0.273  -7.879
  562   1HB   SER  73          HB2       SER  73  10.908   2.298  -8.515
  563   2HB   SER  73          HB1       SER  73   9.951   0.907  -9.017
  564    HG   SER  73           HG       SER  73   9.152   2.875  -7.533
  565    H    ALA  74           HN       ALA  74  11.490  -0.372  -4.961
  566    HA   ALA  74           HA       ALA  74  11.311   1.770  -3.340
  567   1HB   ALA  74          HB1       ALA  74  12.322   0.427  -1.669
  568   2HB   ALA  74          HB2       ALA  74  13.151  -0.554  -2.877
  569   3HB   ALA  74          HB3       ALA  74  11.396  -0.634  -2.729
  570    H    ASP  75           HN       ASP  75  14.320   0.693  -4.913
  571    HA   ASP  75           HA       ASP  75  16.073   2.299  -3.399
  572   1HB   ASP  75          HB2       ASP  75  16.277   1.179  -6.198
  573   2HB   ASP  75          HB1       ASP  75  17.599   2.035  -5.404
  574    H    ASP  76           HN       ASP  76  13.869   3.124  -5.947
  575    HA   ASP  76           HA       ASP  76  15.227   5.663  -6.555
  576   1HB   ASP  76          HB2       ASP  76  14.335   4.383  -8.420
  577   2HB   ASP  76          HB1       ASP  76  12.735   4.386  -7.685
  578    H    TRP  77           HN       TRP  77  12.072   4.596  -5.188
  579    HA   TRP  77           HA       TRP  77  11.455   7.413  -4.630
  580   1HB   TRP  77          HB2       TRP  77   9.243   6.777  -4.297
  581   2HB   TRP  77          HB1       TRP  77   9.812   5.817  -5.644
  582    HD1  TRP  77           HD1      TRP  77   9.753   3.195  -5.384
  583    HE1  TRP  77           HE1      TRP  77   8.953   1.618  -3.532
  584    HE3  TRP  77           HE3      TRP  77   9.195   6.528  -1.453
  585    HZ2  TRP  77           HZ2      TRP  77   8.178   1.708  -0.804
  586    HZ3  TRP  77           HZ3      TRP  77   8.410   5.701   0.714
  587    HH2  TRP  77           HH2      TRP  77   7.902   3.320   1.049
  588    H    PHE  78           HN       PHE  78  12.590   4.681  -2.768
  589    HA   PHE  78           HA       PHE  78  11.721   5.943  -0.240
  590   1HB   PHE  78          HB2       PHE  78  11.576   3.574  -0.175
  591   2HB   PHE  78          HB1       PHE  78  13.211   3.385  -0.788
  592    HD1  PHE  78           HD1      PHE  78  15.172   3.782   0.620
  593    HD2  PHE  78           HD2      PHE  78  11.195   4.390   2.157
  594    HE1  PHE  78           HE1      PHE  78  16.080   3.956   2.905
  595    HE2  PHE  78           HE2      PHE  78  12.120   4.559   4.448
  596    HZ   PHE  78           HZ       PHE  78  14.559   4.341   4.827
  597    H    VAL  79           HN       VAL  79  12.904   7.316   0.851
  598    HA   VAL  79           HA       VAL  79  15.779   7.591   0.199
  599    HB   VAL  79           HB       VAL  79  14.031   9.876   1.118
  600   1HG1  VAL  79          HG11      VAL  79  15.695  11.232   0.087
  601   2HG1  VAL  79          HG12      VAL  79  16.372   9.866  -0.798
  602   3HG1  VAL  79          HG13      VAL  79  16.586   9.980   0.949
  603   1HG2  VAL  79          HG21      VAL  79  12.801   8.988  -0.773
  604   2HG2  VAL  79          HG22      VAL  79  14.290   8.773  -1.699
  605   3HG2  VAL  79          HG23      VAL  79  13.705  10.396  -1.341
  606    H    SER  80           HN       SER  80  17.186   7.779   2.073
  607    HA   SER  80           HA       SER  80  15.832   7.836   4.718
  608   1HB   SER  80          HB2       SER  80  17.823   6.361   5.425
  609   2HB   SER  80          HB1       SER  80  16.573   5.577   4.463
  610    HG   SER  80           HG       SER  80  18.942   6.750   3.420
  611    H    GLU  81           HN       GLU  81  16.697   9.115   6.219
  612    HA   GLU  81           HA       GLU  81  18.405  11.239   5.457
  613   1HB   GLU  81          HB2       GLU  81  17.657  10.270   8.227
  614   2HB   GLU  81          HB1       GLU  81  18.385  11.833   7.849
  615   1HG   GLU  81          HG2       GLU  81  16.444  12.394   6.429
  616   2HG   GLU  81          HG1       GLU  81  15.716  10.835   6.810
  Start of MODEL   11
    1   1H    MET   1          HT1       MET   1 -14.339   3.719  -1.383
    2   2H    MET   1          HT2       MET   1 -12.897   4.578  -1.116
    3   3H    MET   1          HT3       MET   1 -13.913   4.188   0.189
    4    HA   MET   1           HA       MET   1 -13.512   1.789  -0.304
    5   1HB   MET   1          HB2       MET   1 -11.399   3.011  -2.099
    6   2HB   MET   1          HB1       MET   1 -11.528   1.300  -1.694
    7   1HG   MET   1          HG2       MET   1 -13.932   1.444  -2.604
    8   2HG   MET   1          HG1       MET   1 -13.445   2.982  -3.309
    9   1HE   MET   1          HE1       MET   1 -11.118   3.220  -4.413
   10   2HE   MET   1          HE2       MET   1 -10.390   2.020  -5.477
   11   3HE   MET   1          HE3       MET   1 -10.126   1.917  -3.739
   12    H    ARG   2           HN       ARG   2 -12.110   0.862   1.201
   13    HA   ARG   2           HA       ARG   2 -10.096   2.663   2.428
   14   1HB   ARG   2          HB2       ARG   2 -11.948   0.685   3.790
   15   2HB   ARG   2          HB1       ARG   2 -10.537   1.392   4.577
   16   1HG   ARG   2          HG2       ARG   2 -11.448   3.656   4.172
   17   2HG   ARG   2          HG1       ARG   2 -12.867   2.942   3.406
   18   1HD   ARG   2          HD2       ARG   2 -13.343   1.716   5.531
   19   2HD   ARG   2          HD1       ARG   2 -11.991   2.558   6.282
   20    HE   ARG   2           HE       ARG   2 -13.680   4.507   5.197
   21   1HH1  ARG   2          HH21      ARG   2 -14.842   1.837   6.844
   22   2HH1  ARG   2          HH22      ARG   2 -15.500   2.708   8.189
   23   1HH2  ARG   2          HH11      ARG   2 -14.060   5.729   7.275
   24   2HH2  ARG   2          HH12      ARG   2 -15.054   4.912   8.434
   25    H    ILE   3           HN       ILE   3  -8.104   1.890   2.508
   26    HA   ILE   3           HA       ILE   3  -7.643  -0.970   1.815
   27    HB   ILE   3           HB       ILE   3  -5.977   1.475   1.182
   28   1HG1  ILE   3          HG12      ILE   3  -6.428   0.426  -1.206
   29   2HG1  ILE   3          HG11      ILE   3  -7.793  -0.350  -0.412
   30   1HG2  ILE   3          HG21      ILE   3  -4.635  -0.276  -0.117
   31   2HG2  ILE   3          HG22      ILE   3  -5.480  -1.486   0.847
   32   3HG2  ILE   3          HG23      ILE   3  -4.449  -0.293   1.636
   33   1HD1  ILE   3          HD11      ILE   3  -8.844   1.717   0.044
   34   2HD1  ILE   3          HD12      ILE   3  -8.194   1.925  -1.574
   35   3HD1  ILE   3          HD13      ILE   3  -7.360   2.636  -0.198
   36    H    GLU   4           HN       GLU   4  -6.689  -2.092   3.429
   37    HA   GLU   4           HA       GLU   4  -4.996  -0.624   5.397
   38   1HB   GLU   4          HB2       GLU   4  -6.826  -2.978   5.965
   39   2HB   GLU   4          HB1       GLU   4  -5.746  -2.208   7.127
   40   1HG   GLU   4          HG2       GLU   4  -6.934  -0.068   6.818
   41   2HG   GLU   4          HG1       GLU   4  -8.015  -0.835   5.657
   42    H    VAL   5           HN       VAL   5  -3.005  -1.308   5.623
   43    HA   VAL   5           HA       VAL   5  -2.256  -3.980   4.539
   44    HB   VAL   5           HB       VAL   5  -0.508  -1.521   4.657
   45   1HG1  VAL   5          HG11      VAL   5  -0.281  -4.204   3.273
   46   2HG1  VAL   5          HG12      VAL   5   0.749  -3.581   4.560
   47   3HG1  VAL   5          HG13      VAL   5   0.795  -2.843   2.960
   48   1HG2  VAL   5          HG21      VAL   5  -2.257  -0.948   3.146
   49   2HG2  VAL   5          HG22      VAL   5  -2.314  -2.575   2.475
   50   3HG2  VAL   5          HG23      VAL   5  -0.941  -1.526   2.127
   51    H    THR   6           HN       THR   6  -1.156  -5.340   5.801
   52    HA   THR   6           HA       THR   6  -0.109  -4.335   8.390
   53    HB   THR   6           HB       THR   6  -0.799  -6.354   9.432
   54    HG1  THR   6           HG1      THR   6  -0.293  -7.700   7.626
   55   1HG2  THR   6          HG21      THR   6  -2.587  -4.677   9.068
   56   2HG2  THR   6          HG22      THR   6  -3.228  -6.321   9.086
   57   3HG2  THR   6          HG23      THR   6  -3.007  -5.476   7.553
   58    H    ILE   7           HN       ILE   7   1.891  -4.795   8.890
   59    HA   ILE   7           HA       ILE   7   3.434  -6.644   7.171
   60    HB   ILE   7           HB       ILE   7   4.073  -4.036   8.524
   61   1HG1  ILE   7          HG12      ILE   7   3.184  -4.340   6.068
   62   2HG1  ILE   7          HG11      ILE   7   4.507  -3.221   6.376
   63   1HG2  ILE   7          HG21      ILE   7   5.960  -6.271   7.794
   64   2HG2  ILE   7          HG22      ILE   7   6.020  -5.160   9.162
   65   3HG2  ILE   7          HG23      ILE   7   6.496  -4.604   7.559
   66   1HD1  ILE   7          HD11      ILE   7   5.106  -6.086   5.653
   67   2HD1  ILE   7          HD12      ILE   7   6.115  -4.657   5.451
   68   3HD1  ILE   7          HD13      ILE   7   4.726  -4.909   4.395
   69    H    ALA   8           HN       ALA   8   4.428  -8.326   8.168
   70    HA   ALA   8           HA       ALA   8   3.868  -8.968  10.864
   71   1HB   ALA   8          HB1       ALA   8   5.557 -10.801  10.447
   72   2HB   ALA   8          HB2       ALA   8   5.813 -10.092   8.851
   73   3HB   ALA   8          HB3       ALA   8   4.227 -10.727   9.290
   74    H    LYS   9           HN       LYS   9   4.887  -8.717  12.594
   75    HA   LYS   9           HA       LYS   9   6.889  -6.789  12.959
   76   1HB   LYS   9          HB2       LYS   9   5.776  -8.937  14.778
   77   2HB   LYS   9          HB1       LYS   9   7.009  -7.822  15.354
   78   1HG   LYS   9          HG2       LYS   9   5.457  -5.918  14.903
   79   2HG   LYS   9          HG1       LYS   9   4.233  -7.066  14.354
   80   1HD   LYS   9          HD2       LYS   9   5.503  -7.179  17.099
   81   2HD   LYS   9          HD1       LYS   9   4.011  -6.304  16.767
   82   1HE   LYS   9          HE2       LYS   9   3.206  -8.584  15.738
   83   2HE   LYS   9          HE1       LYS   9   4.518  -9.271  16.695
   84   1HZ   LYS   9          HZ1       LYS   9   3.251  -9.130  18.479
   85   2HZ   LYS   9          HZ2       LYS   9   1.984  -8.474  17.556
   86   3HZ   LYS   9          HZ3       LYS   9   3.123  -7.449  18.291
   87    H    THR  10           HN       THR  10   7.211 -10.192  12.339
   88    HA   THR  10           HA       THR  10   9.828 -10.530  13.354
   89    HB   THR  10           HB       THR  10   9.919 -12.380  11.608
   90    HG1  THR  10           HG1      THR  10   7.282 -11.423  11.207
   91   1HG2  THR  10          HG21      THR  10   7.667 -12.178  13.616
   92   2HG2  THR  10          HG22      THR  10   9.245 -12.935  13.834
   93   3HG2  THR  10          HG23      THR  10   8.054 -13.670  12.760
   94    H    SER  11           HN       SER  11   8.604  -8.659  10.774
   95    HA   SER  11           HA       SER  11  11.309  -8.429   9.549
   96   1HB   SER  11          HB2       SER  11   9.698  -9.521   8.035
   97   2HB   SER  11          HB1       SER  11   8.617  -8.140   8.194
   98    HG   SER  11           HG       SER  11  11.151  -7.388   7.578
   99    HA   PRO  12           HA       PRO  12  10.079  -4.195  11.096
  100   1HB   PRO  12          HB2       PRO  12  12.728  -3.941  12.209
  101   2HB   PRO  12          HB1       PRO  12  11.196  -4.075  13.090
  102   1HG   PRO  12          HG2       PRO  12  13.189  -5.991  13.093
  103   2HG   PRO  12          HG1       PRO  12  11.490  -6.294  13.490
  104   1HD   PRO  12          HD2       PRO  12  12.962  -6.874  10.942
  105   2HD   PRO  12          HD1       PRO  12  11.662  -7.784  11.734
  106    H    LEU  13           HN       LEU  13  10.214  -2.425  10.071
  107    HA   LEU  13           HA       LEU  13  12.381  -2.114   8.074
  108   1HB   LEU  13          HB2       LEU  13   9.727  -0.668   8.104
  109   2HB   LEU  13          HB1       LEU  13  10.860  -0.825   6.763
  110    HG   LEU  13           HG       LEU  13   9.248  -3.073   8.019
  111   1HD1  LEU  13          HD11      LEU  13   8.088  -1.418   6.422
  112   2HD1  LEU  13          HD12      LEU  13   7.986  -3.127   6.009
  113   3HD1  LEU  13          HD13      LEU  13   9.129  -2.086   5.162
  114   1HD2  LEU  13          HD21      LEU  13  11.393  -3.070   5.878
  115   2HD2  LEU  13          HD22      LEU  13  10.210  -4.369   6.019
  116   3HD2  LEU  13          HD23      LEU  13  11.321  -4.046   7.345
  117    HA   PRO  14           HA       PRO  14  14.103   1.107  10.471
  118   1HB   PRO  14          HB2       PRO  14  14.256   3.134   8.388
  119   2HB   PRO  14          HB1       PRO  14  15.563   2.131   9.036
  120   1HG   PRO  14          HG2       PRO  14  14.062   1.819   6.550
  121   2HG   PRO  14          HG1       PRO  14  15.570   1.040   7.051
  122   1HD   PRO  14          HD2       PRO  14  13.116  -0.261   6.843
  123   2HD   PRO  14          HD1       PRO  14  14.480  -0.840   7.819
  124    H    ALA  15           HN       ALA  15  13.649   2.899  11.582
  125    HA   ALA  15           HA       ALA  15  11.010   3.486  12.199
  126   1HB   ALA  15          HB1       ALA  15  12.985   3.851  13.645
  127   2HB   ALA  15          HB2       ALA  15  11.887   5.231  13.600
  128   3HB   ALA  15          HB3       ALA  15  13.391   5.269  12.679
  129    H    GLY  16           HN       GLY  16  10.817   3.880   9.484
  130   1HA   GLY  16          HA2       GLY  16   9.727   6.504   9.287
  131   2HA   GLY  16          HA1       GLY  16  11.272   6.463   8.491
  132    H    ALA  17           HN       ALA  17  10.681   3.491   7.970
  133    HA   ALA  17           HA       ALA  17   9.821   3.888   5.281
  134   1HB   ALA  17          HB1       ALA  17  10.572   1.496   6.922
  135   2HB   ALA  17          HB2       ALA  17  11.374   2.157   5.500
  136   3HB   ALA  17          HB3       ALA  17   9.855   1.279   5.324
  137    H    ILE  18           HN       ILE  18   8.017   2.506   8.001
  138    HA   ILE  18           HA       ILE  18   5.884   1.644   6.394
  139    HB   ILE  18           HB       ILE  18   5.988   2.558   9.270
  140   1HG1  ILE  18          HG12      ILE  18   7.093   0.359   8.298
  141   2HG1  ILE  18          HG11      ILE  18   6.195   0.296   9.804
  142   1HG2  ILE  18          HG21      ILE  18   3.728   2.953   8.751
  143   2HG2  ILE  18          HG22      ILE  18   3.718   1.302   9.375
  144   3HG2  ILE  18          HG23      ILE  18   3.652   1.588   7.636
  145   1HD1  ILE  18          HD11      ILE  18   4.374  -0.794   8.843
  146   2HD1  ILE  18          HD12      ILE  18   5.713  -1.481   7.925
  147   3HD1  ILE  18          HD13      ILE  18   4.736  -0.194   7.225
  148    H    ASP  19           HN       ASP  19   6.371   4.725   8.118
  149    HA   ASP  19           HA       ASP  19   3.988   5.941   7.158
  150   1HB   ASP  19          HB2       ASP  19   6.598   7.153   8.120
  151   2HB   ASP  19          HB1       ASP  19   5.177   8.110   7.700
  152    H    ALA  20           HN       ALA  20   7.245   5.744   5.802
  153    HA   ALA  20           HA       ALA  20   6.683   7.492   3.666
  154   1HB   ALA  20          HB1       ALA  20   8.975   6.572   4.479
  155   2HB   ALA  20          HB2       ALA  20   8.745   6.828   2.752
  156   3HB   ALA  20          HB3       ALA  20   8.630   5.203   3.427
  157    H    LEU  21           HN       LEU  21   6.296   4.013   4.076
  158    HA   LEU  21           HA       LEU  21   5.566   3.349   1.468
  159   1HB   LEU  21          HB2       LEU  21   6.225   1.649   3.025
  160   2HB   LEU  21          HB1       LEU  21   4.953   2.101   4.152
  161    HG   LEU  21           HG       LEU  21   3.262   1.381   2.518
  162   1HD1  LEU  21          HD11      LEU  21   4.323   1.706   0.401
  163   2HD1  LEU  21          HD12      LEU  21   4.147  -0.038   0.569
  164   3HD1  LEU  21          HD13      LEU  21   5.708   0.722   0.871
  165   1HD2  LEU  21          HD21      LEU  21   4.329  -0.186   4.215
  166   2HD2  LEU  21          HD22      LEU  21   5.315  -0.802   2.888
  167   3HD2  LEU  21          HD23      LEU  21   3.560  -0.970   2.834
  168    H    ALA  22           HN       ALA  22   3.544   4.163   4.289
  169    HA   ALA  22           HA       ALA  22   1.012   3.883   3.022
  170   1HB   ALA  22          HB1       ALA  22   1.582   5.892   5.194
  171   2HB   ALA  22          HB2       ALA  22   1.545   4.163   5.545
  172   3HB   ALA  22          HB3       ALA  22   0.109   4.965   4.909
  173    H    GLY  23           HN       GLY  23   3.180   6.688   3.245
  174   1HA   GLY  23          HA2       GLY  23   1.364   8.494   1.955
  175   2HA   GLY  23          HA1       GLY  23   3.125   8.661   2.157
  176    H    GLU  24           HN       GLU  24   3.984   6.402   0.671
  177    HA   GLU  24           HA       GLU  24   3.646   7.393  -1.955
  178   1HB   GLU  24          HB2       GLU  24   5.664   6.117  -1.251
  179   2HB   GLU  24          HB1       GLU  24   4.680   4.665  -1.087
  180   1HG   GLU  24          HG2       GLU  24   4.081   4.805  -3.491
  181   2HG   GLU  24          HG1       GLU  24   5.085   6.247  -3.648
  182    H    LEU  25           HN       LEU  25   2.150   4.677  -0.235
  183    HA   LEU  25           HA       LEU  25   0.799   3.644  -2.483
  184   1HB   LEU  25          HB2       LEU  25   0.239   3.399   0.462
  185   2HB   LEU  25          HB1       LEU  25  -0.741   2.590  -0.758
  186    HG   LEU  25           HG       LEU  25   2.273   2.285  -0.544
  187   1HD1  LEU  25          HD11      LEU  25   0.077   0.450   0.468
  188   2HD1  LEU  25          HD12      LEU  25   1.158   1.409   1.477
  189   3HD1  LEU  25          HD13      LEU  25   1.803   0.095   0.494
  190   1HD2  LEU  25          HD21      LEU  25   0.133   1.094  -2.296
  191   2HD2  LEU  25          HD22      LEU  25   1.487   0.066  -1.832
  192   3HD2  LEU  25          HD23      LEU  25   1.782   1.561  -2.707
  193    H    SER  26           HN       SER  26  -0.242   6.063  -0.091
  194    HA   SER  26           HA       SER  26  -2.912   6.253  -0.987
  195   1HB   SER  26          HB2       SER  26  -1.143   8.328   0.318
  196   2HB   SER  26          HB1       SER  26  -2.879   8.508   0.077
  197    HG   SER  26           HG       SER  26  -2.610   6.172   1.153
  198    H    ARG  27           HN       ARG  27   0.011   8.066  -1.983
  199    HA   ARG  27           HA       ARG  27  -1.320   9.785  -3.802
  200   1HB   ARG  27          HB2       ARG  27   1.518   8.714  -3.751
  201   2HB   ARG  27          HB1       ARG  27   0.959   9.932  -4.899
  202   1HG   ARG  27          HG2       ARG  27   0.336  11.418  -3.034
  203   2HG   ARG  27          HG1       ARG  27   0.872  10.202  -1.875
  204   1HD   ARG  27          HD2       ARG  27   3.159  10.335  -2.788
  205   2HD   ARG  27          HD1       ARG  27   2.628  11.540  -3.957
  206    HE   ARG  27           HE       ARG  27   1.932  12.571  -1.489
  207   1HH1  ARG  27          HH21      ARG  27   4.598  12.279  -3.574
  208   2HH1  ARG  27          HH22      ARG  27   5.745  12.977  -2.481
  209   1HH2  ARG  27          HH11      ARG  27   3.525  13.128   0.176
  210   2HH2  ARG  27          HH12      ARG  27   5.140  13.455  -0.359
  211    H    ARG  28           HN       ARG  28   0.014   6.526  -4.145
  212    HA   ARG  28           HA       ARG  28  -0.410   6.241  -6.925
  213   1HB   ARG  28          HB2       ARG  28  -0.289   4.224  -4.679
  214   2HB   ARG  28          HB1       ARG  28  -0.411   3.768  -6.374
  215   1HG   ARG  28          HG2       ARG  28   1.754   5.671  -5.488
  216   2HG   ARG  28          HG1       ARG  28   1.962   3.939  -5.253
  217   1HD   ARG  28          HD2       ARG  28   1.522   3.600  -7.692
  218   2HD   ARG  28          HD1       ARG  28   1.462   5.347  -7.895
  219    HE   ARG  28           HE       ARG  28   3.878   4.621  -6.600
  220   1HH1  ARG  28          HH11      ARG  28   2.733   5.920  -9.420
  221   2HH1  ARG  28          HH12      ARG  28   3.977   5.305 -10.456
  222   1HH2  ARG  28          HH21      ARG  28   5.305   3.191  -8.049
  223   2HH2  ARG  28          HH22      ARG  28   5.430   3.755  -9.682
  224    H    ILE  29           HN       ILE  29  -2.471   5.570  -4.133
  225    HA   ILE  29           HA       ILE  29  -4.587   4.315  -5.521
  226    HB   ILE  29           HB       ILE  29  -4.544   5.818  -2.901
  227   1HG1  ILE  29          HG12      ILE  29  -3.230   3.554  -3.371
  228   2HG1  ILE  29          HG11      ILE  29  -4.129   3.763  -1.874
  229   1HG2  ILE  29          HG21      ILE  29  -6.738   4.239  -4.257
  230   2HG2  ILE  29          HG22      ILE  29  -6.822   5.862  -3.571
  231   3HG2  ILE  29          HG23      ILE  29  -6.695   4.461  -2.508
  232   1HD1  ILE  29          HD11      ILE  29  -5.853   2.340  -2.556
  233   2HD1  ILE  29          HD12      ILE  29  -4.441   1.564  -3.274
  234   3HD1  ILE  29          HD13      ILE  29  -5.500   2.562  -4.269
  235    H    GLN  30           HN       GLN  30  -4.100   7.684  -4.553
  236    HA   GLN  30           HA       GLN  30  -6.613   8.651  -5.525
  237   1HB   GLN  30          HB2       GLN  30  -4.002  10.073  -4.962
  238   2HB   GLN  30          HB1       GLN  30  -5.451  10.908  -5.512
  239   1HG   GLN  30          HG2       GLN  30  -6.672  10.260  -3.533
  240   2HG   GLN  30          HG1       GLN  30  -5.383   9.176  -3.018
  241   1HE2  GLN  30          HE21      GLN  30  -6.210  11.218  -1.265
  242   2HE2  GLN  30          HE22      GLN  30  -4.990  12.394  -1.160
  243    H    TYR  31           HN       TYR  31  -3.438   8.414  -7.185
  244    HA   TYR  31           HA       TYR  31  -4.362   9.792  -9.483
  245   1HB   TYR  31          HB2       TYR  31  -1.955   9.451  -9.108
  246   2HB   TYR  31          HB1       TYR  31  -2.170   7.706  -9.250
  247    HD1  TYR  31           HD1      TYR  31  -2.772   6.675 -11.413
  248    HD2  TYR  31           HD2      TYR  31  -2.019  10.892 -11.070
  249    HE1  TYR  31           HE1      TYR  31  -2.572   6.840 -13.880
  250    HE2  TYR  31           HE2      TYR  31  -1.820  11.056 -13.538
  251    HH   TYR  31           HH       TYR  31  -1.141   9.093 -15.463
  252    H    ALA  32           HN       ALA  32  -4.409   6.390  -8.551
  253    HA   ALA  32           HA       ALA  32  -5.356   5.430 -11.047
  254   1HB   ALA  32          HB1       ALA  32  -5.956   3.392  -9.688
  255   2HB   ALA  32          HB2       ALA  32  -5.404   4.273  -8.263
  256   3HB   ALA  32          HB3       ALA  32  -4.274   3.909  -9.567
  257    H    PHE  33           HN       PHE  33  -6.946   6.447  -8.064
  258    HA   PHE  33           HA       PHE  33  -9.600   6.189  -9.388
  259   1HB   PHE  33          HB2       PHE  33  -8.919   5.940  -6.454
  260   2HB   PHE  33          HB1       PHE  33 -10.536   5.844  -7.152
  261    HD1  PHE  33           HD1      PHE  33  -7.283   4.153  -6.810
  262    HD2  PHE  33           HD2      PHE  33 -11.219   3.930  -8.519
  263    HE1  PHE  33           HE1      PHE  33  -6.928   1.752  -7.318
  264    HE2  PHE  33           HE2      PHE  33 -10.863   1.527  -9.022
  265    HZ   PHE  33           HZ       PHE  33  -8.718   0.438  -8.421
  266    HA   PRO  34           HA       PRO  34  -8.947  10.685  -8.513
  267   1HB   PRO  34          HB2       PRO  34 -10.503  11.265 -10.882
  268   2HB   PRO  34          HB1       PRO  34  -8.784  11.555 -10.588
  269   1HG   PRO  34          HG2       PRO  34  -9.850   9.672 -12.348
  270   2HG   PRO  34          HG1       PRO  34  -8.180   9.724 -11.764
  271   1HD   PRO  34          HD2       PRO  34 -10.390   7.913 -10.954
  272   2HD   PRO  34          HD1       PRO  34  -8.632   7.670 -10.857
  273    H    ASP  35           HN       ASP  35 -11.776   8.828  -9.310
  274    HA   ASP  35           HA       ASP  35 -13.667  10.853  -8.420
  275   1HB   ASP  35          HB2       ASP  35 -14.016   8.097  -9.585
  276   2HB   ASP  35          HB1       ASP  35 -15.349   9.162  -9.137
  277    H    ASN  36           HN       ASN  36 -11.997   8.278  -6.801
  278    HA   ASN  36           HA       ASN  36 -14.206   8.132  -4.817
  279   1HB   ASN  36          HB2       ASN  36 -13.982   6.046  -5.994
  280   2HB   ASN  36          HB1       ASN  36 -12.268   5.970  -5.591
  281   1HD2  ASN  36          HD21      ASN  36 -15.523   6.013  -4.072
  282   2HD2  ASN  36          HD22      ASN  36 -15.037   5.207  -2.660
  283    H    GLU  37           HN       GLU  37 -13.590   8.735  -2.655
  284    HA   GLU  37           HA       GLU  37 -11.046   9.644  -1.978
  285   1HB   GLU  37          HB2       GLU  37 -13.130  10.217  -0.853
  286   2HB   GLU  37          HB1       GLU  37 -13.320   8.553  -0.320
  287   1HG   GLU  37          HG2       GLU  37 -11.232   8.738   1.009
  288   2HG   GLU  37          HG1       GLU  37 -11.039  10.412   0.483
  289    H    GLY  38           HN       GLY  38  -9.244   8.398  -1.579
  290   1HA   GLY  38          HA2       GLY  38  -9.576   5.518  -0.833
  291   2HA   GLY  38          HA1       GLY  38  -8.228   6.051  -1.589
  292    H    HIS  39           HN       HIS  39  -9.065   5.056   1.436
  293    HA   HIS  39           HA       HIS  39  -7.169   6.925   2.713
  294   1HB   HIS  39          HB2       HIS  39  -9.388   6.993   3.757
  295   2HB   HIS  39          HB1       HIS  39  -9.361   5.240   3.965
  296    HD1  HIS  39           HD1      HIS  39  -6.886   8.040   4.795
  297    HD2  HIS  39           HD2      HIS  39  -8.605   4.670   6.548
  298    HE1  HIS  39           HE1      HIS  39  -5.893   7.856   7.118
  299    H    VAL  40           HN       VAL  40  -5.216   5.956   3.202
  300    HA   VAL  40           HA       VAL  40  -5.099   3.015   3.239
  301    HB   VAL  40           HB       VAL  40  -2.920   5.019   2.630
  302   1HG1  VAL  40          HG11      VAL  40  -3.156   2.017   2.343
  303   2HG1  VAL  40          HG12      VAL  40  -2.019   2.907   3.355
  304   3HG1  VAL  40          HG13      VAL  40  -1.876   2.972   1.600
  305   1HG2  VAL  40          HG21      VAL  40  -4.751   3.435   0.798
  306   2HG2  VAL  40          HG22      VAL  40  -3.327   4.321   0.259
  307   3HG2  VAL  40          HG23      VAL  40  -4.694   5.190   0.959
  308    H    SER  41           HN       SER  41  -4.453   2.033   5.014
  309    HA   SER  41           HA       SER  41  -2.974   3.569   7.067
  310   1HB   SER  41          HB2       SER  41  -5.250   3.296   7.902
  311   2HB   SER  41          HB1       SER  41  -5.207   1.570   7.552
  312    HG   SER  41           HG       SER  41  -3.733   3.038   9.473
  313    H    VAL  42           HN       VAL  42  -1.304   2.569   8.053
  314    HA   VAL  42           HA       VAL  42  -0.776  -0.252   7.337
  315    HB   VAL  42           HB       VAL  42   1.366   1.883   7.364
  316   1HG1  VAL  42          HG11      VAL  42   2.245  -0.324   7.766
  317   2HG1  VAL  42          HG12      VAL  42   2.584   0.063   6.080
  318   3HG1  VAL  42          HG13      VAL  42   1.251  -1.016   6.485
  319   1HG2  VAL  42          HG21      VAL  42  -0.255   0.746   5.075
  320   2HG2  VAL  42          HG22      VAL  42   1.299   1.542   4.837
  321   3HG2  VAL  42          HG23      VAL  42  -0.057   2.440   5.517
  322    H    ARG  43           HN       ARG  43  -0.246  -1.494   8.987
  323    HA   ARG  43           HA       ARG  43   0.977  -0.332  11.369
  324   1HB   ARG  43          HB2       ARG  43  -0.751  -1.263  12.873
  325   2HB   ARG  43          HB1       ARG  43  -1.415  -0.042  11.787
  326   1HG   ARG  43          HG2       ARG  43  -2.204  -1.840  10.271
  327   2HG   ARG  43          HG1       ARG  43  -1.588  -3.046  11.399
  328   1HD   ARG  43          HD2       ARG  43  -3.071  -2.058  13.168
  329   2HD   ARG  43          HD1       ARG  43  -3.762  -1.005  11.936
  330    HE   ARG  43           HE       ARG  43  -4.030  -3.529  10.893
  331   1HH1  ARG  43          HH21      ARG  43  -5.981  -1.469  12.487
  332   2HH1  ARG  43          HH22      ARG  43  -6.927  -2.647  13.336
  333   1HH2  ARG  43          HH11      ARG  43  -4.809  -5.284  12.582
  334   2HH2  ARG  43          HH12      ARG  43  -6.266  -4.804  13.387
  335    H    TYR  44           HN       TYR  44   1.676  -2.030  12.927
  336    HA   TYR  44           HA       TYR  44   2.577  -4.438  11.499
  337   1HB   TYR  44          HB2       TYR  44   3.077  -3.506  14.342
  338   2HB   TYR  44          HB1       TYR  44   3.768  -4.944  13.612
  339    HD1  TYR  44           HD1      TYR  44   3.821  -1.272  13.680
  340    HD2  TYR  44           HD2      TYR  44   5.486  -4.805  11.911
  341    HE1  TYR  44           HE1      TYR  44   5.699   0.072  12.784
  342    HE2  TYR  44           HE2      TYR  44   7.372  -3.471  11.005
  343    HH   TYR  44           HH       TYR  44   8.474  -1.444  11.262
  344    H    ALA  45           HN       ALA  45   1.959  -6.489  11.871
  345    HA   ALA  45           HA       ALA  45  -0.046  -7.038  13.943
  346   1HB   ALA  45          HB1       ALA  45  -1.183  -6.477  11.717
  347   2HB   ALA  45          HB2       ALA  45  -1.587  -8.037  12.432
  348   3HB   ALA  45          HB3       ALA  45  -0.446  -7.953  11.091
  349    H    ALA  46           HN       ALA  46  -0.359  -9.485  14.112
  350    HA   ALA  46           HA       ALA  46   2.164 -10.704  14.374
  351   1HB   ALA  46          HB1       ALA  46   0.047 -11.385  15.599
  352   2HB   ALA  46          HB2       ALA  46   0.995 -12.725  14.955
  353   3HB   ALA  46          HB3       ALA  46  -0.462 -12.193  14.117
  354    H    ALA  47           HN       ALA  47   0.024 -10.508  11.609
  355    HA   ALA  47           HA       ALA  47   2.047 -12.019  10.077
  356   1HB   ALA  47          HB1       ALA  47   0.385 -13.338   8.955
  357   2HB   ALA  47          HB2       ALA  47  -0.924 -12.469   9.757
  358   3HB   ALA  47          HB3       ALA  47   0.136 -13.525  10.691
  359    H    ASN  48           HN       ASN  48   2.170 -11.567   7.859
  360    HA   ASN  48           HA       ASN  48   1.524  -8.864   7.078
  361   1HB   ASN  48          HB2       ASN  48   2.580  -9.441   4.997
  362   2HB   ASN  48          HB1       ASN  48   3.530 -10.162   6.294
  363   1HD2  ASN  48          HD21      ASN  48   3.348 -11.102   3.473
  364   2HD2  ASN  48          HD22      ASN  48   2.753 -12.689   3.552
  365    H    ASN  49           HN       ASN  49  -0.352  -8.178   6.086
  366    HA   ASN  49           HA       ASN  49  -1.956 -10.043   4.505
  367   1HB   ASN  49          HB2       ASN  49  -2.782 -10.397   6.794
  368   2HB   ASN  49          HB1       ASN  49  -3.070  -8.666   6.958
  369   1HD2  ASN  49          HD21      ASN  49  -4.090 -11.545   5.078
  370   2HD2  ASN  49          HD22      ASN  49  -5.609 -10.915   4.651
  371    H    LEU  50           HN       LEU  50  -3.428  -8.989   3.104
  372    HA   LEU  50           HA       LEU  50  -3.310  -6.025   3.021
  373   1HB   LEU  50          HB2       LEU  50  -1.948  -7.209   1.193
  374   2HB   LEU  50          HB1       LEU  50  -3.478  -7.862   0.611
  375    HG   LEU  50           HG       LEU  50  -4.246  -5.316   0.680
  376   1HD1  LEU  50          HD11      LEU  50  -1.918  -4.736   1.700
  377   2HD1  LEU  50          HD12      LEU  50  -2.563  -3.698   0.434
  378   3HD1  LEU  50          HD13      LEU  50  -1.325  -4.891   0.047
  379   1HD2  LEU  50          HD21      LEU  50  -2.485  -6.578  -1.442
  380   2HD2  LEU  50          HD22      LEU  50  -3.314  -5.041  -1.678
  381   3HD2  LEU  50          HD23      LEU  50  -4.248  -6.509  -1.400
  382    H    SER  51           HN       SER  51  -5.384  -5.205   3.256
  383    HA   SER  51           HA       SER  51  -7.653  -6.932   2.417
  384   1HB   SER  51          HB2       SER  51  -7.494  -6.785   4.854
  385   2HB   SER  51          HB1       SER  51  -7.466  -5.027   4.760
  386    HG   SER  51           HG       SER  51  -9.565  -6.613   4.851
  387    H    VAL  52           HN       VAL  52  -9.034  -5.987   0.971
  388    HA   VAL  52           HA       VAL  52  -8.994  -3.049   0.694
  389    HB   VAL  52           HB       VAL  52  -9.322  -5.084  -1.533
  390   1HG1  VAL  52          HG11      VAL  52  -9.387  -2.048  -1.519
  391   2HG1  VAL  52          HG12      VAL  52 -10.725  -3.123  -1.924
  392   3HG1  VAL  52          HG13      VAL  52  -9.316  -3.035  -2.979
  393   1HG2  VAL  52          HG21      VAL  52  -6.996  -4.915  -0.949
  394   2HG2  VAL  52          HG22      VAL  52  -7.105  -3.164  -0.771
  395   3HG2  VAL  52          HG23      VAL  52  -7.227  -3.897  -2.370
  396    H    ILE  53           HN       ILE  53 -10.965  -2.153   1.072
  397    HA   ILE  53           HA       ILE  53 -13.372  -3.885   0.847
  398    HB   ILE  53           HB       ILE  53 -12.810  -1.622   2.776
  399   1HG1  ILE  53          HG12      ILE  53 -11.726  -4.049   3.041
  400   2HG1  ILE  53          HG11      ILE  53 -12.379  -3.196   4.432
  401   1HG2  ILE  53          HG21      ILE  53 -15.248  -3.315   2.251
  402   2HG2  ILE  53          HG22      ILE  53 -15.127  -1.558   2.355
  403   3HG2  ILE  53          HG23      ILE  53 -14.985  -2.540   3.813
  404   1HD1  ILE  53          HD11      ILE  53 -14.392  -4.488   4.406
  405   2HD1  ILE  53          HD12      ILE  53 -13.072  -5.639   4.207
  406   3HD1  ILE  53          HD13      ILE  53 -14.035  -5.153   2.815
  407    H    GLY  54           HN       GLY  54 -14.921  -3.196  -0.532
  408   1HA   GLY  54          HA2       GLY  54 -16.369  -1.573  -1.490
  409   2HA   GLY  54          HA1       GLY  54 -15.203  -0.323  -1.063
  410    H    ALA  55           HN       ALA  55 -13.862  -3.108  -2.617
  411    HA   ALA  55           HA       ALA  55 -13.771  -1.609  -5.185
  412   1HB   ALA  55          HB1       ALA  55 -11.629  -1.609  -3.818
  413   2HB   ALA  55          HB2       ALA  55 -11.490  -2.209  -5.471
  414   3HB   ALA  55          HB3       ALA  55 -11.543  -3.344  -4.122
  415    H    THR  56           HN       THR  56 -13.277  -2.862  -7.064
  416    HA   THR  56           HA       THR  56 -14.746  -5.418  -7.273
  417    HB   THR  56           HB       THR  56 -14.368  -4.997  -9.670
  418    HG1  THR  56           HG1      THR  56 -12.412  -3.694  -9.127
  419   1HG2  THR  56          HG21      THR  56 -15.522  -2.601  -8.216
  420   2HG2  THR  56          HG22      THR  56 -16.386  -4.107  -8.527
  421   3HG2  THR  56          HG23      THR  56 -15.879  -3.087  -9.874
  422    H    LYS  57           HN       LYS  57 -13.821  -7.189  -8.285
  423    HA   LYS  57           HA       LYS  57 -11.348  -7.972  -7.303
  424   1HB   LYS  57          HB2       LYS  57 -12.804  -9.040  -9.741
  425   2HB   LYS  57          HB1       LYS  57 -11.506  -9.866  -8.887
  426   1HG   LYS  57          HG2       LYS  57 -12.909  -9.953  -6.836
  427   2HG   LYS  57          HG1       LYS  57 -14.205  -9.118  -7.699
  428   1HD   LYS  57          HD2       LYS  57 -14.345 -10.965  -9.303
  429   2HD   LYS  57          HD1       LYS  57 -13.010 -11.788  -8.495
  430   1HE   LYS  57          HE2       LYS  57 -15.697 -11.114  -7.262
  431   2HE   LYS  57          HE1       LYS  57 -15.143 -12.722  -7.732
  432   1HZ   LYS  57          HZ1       LYS  57 -13.331 -12.522  -6.146
  433   2HZ   LYS  57          HZ2       LYS  57 -14.832 -12.342  -5.368
  434   3HZ   LYS  57          HZ3       LYS  57 -13.869 -10.979  -5.690
  435    H    GLU  58           HN       GLU  58 -12.081  -6.533 -10.535
  436    HA   GLU  58           HA       GLU  58  -9.448  -6.928 -11.548
  437   1HB   GLU  58          HB2       GLU  58 -11.585  -4.907 -12.270
  438   2HB   GLU  58          HB1       GLU  58 -10.102  -5.174 -13.181
  439   1HG   GLU  58          HG2       GLU  58 -11.665  -6.505 -14.323
  440   2HG   GLU  58          HG1       GLU  58 -10.856  -7.662 -13.270
  441    H    ASP  59           HN       ASP  59 -11.008  -4.333  -9.699
  442    HA   ASP  59           HA       ASP  59  -8.902  -2.461  -9.912
  443   1HB   ASP  59          HB2       ASP  59 -11.024  -2.882  -7.793
  444   2HB   ASP  59          HB1       ASP  59  -9.892  -1.531  -7.773
  445    H    LYS  60           HN       LYS  60  -9.707  -5.014  -7.632
  446    HA   LYS  60           HA       LYS  60  -7.530  -4.602  -5.865
  447   1HB   LYS  60          HB2       LYS  60  -9.526  -5.950  -5.245
  448   2HB   LYS  60          HB1       LYS  60  -9.047  -7.173  -6.421
  449   1HG   LYS  60          HG2       LYS  60  -6.926  -7.523  -5.198
  450   2HG   LYS  60          HG1       LYS  60  -7.404  -6.298  -4.024
  451   1HD   LYS  60          HD2       LYS  60  -9.317  -7.640  -3.338
  452   2HD   LYS  60          HD1       LYS  60  -8.972  -8.828  -4.597
  453   1HE   LYS  60          HE2       LYS  60  -6.885  -9.440  -3.549
  454   2HE   LYS  60          HE1       LYS  60  -7.020  -8.114  -2.394
  455   1HZ   LYS  60          HZ1       LYS  60  -7.689 -10.359  -1.549
  456   2HZ   LYS  60          HZ2       LYS  60  -9.025 -10.286  -2.596
  457   3HZ   LYS  60          HZ3       LYS  60  -8.852  -9.139  -1.354
  458    H    GLN  61           HN       GLN  61  -7.727  -6.619  -8.817
  459    HA   GLN  61           HA       GLN  61  -5.161  -7.796  -8.410
  460   1HB   GLN  61          HB2       GLN  61  -6.819  -8.673 -10.049
  461   2HB   GLN  61          HB1       GLN  61  -6.617  -7.208 -11.009
  462   1HG   GLN  61          HG2       GLN  61  -4.308  -7.717 -11.447
  463   2HG   GLN  61          HG1       GLN  61  -4.323  -9.044 -10.286
  464   1HE2  GLN  61          HE21      GLN  61  -3.532  -9.683 -12.866
  465   2HE2  GLN  61          HE22      GLN  61  -4.753 -10.559 -13.655
  466    H    ARG  62           HN       ARG  62  -6.282  -4.829 -10.067
  467    HA   ARG  62           HA       ARG  62  -3.776  -4.077 -11.057
  468   1HB   ARG  62          HB2       ARG  62  -5.876  -3.028 -11.808
  469   2HB   ARG  62          HB1       ARG  62  -6.119  -2.343 -10.206
  470   1HG   ARG  62          HG2       ARG  62  -5.212  -0.638 -11.692
  471   2HG   ARG  62          HG1       ARG  62  -4.014  -1.043 -10.471
  472   1HD   ARG  62          HD2       ARG  62  -2.716  -2.306 -12.015
  473   2HD   ARG  62          HD1       ARG  62  -4.027  -2.358 -13.192
  474    HE   ARG  62           HE       ARG  62  -3.338   0.336 -12.701
  475   1HH1  ARG  62          HH11      ARG  62  -0.829  -1.683 -13.056
  476   2HH1  ARG  62          HH12      ARG  62  -0.381  -1.234 -14.668
  477   1HH2  ARG  62          HH21      ARG  62  -3.293   0.556 -15.262
  478   2HH2  ARG  62          HH22      ARG  62  -1.777   0.034 -15.919
  479    H    ILE  63           HN       ILE  63  -5.367  -3.345  -7.991
  480    HA   ILE  63           HA       ILE  63  -3.313  -1.702  -6.988
  481    HB   ILE  63           HB       ILE  63  -5.386  -3.359  -5.587
  482   1HG1  ILE  63          HG12      ILE  63  -5.108  -0.358  -5.798
  483   2HG1  ILE  63          HG11      ILE  63  -6.025  -1.318  -6.958
  484   1HG2  ILE  63          HG21      ILE  63  -3.709  -3.222  -3.932
  485   2HG2  ILE  63          HG22      ILE  63  -4.758  -1.850  -3.579
  486   3HG2  ILE  63          HG23      ILE  63  -3.234  -1.600  -4.430
  487   1HD1  ILE  63          HD11      ILE  63  -6.528  -1.262  -3.968
  488   2HD1  ILE  63          HD12      ILE  63  -7.468  -2.156  -5.161
  489   3HD1  ILE  63          HD13      ILE  63  -7.480  -0.393  -5.170
  490    H    SER  64           HN       SER  64  -3.704  -5.198  -6.744
  491    HA   SER  64           HA       SER  64  -1.434  -5.631  -5.088
  492   1HB   SER  64          HB2       SER  64  -3.106  -7.404  -5.634
  493   2HB   SER  64          HB1       SER  64  -2.500  -7.430  -7.287
  494    HG   SER  64           HG       SER  64  -1.459  -8.515  -5.004
  495    H    GLU  65           HN       GLU  65  -1.779  -5.432  -8.694
  496    HA   GLU  65           HA       GLU  65   0.922  -5.945  -9.253
  497   1HB   GLU  65          HB2       GLU  65  -1.165  -4.380 -10.790
  498   2HB   GLU  65          HB1       GLU  65   0.446  -4.734 -11.421
  499   1HG   GLU  65          HG2       GLU  65   0.047  -7.143 -11.138
  500   2HG   GLU  65          HG1       GLU  65  -1.552  -6.811 -10.476
  501    H    ILE  66           HN       ILE  66  -0.751  -2.873  -8.581
  502    HA   ILE  66           HA       ILE  66   1.446  -1.173  -9.057
  503    HB   ILE  66           HB       ILE  66  -0.907  -0.871  -7.176
  504   1HG1  ILE  66          HG12      ILE  66  -0.274   0.448  -9.834
  505   2HG1  ILE  66          HG11      ILE  66  -1.301  -0.976  -9.670
  506   1HG2  ILE  66          HG21      ILE  66   0.823   0.572  -6.310
  507   2HG2  ILE  66          HG22      ILE  66  -0.250   1.593  -7.259
  508   3HG2  ILE  66          HG23      ILE  66   1.294   1.076  -7.933
  509   1HD1  ILE  66          HD11      ILE  66  -2.741   0.343  -8.074
  510   2HD1  ILE  66          HD12      ILE  66  -2.740   0.968  -9.723
  511   3HD1  ILE  66          HD13      ILE  66  -1.782   1.767  -8.476
  512    H    LEU  67           HN       LEU  67   0.374  -2.786  -6.098
  513    HA   LEU  67           HA       LEU  67   2.353  -1.742  -4.386
  514   1HB   LEU  67          HB2       LEU  67   0.522  -2.884  -3.354
  515   2HB   LEU  67          HB1       LEU  67   0.743  -4.307  -4.363
  516    HG   LEU  67           HG       LEU  67   2.930  -4.749  -3.208
  517   1HD1  LEU  67          HD11      LEU  67   2.089  -2.278  -1.678
  518   2HD1  LEU  67          HD12      LEU  67   3.662  -2.648  -2.393
  519   3HD1  LEU  67          HD13      LEU  67   3.136  -3.491  -0.941
  520   1HD2  LEU  67          HD21      LEU  67   0.611  -4.443  -1.279
  521   2HD2  LEU  67          HD22      LEU  67   1.930  -5.610  -1.184
  522   3HD2  LEU  67          HD23      LEU  67   0.732  -5.735  -2.473
  523    H    GLN  68           HN       GLN  68   2.312  -4.557  -6.524
  524    HA   GLN  68           HA       GLN  68   4.869  -5.548  -5.763
  525   1HB   GLN  68          HB2       GLN  68   3.319  -5.801  -8.351
  526   2HB   GLN  68          HB1       GLN  68   4.828  -6.652  -8.019
  527   1HG   GLN  68          HG2       GLN  68   2.387  -6.835  -6.241
  528   2HG   GLN  68          HG1       GLN  68   2.742  -7.991  -7.521
  529   1HE2  GLN  68          HE21      GLN  68   2.639  -8.667  -4.692
  530   2HE2  GLN  68          HE22      GLN  68   4.197  -9.163  -4.235
  531    H    GLU  69           HN       GLU  69   3.950  -3.406  -8.520
  532    HA   GLU  69           HA       GLU  69   6.567  -3.017  -9.415
  533   1HB   GLU  69          HB2       GLU  69   4.147  -1.226  -9.623
  534   2HB   GLU  69          HB1       GLU  69   5.662  -0.952 -10.486
  535   1HG   GLU  69          HG2       GLU  69   5.465  -3.169 -11.546
  536   2HG   GLU  69          HG1       GLU  69   3.951  -3.446 -10.687
  537    H    THR  70           HN       THR  70   4.720  -1.056  -7.069
  538    HA   THR  70           HA       THR  70   6.653   0.952  -6.718
  539    HB   THR  70           HB       THR  70   4.692  -0.156  -4.742
  540    HG1  THR  70           HG1      THR  70   3.936   0.726  -6.811
  541   1HG2  THR  70          HG21      THR  70   6.386   2.324  -4.785
  542   2HG2  THR  70          HG22      THR  70   6.233   1.126  -3.497
  543   3HG2  THR  70          HG23      THR  70   4.901   2.232  -3.836
  544    H    TRP  71           HN       TRP  71   6.036  -2.006  -4.974
  545    HA   TRP  71           HA       TRP  71   8.077  -1.894  -3.118
  546   1HB   TRP  71          HB2       TRP  71   6.220  -3.377  -2.905
  547   2HB   TRP  71          HB1       TRP  71   6.616  -4.168  -4.419
  548    HD1  TRP  71           HD1      TRP  71   7.516  -6.472  -3.956
  549    HE1  TRP  71           HE1      TRP  71   9.079  -7.557  -2.222
  550    HE3  TRP  71           HE3      TRP  71   8.457  -2.439  -0.936
  551    HZ2  TRP  71           HZ2      TRP  71  10.512  -6.832   0.135
  552    HZ3  TRP  71           HZ3      TRP  71   9.909  -2.682   1.050
  553    HH2  TRP  71           HH2      TRP  71  10.935  -4.870   1.592
  554    H    GLU  72           HN       GLU  72   8.097  -3.125  -6.399
  555    HA   GLU  72           HA       GLU  72  10.793  -4.077  -6.273
  556   1HB   GLU  72          HB2       GLU  72   8.887  -3.634  -8.573
  557   2HB   GLU  72          HB1       GLU  72  10.530  -4.232  -8.812
  558   1HG   GLU  72          HG2       GLU  72  10.070  -6.119  -7.296
  559   2HG   GLU  72          HG1       GLU  72   8.432  -5.524  -7.043
  560    H    SER  73           HN       SER  73   9.505  -0.910  -6.765
  561    HA   SER  73           HA       SER  73  12.072  -0.042  -7.990
  562   1HB   SER  73          HB2       SER  73   9.327   1.202  -7.972
  563   2HB   SER  73          HB1       SER  73  10.772   2.088  -8.457
  564    HG   SER  73           HG       SER  73  10.763  -0.316  -9.625
  565    H    ALA  74           HN       ALA  74  11.416  -0.621  -5.068
  566    HA   ALA  74           HA       ALA  74  11.168   1.534  -3.471
  567   1HB   ALA  74          HB1       ALA  74  11.252  -0.800  -2.751
  568   2HB   ALA  74          HB2       ALA  74  12.301   0.236  -1.781
  569   3HB   ALA  74          HB3       ALA  74  12.997  -0.807  -3.021
  570    H    ASP  75           HN       ASP  75  14.194   0.658  -5.075
  571    HA   ASP  75           HA       ASP  75  15.862   2.315  -3.470
  572   1HB   ASP  75          HB2       ASP  75  16.188   1.143  -6.222
  573   2HB   ASP  75          HB1       ASP  75  17.443   2.099  -5.437
  574    H    ASP  76           HN       ASP  76  13.656   3.148  -6.022
  575    HA   ASP  76           HA       ASP  76  15.062   5.665  -6.627
  576   1HB   ASP  76          HB2       ASP  76  12.583   4.355  -7.748
  577   2HB   ASP  76          HB1       ASP  76  13.137   5.956  -8.233
  578    H    TRP  77           HN       TRP  77  11.903   4.704  -5.239
  579    HA   TRP  77           HA       TRP  77  11.346   7.538  -4.670
  580   1HB   TRP  77          HB2       TRP  77   9.145   6.922  -4.222
  581   2HB   TRP  77          HB1       TRP  77   9.635   5.948  -5.591
  582    HD1  TRP  77           HD1      TRP  77   9.797   3.322  -5.261
  583    HE1  TRP  77           HE1      TRP  77   9.068   1.748  -3.385
  584    HE3  TRP  77           HE3      TRP  77   8.997   6.710  -1.411
  585    HZ2  TRP  77           HZ2      TRP  77   8.256   1.849  -0.681
  586    HZ3  TRP  77           HZ3      TRP  77   8.224   5.879   0.754
  587    HH2  TRP  77           HH2      TRP  77   7.855   3.476   1.132
  588    H    PHE  78           HN       PHE  78  12.605   4.848  -2.844
  589    HA   PHE  78           HA       PHE  78  11.747   6.093  -0.311
  590   1HB   PHE  78          HB2       PHE  78  11.649   3.707  -0.270
  591   2HB   PHE  78          HB1       PHE  78  13.290   3.566  -0.877
  592    HD1  PHE  78           HD1      PHE  78  15.239   3.991   0.556
  593    HD2  PHE  78           HD2      PHE  78  11.230   4.479   2.061
  594    HE1  PHE  78           HE1      PHE  78  16.119   4.151   2.860
  595    HE2  PHE  78           HE2      PHE  78  12.128   4.623   4.364
  596    HZ   PHE  78           HZ       PHE  78  14.567   4.459   4.766
  597    H    VAL  79           HN       VAL  79  12.884   7.446   0.793
  598    HA   VAL  79           HA       VAL  79  15.741   7.853   0.166
  599    HB   VAL  79           HB       VAL  79  15.232  10.266   0.725
  600   1HG1  VAL  79          HG11      VAL  79  15.443   9.552  -1.597
  601   2HG1  VAL  79          HG12      VAL  79  14.092  10.678  -1.472
  602   3HG1  VAL  79          HG13      VAL  79  13.786   8.945  -1.591
  603   1HG2  VAL  79          HG21      VAL  79  12.959  11.005   0.831
  604   2HG2  VAL  79          HG22      VAL  79  13.049   9.628   1.926
  605   3HG2  VAL  79          HG23      VAL  79  12.345   9.432   0.318
  606    H    SER  80           HN       SER  80  17.088   8.475   2.064
  607    HA   SER  80           HA       SER  80  15.733   8.390   4.682
  608   1HB   SER  80          HB2       SER  80  16.523   6.064   4.176
  609   2HB   SER  80          HB1       SER  80  18.165   6.692   4.029
  610    HG   SER  80           HG       SER  80  17.832   7.546   6.198
  611    H    GLU  81           HN       GLU  81  16.574   9.786   6.110
  612    HA   GLU  81           HA       GLU  81  18.450  11.736   5.226
  613   1HB   GLU  81          HB2       GLU  81  17.429  11.164   8.020
  614   2HB   GLU  81          HB1       GLU  81  18.292  12.618   7.521
  615   1HG   GLU  81          HG2       GLU  81  16.505  13.126   5.898
  616   2HG   GLU  81          HG1       GLU  81  15.639  11.674   6.395
  Start of MODEL   12
    1   1H    MET   1          HT1       MET   1 -13.431   4.531  -0.180
    2   2H    MET   1          HT2       MET   1 -14.871   3.644  -0.351
    3   3H    MET   1          HT3       MET   1 -13.981   4.100  -1.726
    4    HA   MET   1           HA       MET   1 -13.814   1.717  -0.410
    5   1HB   MET   1          HB2       MET   1 -11.942   1.320  -1.963
    6   2HB   MET   1          HB1       MET   1 -13.266   2.165  -2.766
    7   1HG   MET   1          HG2       MET   1 -12.057   4.331  -2.267
    8   2HG   MET   1          HG1       MET   1 -10.682   3.366  -1.734
    9   1HE   MET   1          HE1       MET   1  -8.778   2.333  -4.082
   10   2HE   MET   1          HE2       MET   1  -9.942   1.095  -4.543
   11   3HE   MET   1          HE3       MET   1  -9.781   1.550  -2.853
   12    H    ARG   2           HN       ARG   2 -12.318   0.763   1.001
   13    HA   ARG   2           HA       ARG   2 -10.286   2.570   2.199
   14   1HB   ARG   2          HB2       ARG   2 -12.035   0.536   3.608
   15   2HB   ARG   2          HB1       ARG   2 -10.696   1.404   4.361
   16   1HG   ARG   2          HG2       ARG   2 -11.804   3.557   3.811
   17   2HG   ARG   2          HG1       ARG   2 -13.162   2.665   3.125
   18   1HD   ARG   2          HD2       ARG   2 -13.508   1.564   5.335
   19   2HD   ARG   2          HD1       ARG   2 -12.215   2.556   6.001
   20    HE   ARG   2           HE       ARG   2 -14.909   3.416   5.397
   21   1HH1  ARG   2          HH21      ARG   2 -13.185   4.338   7.734
   22   2HH1  ARG   2          HH22      ARG   2 -12.856   5.981   7.295
   23   1HH2  ARG   2          HH11      ARG   2 -13.803   5.566   3.985
   24   2HH2  ARG   2          HH12      ARG   2 -13.203   6.674   5.173
   25    H    ILE   3           HN       ILE   3  -8.282   1.796   2.320
   26    HA   ILE   3           HA       ILE   3  -7.804  -1.065   1.636
   27    HB   ILE   3           HB       ILE   3  -6.150   1.383   1.009
   28   1HG1  ILE   3          HG12      ILE   3  -7.554  -0.590  -0.816
   29   2HG1  ILE   3          HG11      ILE   3  -8.266   0.946  -0.323
   30   1HG2  ILE   3          HG21      ILE   3  -5.660  -1.584   0.691
   31   2HG2  ILE   3          HG22      ILE   3  -4.592  -0.367   1.386
   32   3HG2  ILE   3          HG23      ILE   3  -4.869  -0.405  -0.354
   33   1HD1  ILE   3          HD11      ILE   3  -7.044   0.979  -2.549
   34   2HD1  ILE   3          HD12      ILE   3  -5.552   0.745  -1.638
   35   3HD1  ILE   3          HD13      ILE   3  -6.522   2.197  -1.384
   36    H    GLU   4           HN       GLU   4  -6.819  -2.189   3.235
   37    HA   GLU   4           HA       GLU   4  -5.140  -0.717   5.215
   38   1HB   GLU   4          HB2       GLU   4  -7.271  -1.385   6.232
   39   2HB   GLU   4          HB1       GLU   4  -6.993  -3.059   5.754
   40   1HG   GLU   4          HG2       GLU   4  -5.007  -3.179   7.165
   41   2HG   GLU   4          HG1       GLU   4  -5.151  -1.466   7.562
   42    H    VAL   5           HN       VAL   5  -3.145  -1.403   5.470
   43    HA   VAL   5           HA       VAL   5  -2.395  -4.094   4.430
   44    HB   VAL   5           HB       VAL   5  -0.658  -1.623   4.501
   45   1HG1  VAL   5          HG11      VAL   5   0.598  -3.709   4.609
   46   2HG1  VAL   5          HG12      VAL   5   0.776  -3.010   3.001
   47   3HG1  VAL   5          HG13      VAL   5  -0.320  -4.367   3.255
   48   1HG2  VAL   5          HG21      VAL   5  -2.489  -2.746   2.394
   49   2HG2  VAL   5          HG22      VAL   5  -0.988  -1.978   1.889
   50   3HG2  VAL   5          HG23      VAL   5  -2.178  -1.067   2.817
   51    H    THR   6           HN       THR   6  -1.330  -5.441   5.740
   52    HA   THR   6           HA       THR   6  -0.277  -4.396   8.317
   53    HB   THR   6           HB       THR   6  -0.810  -6.699   9.195
   54    HG1  THR   6           HG1      THR   6  -1.480  -8.066   7.779
   55   1HG2  THR   6          HG21      THR   6  -3.115  -4.996   8.214
   56   2HG2  THR   6          HG22      THR   6  -2.209  -4.748   9.708
   57   3HG2  THR   6          HG23      THR   6  -3.207  -6.189   9.510
   58    H    ILE   7           HN       ILE   7   1.721  -4.914   8.831
   59    HA   ILE   7           HA       ILE   7   3.240  -6.769   7.084
   60    HB   ILE   7           HB       ILE   7   3.886  -4.140   8.391
   61   1HG1  ILE   7          HG12      ILE   7   4.468  -5.199   5.606
   62   2HG1  ILE   7          HG11      ILE   7   2.998  -4.323   6.030
   63   1HG2  ILE   7          HG21      ILE   7   5.780  -6.387   7.670
   64   2HG2  ILE   7          HG22      ILE   7   5.813  -5.315   9.072
   65   3HG2  ILE   7          HG23      ILE   7   6.309  -4.711   7.493
   66   1HD1  ILE   7          HD11      ILE   7   5.732  -3.182   6.598
   67   2HD1  ILE   7          HD12      ILE   7   4.188  -2.336   6.518
   68   3HD1  ILE   7          HD13      ILE   7   4.938  -2.946   5.043
   69    H    ALA   8           HN       ALA   8   4.265  -8.441   8.056
   70    HA   ALA   8           HA       ALA   8   3.742  -9.106  10.750
   71   1HB   ALA   8          HB1       ALA   8   5.658 -10.196   8.690
   72   2HB   ALA   8          HB2       ALA   8   4.104 -10.866   9.190
   73   3HB   ALA   8          HB3       ALA   8   5.478 -10.908  10.293
   74    H    LYS   9           HN       LYS   9   4.764  -8.821  12.470
   75    HA   LYS   9           HA       LYS   9   6.750  -6.868  12.811
   76   1HB   LYS   9          HB2       LYS   9   5.673  -9.027  14.649
   77   2HB   LYS   9          HB1       LYS   9   6.909  -7.904  15.206
   78   1HG   LYS   9          HG2       LYS   9   5.383  -6.012  14.857
   79   2HG   LYS   9          HG1       LYS   9   4.159  -7.095  14.176
   80   1HD   LYS   9          HD2       LYS   9   4.051  -8.305  16.323
   81   2HD   LYS   9          HD1       LYS   9   5.264  -7.217  16.996
   82   1HE   LYS   9          HE2       LYS   9   3.786  -5.310  16.720
   83   2HE   LYS   9          HE1       LYS   9   2.602  -6.305  15.873
   84   1HZ   LYS   9          HZ1       LYS   9   2.164  -5.888  18.301
   85   2HZ   LYS   9          HZ2       LYS   9   3.490  -6.896  18.636
   86   3HZ   LYS   9          HZ3       LYS   9   2.136  -7.512  17.815
   87    H    THR  10           HN       THR  10   7.105 -10.262  12.168
   88    HA   THR  10           HA       THR  10   9.734 -10.595  13.151
   89    HB   THR  10           HB       THR  10   9.855 -12.412  11.403
   90    HG1  THR  10           HG1      THR  10   8.534 -12.105   9.815
   91   1HG2  THR  10          HG21      THR  10   8.343 -13.849  12.562
   92   2HG2  THR  10          HG22      THR  10   7.281 -12.509  12.989
   93   3HG2  THR  10          HG23      THR  10   8.863 -12.656  13.751
   94    H    SER  11           HN       SER  11   8.478  -8.638  10.669
   95    HA   SER  11           HA       SER  11  11.158  -8.354   9.407
   96   1HB   SER  11          HB2       SER  11   9.580  -9.282   7.813
   97   2HB   SER  11          HB1       SER  11   8.400  -8.035   8.201
   98    HG   SER  11           HG       SER  11  10.008  -6.503   7.480
   99    HA   PRO  12           HA       PRO  12  10.007  -4.222  11.244
  100   1HB   PRO  12          HB2       PRO  12  12.662  -4.053  12.372
  101   2HB   PRO  12          HB1       PRO  12  11.135  -4.253  13.249
  102   1HG   PRO  12          HG2       PRO  12  13.125  -6.167  13.104
  103   2HG   PRO  12          HG1       PRO  12  11.426  -6.498  13.483
  104   1HD   PRO  12          HD2       PRO  12  12.885  -6.871  10.885
  105   2HD   PRO  12          HD1       PRO  12  11.604  -7.853  11.617
  106    H    LEU  13           HN       LEU  13  10.130  -2.395  10.308
  107    HA   LEU  13           HA       LEU  13  12.235  -2.025   8.270
  108   1HB   LEU  13          HB2       LEU  13   9.409  -1.011   8.566
  109   2HB   LEU  13          HB1       LEU  13  10.539  -0.258   7.454
  110    HG   LEU  13           HG       LEU  13  10.169  -3.251   7.360
  111   1HD1  LEU  13          HD11      LEU  13   7.886  -2.533   7.238
  112   2HD1  LEU  13          HD12      LEU  13   8.403  -2.842   5.583
  113   3HD1  LEU  13          HD13      LEU  13   8.296  -1.185   6.173
  114   1HD2  LEU  13          HD21      LEU  13  11.946  -2.118   5.990
  115   2HD2  LEU  13          HD22      LEU  13  10.682  -1.201   5.172
  116   3HD2  LEU  13          HD23      LEU  13  10.748  -2.954   5.008
  117    HA   PRO  14           HA       PRO  14  14.054   1.147  10.654
  118   1HB   PRO  14          HB2       PRO  14  14.195   3.211   8.610
  119   2HB   PRO  14          HB1       PRO  14  15.500   2.174   9.208
  120   1HG   PRO  14          HG2       PRO  14  14.048   1.986   6.719
  121   2HG   PRO  14          HG1       PRO  14  15.440   1.040   7.260
  122   1HD   PRO  14          HD2       PRO  14  12.768   0.108   6.994
  123   2HD   PRO  14          HD1       PRO  14  14.117  -0.757   7.750
  124    H    ALA  15           HN       ALA  15  13.673   2.949  11.792
  125    HA   ALA  15           HA       ALA  15  11.070   3.602  12.480
  126   1HB   ALA  15          HB1       ALA  15  12.017   5.228  13.921
  127   2HB   ALA  15          HB2       ALA  15  13.450   5.392  12.905
  128   3HB   ALA  15          HB3       ALA  15  13.180   3.906  13.816
  129    H    GLY  16           HN       GLY  16  10.944   4.006   9.719
  130   1HA   GLY  16          HA2       GLY  16   9.838   6.620   9.565
  131   2HA   GLY  16          HA1       GLY  16  11.381   6.610   8.766
  132    H    ALA  17           HN       ALA  17  10.869   3.654   8.154
  133    HA   ALA  17           HA       ALA  17  10.005   4.136   5.489
  134   1HB   ALA  17          HB1       ALA  17  11.345   2.319   5.264
  135   2HB   ALA  17          HB2       ALA  17   9.985   1.354   5.836
  136   3HB   ALA  17          HB3       ALA  17  11.199   1.934   6.976
  137    H    ILE  18           HN       ILE  18   8.209   2.750   8.187
  138    HA   ILE  18           HA       ILE  18   6.080   1.817   6.606
  139    HB   ILE  18           HB       ILE  18   6.140   2.846   9.448
  140   1HG1  ILE  18          HG12      ILE  18   7.307   0.630   8.609
  141   2HG1  ILE  18          HG11      ILE  18   6.362   0.613  10.087
  142   1HG2  ILE  18          HG21      ILE  18   3.893   1.616   9.612
  143   2HG2  ILE  18          HG22      ILE  18   3.854   1.681   7.850
  144   3HG2  ILE  18          HG23      ILE  18   3.879   3.175   8.786
  145   1HD1  ILE  18          HD11      ILE  18   5.078  -0.063   7.446
  146   2HD1  ILE  18          HD12      ILE  18   4.547  -0.491   9.069
  147   3HD1  ILE  18          HD13      ILE  18   5.957  -1.279   8.367
  148    H    ASP  19           HN       ASP  19   6.564   4.966   8.200
  149    HA   ASP  19           HA       ASP  19   4.169   6.141   7.206
  150   1HB   ASP  19          HB2       ASP  19   5.621   7.090   9.083
  151   2HB   ASP  19          HB1       ASP  19   6.742   7.620   7.830
  152    H    ALA  20           HN       ALA  20   7.413   5.871   5.804
  153    HA   ALA  20           HA       ALA  20   6.806   7.573   3.636
  154   1HB   ALA  20          HB1       ALA  20   8.770   5.310   3.366
  155   2HB   ALA  20          HB2       ALA  20   9.122   6.669   4.429
  156   3HB   ALA  20          HB3       ALA  20   8.859   6.946   2.706
  157    H    LEU  21           HN       LEU  21   6.501   4.083   4.079
  158    HA   LEU  21           HA       LEU  21   5.784   3.385   1.486
  159   1HB   LEU  21          HB2       LEU  21   6.456   1.713   3.064
  160   2HB   LEU  21          HB1       LEU  21   5.193   2.180   4.195
  161    HG   LEU  21           HG       LEU  21   3.493   1.408   2.600
  162   1HD1  LEU  21          HD11      LEU  21   4.561   1.710   0.469
  163   2HD1  LEU  21          HD12      LEU  21   4.338  -0.025   0.663
  164   3HD1  LEU  21          HD13      LEU  21   5.921   0.696   0.943
  165   1HD2  LEU  21          HD21      LEU  21   4.154  -1.061   2.674
  166   2HD2  LEU  21          HD22      LEU  21   4.158  -0.209   4.217
  167   3HD2  LEU  21          HD23      LEU  21   5.678  -0.522   3.380
  168    H    ALA  22           HN       ALA  22   3.784   4.216   4.283
  169    HA   ALA  22           HA       ALA  22   1.254   3.929   3.028
  170   1HB   ALA  22          HB1       ALA  22   1.759   4.200   5.538
  171   2HB   ALA  22          HB2       ALA  22   0.373   5.090   4.909
  172   3HB   ALA  22          HB3       ALA  22   1.897   5.926   5.203
  173    H    GLY  23           HN       GLY  23   3.482   6.687   3.172
  174   1HA   GLY  23          HA2       GLY  23   1.675   8.499   1.882
  175   2HA   GLY  23          HA1       GLY  23   3.436   8.663   2.073
  176    H    GLU  24           HN       GLU  24   4.316   6.405   0.605
  177    HA   GLU  24           HA       GLU  24   3.985   7.390  -2.016
  178   1HB   GLU  24          HB2       GLU  24   5.889   5.824  -0.930
  179   2HB   GLU  24          HB1       GLU  24   4.888   4.543  -1.611
  180   1HG   GLU  24          HG2       GLU  24   6.183   6.845  -3.094
  181   2HG   GLU  24          HG1       GLU  24   6.507   5.125  -3.292
  182    H    LEU  25           HN       LEU  25   2.489   4.673  -0.334
  183    HA   LEU  25           HA       LEU  25   1.148   3.632  -2.577
  184   1HB   LEU  25          HB2       LEU  25   0.480   3.478   0.358
  185   2HB   LEU  25          HB1       LEU  25  -0.429   2.614  -0.878
  186    HG   LEU  25           HG       LEU  25   2.559   2.353  -0.470
  187   1HD1  LEU  25          HD11      LEU  25   0.258   0.627   0.486
  188   2HD1  LEU  25          HD12      LEU  25   1.441   1.469   1.483
  189   3HD1  LEU  25          HD13      LEU  25   1.943   0.102   0.491
  190   1HD2  LEU  25          HD21      LEU  25   2.253   1.589  -2.646
  191   2HD2  LEU  25          HD22      LEU  25   0.575   1.129  -2.367
  192   3HD2  LEU  25          HD23      LEU  25   1.882   0.106  -1.778
  193    H    SER  26           HN       SER  26   0.102   6.063  -0.227
  194    HA   SER  26           HA       SER  26  -2.567   6.281  -1.091
  195   1HB   SER  26          HB2       SER  26  -1.796   7.294   0.994
  196   2HB   SER  26          HB1       SER  26  -0.757   8.398   0.097
  197    HG   SER  26           HG       SER  26  -2.634   9.248  -0.874
  198    H    ARG  27           HN       ARG  27   0.339   8.094  -2.149
  199    HA   ARG  27           HA       ARG  27  -1.021   9.790  -3.958
  200   1HB   ARG  27          HB2       ARG  27   1.309  10.189  -3.247
  201   2HB   ARG  27          HB1       ARG  27   1.818   8.735  -4.109
  202   1HG   ARG  27          HG2       ARG  27   1.142   9.686  -6.235
  203   2HG   ARG  27          HG1       ARG  27   0.431  11.086  -5.428
  204   1HD   ARG  27          HD2       ARG  27   2.651  11.733  -4.581
  205   2HD   ARG  27          HD1       ARG  27   3.364  10.326  -5.360
  206    HE   ARG  27           HE       ARG  27   3.247  11.449  -7.394
  207   1HH1  ARG  27          HH11      ARG  27   1.760  13.255  -4.857
  208   2HH1  ARG  27          HH12      ARG  27   1.258  14.554  -5.886
  209   1HH2  ARG  27          HH21      ARG  27   2.406  13.058  -8.792
  210   2HH2  ARG  27          HH22      ARG  27   1.622  14.443  -8.110
  211    H    ARG  28           HN       ARG  28   0.371   6.551  -4.384
  212    HA   ARG  28           HA       ARG  28  -0.081   6.332  -7.164
  213   1HB   ARG  28          HB2       ARG  28   0.043   4.248  -4.978
  214   2HB   ARG  28          HB1       ARG  28  -0.060   3.860  -6.690
  215   1HG   ARG  28          HG2       ARG  28   2.097   5.695  -5.665
  216   2HG   ARG  28          HG1       ARG  28   2.290   3.947  -5.587
  217   1HD   ARG  28          HD2       ARG  28   1.825   3.857  -8.063
  218   2HD   ARG  28          HD1       ARG  28   1.865   5.617  -8.084
  219    HE   ARG  28           HE       ARG  28   4.212   4.496  -6.871
  220   1HH1  ARG  28          HH21      ARG  28   2.740   5.831  -9.674
  221   2HH1  ARG  28          HH22      ARG  28   4.162   5.723 -10.655
  222   1HH2  ARG  28          HH11      ARG  28   6.034   4.094  -8.231
  223   2HH2  ARG  28          HH12      ARG  28   6.028   4.741  -9.839
  224    H    ILE  29           HN       ILE  29  -2.105   5.607  -4.370
  225    HA   ILE  29           HA       ILE  29  -4.216   4.365  -5.775
  226    HB   ILE  29           HB       ILE  29  -4.127   5.759  -3.104
  227   1HG1  ILE  29          HG12      ILE  29  -2.813   3.598  -3.545
  228   2HG1  ILE  29          HG11      ILE  29  -3.905   3.588  -2.170
  229   1HG2  ILE  29          HG21      ILE  29  -6.382   4.310  -4.482
  230   2HG2  ILE  29          HG22      ILE  29  -6.409   5.891  -3.701
  231   3HG2  ILE  29          HG23      ILE  29  -6.292   4.427  -2.725
  232   1HD1  ILE  29          HD11      ILE  29  -5.610   2.434  -3.655
  233   2HD1  ILE  29          HD12      ILE  29  -4.156   1.501  -3.352
  234   3HD1  ILE  29          HD13      ILE  29  -4.363   2.316  -4.890
  235    H    GLN  30           HN       GLN  30  -3.739   7.699  -4.721
  236    HA   GLN  30           HA       GLN  30  -6.232   8.723  -5.645
  237   1HB   GLN  30          HB2       GLN  30  -4.819   9.978  -4.072
  238   2HB   GLN  30          HB1       GLN  30  -3.554  10.107  -5.293
  239   1HG   GLN  30          HG2       GLN  30  -4.955  11.475  -6.707
  240   2HG   GLN  30          HG1       GLN  30  -6.361  11.187  -5.683
  241   1HE2  GLN  30          HE21      GLN  30  -3.442  13.089  -6.040
  242   2HE2  GLN  30          HE22      GLN  30  -3.686  14.063  -4.672
  243    H    TYR  31           HN       TYR  31  -3.078   8.467  -7.336
  244    HA   TYR  31           HA       TYR  31  -4.036   9.815  -9.632
  245   1HB   TYR  31          HB2       TYR  31  -1.623   9.531  -9.222
  246   2HB   TYR  31          HB1       TYR  31  -1.795   7.784  -9.402
  247    HD1  TYR  31           HD1      TYR  31  -2.215  11.032 -11.186
  248    HD2  TYR  31           HD2      TYR  31  -1.827   6.769 -11.557
  249    HE1  TYR  31           HE1      TYR  31  -1.988  11.268 -13.642
  250    HE2  TYR  31           HE2      TYR  31  -1.599   7.008 -14.015
  251    HH   TYR  31           HH       TYR  31  -2.024   8.499 -15.763
  252    H    ALA  32           HN       ALA  32  -4.025   6.404  -8.677
  253    HA   ALA  32           HA       ALA  32  -4.977   5.419 -11.165
  254   1HB   ALA  32          HB1       ALA  32  -5.547   3.373  -9.788
  255   2HB   ALA  32          HB2       ALA  32  -4.966   4.262  -8.380
  256   3HB   ALA  32          HB3       ALA  32  -3.866   3.899  -9.709
  257    H    PHE  33           HN       PHE  33  -6.559   6.436  -8.183
  258    HA   PHE  33           HA       PHE  33  -9.232   6.063  -9.450
  259   1HB   PHE  33          HB2       PHE  33  -8.412   5.889  -6.551
  260   2HB   PHE  33          HB1       PHE  33 -10.080   5.871  -7.122
  261    HD1  PHE  33           HD1      PHE  33 -10.847   4.049  -8.688
  262    HD2  PHE  33           HD2      PHE  33  -7.025   3.954  -6.727
  263    HE1  PHE  33           HE1      PHE  33 -10.649   1.629  -9.189
  264    HE2  PHE  33           HE2      PHE  33  -6.831   1.533  -7.224
  265    HZ   PHE  33           HZ       PHE  33  -8.642   0.371  -8.456
  266    HA   PRO  34           HA       PRO  34  -8.778  10.580  -8.696
  267   1HB   PRO  34          HB2       PRO  34 -10.369  11.072 -11.073
  268   2HB   PRO  34          HB1       PRO  34  -8.658  11.425 -10.791
  269   1HG   PRO  34          HG2       PRO  34  -9.624   9.497 -12.530
  270   2HG   PRO  34          HG1       PRO  34  -7.981   9.547 -11.868
  271   1HD   PRO  34          HD2       PRO  34 -10.287   7.826 -11.057
  272   2HD   PRO  34          HD1       PRO  34  -8.541   7.484 -11.027
  273    H    ASP  35           HN       ASP  35 -11.596   8.647  -9.412
  274    HA   ASP  35           HA       ASP  35 -13.481  10.681  -8.478
  275   1HB   ASP  35          HB2       ASP  35 -15.201   9.130  -9.271
  276   2HB   ASP  35          HB1       ASP  35 -14.002   9.474 -10.517
  277    H    ASN  36           HN       ASN  36 -11.805   8.060  -6.953
  278    HA   ASN  36           HA       ASN  36 -14.022   7.828  -4.980
  279   1HB   ASN  36          HB2       ASN  36 -12.092   5.742  -5.962
  280   2HB   ASN  36          HB1       ASN  36 -13.119   5.527  -4.547
  281   1HD2  ASN  36          HD21      ASN  36 -13.336   3.946  -6.990
  282   2HD2  ASN  36          HD22      ASN  36 -14.866   4.264  -7.652
  283    H    GLU  37           HN       GLU  37 -13.419   8.404  -2.800
  284    HA   GLU  37           HA       GLU  37 -10.886   9.332  -2.128
  285   1HB   GLU  37          HB2       GLU  37 -12.968   9.895  -1.011
  286   2HB   GLU  37          HB1       GLU  37 -13.162   8.229  -0.488
  287   1HG   GLU  37          HG2       GLU  37 -11.097   8.404   0.866
  288   2HG   GLU  37          HG1       GLU  37 -10.892  10.081   0.353
  289    H    GLY  38           HN       GLY  38  -9.078   8.112  -1.758
  290   1HA   GLY  38          HA2       GLY  38  -9.358   5.223  -1.030
  291   2HA   GLY  38          HA1       GLY  38  -8.021   5.795  -1.779
  292    H    HIS  39           HN       HIS  39  -8.894   4.794   1.251
  293    HA   HIS  39           HA       HIS  39  -7.009   6.668   2.530
  294   1HB   HIS  39          HB2       HIS  39  -9.247   6.697   3.568
  295   2HB   HIS  39          HB1       HIS  39  -9.169   4.949   3.797
  296    HD1  HIS  39           HD1      HIS  39  -6.839   7.874   4.617
  297    HD2  HIS  39           HD2      HIS  39  -8.309   4.378   6.346
  298    HE1  HIS  39           HE1      HIS  39  -5.792   7.719   6.918
  299    H    VAL  40           HN       VAL  40  -5.048   5.704   2.978
  300    HA   VAL  40           HA       VAL  40  -4.924   2.764   3.016
  301    HB   VAL  40           HB       VAL  40  -2.794   4.792   2.323
  302   1HG1  VAL  40          HG11      VAL  40  -1.849   2.747   3.264
  303   2HG1  VAL  40          HG12      VAL  40  -1.580   2.772   1.524
  304   3HG1  VAL  40          HG13      VAL  40  -2.857   1.766   2.203
  305   1HG2  VAL  40          HG21      VAL  40  -4.738   4.561   0.702
  306   2HG2  VAL  40          HG22      VAL  40  -4.297   2.862   0.527
  307   3HG2  VAL  40          HG23      VAL  40  -3.167   4.120   0.030
  308    H    SER  41           HN       SER  41  -4.266   1.815   4.811
  309    HA   SER  41           HA       SER  41  -2.800   3.393   6.855
  310   1HB   SER  41          HB2       SER  41  -5.027   3.137   7.743
  311   2HB   SER  41          HB1       SER  41  -5.059   1.426   7.322
  312    HG   SER  41           HG       SER  41  -3.141   2.575   9.068
  313    H    VAL  42           HN       VAL  42  -1.127   2.438   7.863
  314    HA   VAL  42           HA       VAL  42  -0.558  -0.383   7.192
  315    HB   VAL  42           HB       VAL  42   1.514   1.836   7.253
  316   1HG1  VAL  42          HG11      VAL  42   2.423  -0.322   7.903
  317   2HG1  VAL  42          HG12      VAL  42   2.964   0.048   6.266
  318   3HG1  VAL  42          HG13      VAL  42   1.652  -1.103   6.521
  319   1HG2  VAL  42          HG21      VAL  42   1.583   1.761   4.871
  320   2HG2  VAL  42          HG22      VAL  42  -0.128   1.858   5.279
  321   3HG2  VAL  42          HG23      VAL  42   0.581   0.314   4.813
  322    H    ARG  43           HN       ARG  43  -0.182  -1.588   8.889
  323    HA   ARG  43           HA       ARG  43   0.989  -0.400  11.283
  324   1HB   ARG  43          HB2       ARG  43  -1.369  -0.082  11.708
  325   2HB   ARG  43          HB1       ARG  43  -1.734  -1.737  11.226
  326   1HG   ARG  43          HG2       ARG  43  -0.556  -2.624  13.147
  327   2HG   ARG  43          HG1       ARG  43   0.032  -1.017  13.584
  328   1HD   ARG  43          HD2       ARG  43  -2.905  -1.730  13.421
  329   2HD   ARG  43          HD1       ARG  43  -1.971  -1.816  14.911
  330    HE   ARG  43           HE       ARG  43  -1.527   0.729  13.994
  331   1HH1  ARG  43          HH21      ARG  43  -4.179  -1.218  15.042
  332   2HH1  ARG  43          HH22      ARG  43  -5.235   0.126  15.325
  333   1HH2  ARG  43          HH11      ARG  43  -2.966   2.492  14.202
  334   2HH2  ARG  43          HH12      ARG  43  -4.549   2.223  14.851
  335    H    TYR  44           HN       TYR  44   1.702  -2.034  12.842
  336    HA   TYR  44           HA       TYR  44   2.655  -4.463  11.500
  337   1HB   TYR  44          HB2       TYR  44   3.048  -3.391  14.317
  338   2HB   TYR  44          HB1       TYR  44   3.771  -4.867  13.704
  339    HD1  TYR  44           HD1      TYR  44   5.337  -4.719  11.678
  340    HD2  TYR  44           HD2      TYR  44   4.062  -1.293  13.939
  341    HE1  TYR  44           HE1      TYR  44   7.240  -3.414  10.775
  342    HE2  TYR  44           HE2      TYR  44   5.967   0.011  13.046
  343    HH   TYR  44           HH       TYR  44   8.567  -1.108  11.868
  344    H    ALA  45           HN       ALA  45   1.992  -6.490  11.816
  345    HA   ALA  45           HA       ALA  45  -0.024  -7.055  13.878
  346   1HB   ALA  45          HB1       ALA  45  -1.091  -6.483  11.586
  347   2HB   ALA  45          HB2       ALA  45  -1.577  -7.989  12.366
  348   3HB   ALA  45          HB3       ALA  45  -0.410  -8.018  11.045
  349    H    ALA  46           HN       ALA  46  -0.362  -9.498  14.016
  350    HA   ALA  46           HA       ALA  46   2.148 -10.753  14.284
  351   1HB   ALA  46          HB1       ALA  46  -0.515 -12.176  14.060
  352   2HB   ALA  46          HB2       ALA  46   0.054 -11.401  15.538
  353   3HB   ALA  46          HB3       ALA  46   0.945 -12.762  14.857
  354    H    ALA  47           HN       ALA  47  -0.034 -10.587  11.540
  355    HA   ALA  47           HA       ALA  47   1.971 -12.125   9.999
  356   1HB   ALA  47          HB1       ALA  47   0.323 -13.509   8.977
  357   2HB   ALA  47          HB2       ALA  47  -0.998 -12.573   9.676
  358   3HB   ALA  47          HB3       ALA  47   0.014 -13.580  10.711
  359    H    ASN  48           HN       ASN  48   2.044 -11.760   7.764
  360    HA   ASN  48           HA       ASN  48   1.405  -9.068   6.939
  361   1HB   ASN  48          HB2       ASN  48   3.391 -10.450   6.136
  362   2HB   ASN  48          HB1       ASN  48   2.241 -11.381   5.178
  363   1HD2  ASN  48          HD21      ASN  48   2.430 -10.650   3.048
  364   2HD2  ASN  48          HD22      ASN  48   2.474  -9.016   2.592
  365    H    ASN  49           HN       ASN  49  -0.496  -8.410   6.027
  366    HA   ASN  49           HA       ASN  49  -2.109 -10.269   4.456
  367   1HB   ASN  49          HB2       ASN  49  -2.812 -10.578   6.855
  368   2HB   ASN  49          HB1       ASN  49  -3.312  -8.890   6.857
  369   1HD2  ASN  49          HD21      ASN  49  -4.090 -12.093   5.604
  370   2HD2  ASN  49          HD22      ASN  49  -5.593 -11.662   4.942
  371    H    LEU  50           HN       LEU  50  -3.626  -9.218   3.121
  372    HA   LEU  50           HA       LEU  50  -3.544  -6.252   3.085
  373   1HB   LEU  50          HB2       LEU  50  -2.185  -7.202   1.226
  374   2HB   LEU  50          HB1       LEU  50  -3.577  -8.148   0.709
  375    HG   LEU  50           HG       LEU  50  -4.859  -6.024   0.379
  376   1HD1  LEU  50          HD11      LEU  50  -3.945  -4.408   1.749
  377   2HD1  LEU  50          HD12      LEU  50  -3.260  -3.947   0.194
  378   3HD1  LEU  50          HD13      LEU  50  -2.282  -4.844   1.356
  379   1HD2  LEU  50          HD21      LEU  50  -2.230  -6.265  -1.122
  380   2HD2  LEU  50          HD22      LEU  50  -3.585  -5.267  -1.645
  381   3HD2  LEU  50          HD23      LEU  50  -3.766  -7.017  -1.559
  382    H    SER  51           HN       SER  51  -5.625  -5.472   3.388
  383    HA   SER  51           HA       SER  51  -7.891  -7.214   2.575
  384   1HB   SER  51          HB2       SER  51  -7.707  -5.336   4.938
  385   2HB   SER  51          HB1       SER  51  -9.125  -6.265   4.468
  386    HG   SER  51           HG       SER  51  -7.593  -7.159   6.125
  387    H    VAL  52           HN       VAL  52  -9.325  -6.240   1.195
  388    HA   VAL  52           HA       VAL  52  -9.280  -3.295   0.958
  389    HB   VAL  52           HB       VAL  52  -9.629  -5.298  -1.287
  390   1HG1  VAL  52          HG11      VAL  52  -9.633  -2.268  -1.207
  391   2HG1  VAL  52          HG12      VAL  52 -10.965  -3.317  -1.691
  392   3HG1  VAL  52          HG13      VAL  52  -9.518  -3.211  -2.693
  393   1HG2  VAL  52          HG21      VAL  52  -7.296  -5.111  -0.475
  394   2HG2  VAL  52          HG22      VAL  52  -7.380  -3.358  -0.657
  395   3HG2  VAL  52          HG23      VAL  52  -7.472  -4.398  -2.079
  396    H    ILE  53           HN       ILE  53 -11.255  -2.383   1.323
  397    HA   ILE  53           HA       ILE  53 -13.676  -4.081   1.014
  398    HB   ILE  53           HB       ILE  53 -13.173  -1.931   3.093
  399   1HG1  ILE  53          HG12      ILE  53 -13.604  -4.898   3.538
  400   2HG1  ILE  53          HG11      ILE  53 -11.993  -4.189   3.391
  401   1HG2  ILE  53          HG21      ILE  53 -15.358  -2.756   4.001
  402   2HG2  ILE  53          HG22      ILE  53 -15.538  -3.758   2.563
  403   3HG2  ILE  53          HG23      ILE  53 -15.520  -2.001   2.417
  404   1HD1  ILE  53          HD11      ILE  53 -14.078  -3.231   5.368
  405   2HD1  ILE  53          HD12      ILE  53 -12.384  -2.748   5.292
  406   3HD1  ILE  53          HD13      ILE  53 -12.812  -4.392   5.767
  407    H    GLY  54           HN       GLY  54 -15.211  -3.292  -0.278
  408   1HA   GLY  54          HA2       GLY  54 -16.616  -1.623  -1.161
  409   2HA   GLY  54          HA1       GLY  54 -15.429  -0.399  -0.725
  410    H    ALA  55           HN       ALA  55 -14.028  -3.107  -2.263
  411    HA   ALA  55           HA       ALA  55 -13.948  -1.627  -4.839
  412   1HB   ALA  55          HB1       ALA  55 -11.655  -1.959  -5.023
  413   2HB   ALA  55          HB2       ALA  55 -11.663  -3.359  -3.949
  414   3HB   ALA  55          HB3       ALA  55 -11.828  -1.737  -3.282
  415    H    THR  56           HN       THR  56 -13.385  -2.885  -6.706
  416    HA   THR  56           HA       THR  56 -14.805  -5.475  -6.918
  417    HB   THR  56           HB       THR  56 -14.596  -5.031  -9.284
  418    HG1  THR  56           HG1      THR  56 -12.727  -3.981  -9.530
  419   1HG2  THR  56          HG21      THR  56 -16.400  -3.910  -7.840
  420   2HG2  THR  56          HG22      THR  56 -16.110  -3.207  -9.432
  421   3HG2  THR  56          HG23      THR  56 -15.445  -2.435  -7.992
  422    H    LYS  57           HN       LYS  57 -13.856  -7.189  -8.001
  423    HA   LYS  57           HA       LYS  57 -11.356  -7.931  -7.049
  424   1HB   LYS  57          HB2       LYS  57 -13.010  -9.593  -7.760
  425   2HB   LYS  57          HB1       LYS  57 -12.849  -9.073  -9.436
  426   1HG   LYS  57          HG2       LYS  57 -10.477  -9.800  -9.433
  427   2HG   LYS  57          HG1       LYS  57 -10.635 -10.324  -7.754
  428   1HD   LYS  57          HD2       LYS  57 -12.264 -11.986  -8.350
  429   2HD   LYS  57          HD1       LYS  57 -12.380 -11.360  -9.996
  430   1HE   LYS  57          HE2       LYS  57 -10.080 -12.011 -10.458
  431   2HE   LYS  57          HE1       LYS  57  -9.850 -12.509  -8.782
  432   1HZ   LYS  57          HZ1       LYS  57 -10.310 -14.454  -9.997
  433   2HZ   LYS  57          HZ2       LYS  57 -11.613 -13.739 -10.819
  434   3HZ   LYS  57          HZ3       LYS  57 -11.742 -14.093  -9.163
  435    H    GLU  58           HN       GLU  58 -12.123  -6.512 -10.283
  436    HA   GLU  58           HA       GLU  58  -9.490  -6.892 -11.312
  437   1HB   GLU  58          HB2       GLU  58 -11.773  -5.065 -12.047
  438   2HB   GLU  58          HB1       GLU  58 -10.216  -4.992 -12.869
  439   1HG   GLU  58          HG2       GLU  58 -11.856  -7.537 -12.619
  440   2HG   GLU  58          HG1       GLU  58 -11.925  -6.460 -14.011
  441    H    ASP  59           HN       ASP  59 -11.061  -4.355  -9.425
  442    HA   ASP  59           HA       ASP  59  -8.989  -2.442  -9.624
  443   1HB   ASP  59          HB2       ASP  59 -11.094  -2.928  -7.502
  444   2HB   ASP  59          HB1       ASP  59  -9.983  -1.561  -7.466
  445    H    LYS  60           HN       LYS  60  -9.762  -5.006  -7.348
  446    HA   LYS  60           HA       LYS  60  -7.566  -4.580  -5.606
  447   1HB   LYS  60          HB2       LYS  60  -9.529  -5.935  -4.937
  448   2HB   LYS  60          HB1       LYS  60  -9.096  -7.149  -6.142
  449   1HG   LYS  60          HG2       LYS  60  -6.942  -7.528  -4.986
  450   2HG   LYS  60          HG1       LYS  60  -7.374  -6.314  -3.784
  451   1HD   LYS  60          HD2       LYS  60  -9.271  -7.647  -3.052
  452   2HD   LYS  60          HD1       LYS  60  -8.987  -8.819  -4.341
  453   1HE   LYS  60          HE2       LYS  60  -6.807  -9.390  -3.379
  454   2HE   LYS  60          HE1       LYS  60  -7.026  -8.175  -2.121
  455   1HZ   LYS  60          HZ1       LYS  60  -9.213 -10.032  -2.345
  456   2HZ   LYS  60          HZ2       LYS  60  -8.372  -9.503  -0.966
  457   3HZ   LYS  60          HZ3       LYS  60  -7.746 -10.766  -1.915
  458    H    GLN  61           HN       GLN  61  -7.789  -6.564  -8.578
  459    HA   GLN  61           HA       GLN  61  -5.210  -7.724  -8.212
  460   1HB   GLN  61          HB2       GLN  61  -6.846  -8.622  -9.852
  461   2HB   GLN  61          HB1       GLN  61  -6.713  -7.132 -10.788
  462   1HG   GLN  61          HG2       GLN  61  -4.360  -7.545 -11.213
  463   2HG   GLN  61          HG1       GLN  61  -4.372  -8.948 -10.147
  464   1HE2  GLN  61          HE21      GLN  61  -7.322  -8.983 -11.721
  465   2HE2  GLN  61          HE22      GLN  61  -6.915  -9.989 -13.027
  466    H    ARG  62           HN       ARG  62  -6.381  -4.752  -9.847
  467    HA   ARG  62           HA       ARG  62  -3.882  -3.967 -10.839
  468   1HB   ARG  62          HB2       ARG  62  -5.960  -2.904 -11.610
  469   2HB   ARG  62          HB1       ARG  62  -6.240  -2.245 -10.000
  470   1HG   ARG  62          HG2       ARG  62  -4.176  -0.905 -10.175
  471   2HG   ARG  62          HG1       ARG  62  -3.862  -1.583 -11.773
  472   1HD   ARG  62          HD2       ARG  62  -5.996  -0.641 -12.584
  473   2HD   ARG  62          HD1       ARG  62  -6.295   0.044 -10.991
  474    HE   ARG  62           HE       ARG  62  -3.777   0.935 -11.947
  475   1HH1  ARG  62          HH21      ARG  62  -7.178   1.225 -12.479
  476   2HH1  ARG  62          HH22      ARG  62  -7.090   2.842 -13.093
  477   1HH2  ARG  62          HH11      ARG  62  -3.646   3.067 -12.748
  478   2HH2  ARG  62          HH12      ARG  62  -5.089   3.886 -13.247
  479    H    ILE  63           HN       ILE  63  -5.495  -3.244  -7.776
  480    HA   ILE  63           HA       ILE  63  -3.445  -1.588  -6.784
  481    HB   ILE  63           HB       ILE  63  -5.461  -3.279  -5.326
  482   1HG1  ILE  63          HG12      ILE  63  -5.287  -0.275  -5.639
  483   2HG1  ILE  63          HG11      ILE  63  -6.225  -1.302  -6.721
  484   1HG2  ILE  63          HG21      ILE  63  -3.697  -3.018  -3.751
  485   2HG2  ILE  63          HG22      ILE  63  -4.839  -1.731  -3.368
  486   3HG2  ILE  63          HG23      ILE  63  -3.374  -1.366  -4.280
  487   1HD1  ILE  63          HD11      ILE  63  -6.607  -1.262  -3.716
  488   2HD1  ILE  63          HD12      ILE  63  -7.635  -2.049  -4.914
  489   3HD1  ILE  63          HD13      ILE  63  -7.564  -0.289  -4.833
  490    H    SER  64           HN       SER  64  -3.847  -5.090  -6.581
  491    HA   SER  64           HA       SER  64  -1.551  -5.555  -4.972
  492   1HB   SER  64          HB2       SER  64  -2.716  -7.300  -7.166
  493   2HB   SER  64          HB1       SER  64  -1.563  -7.828  -5.943
  494    HG   SER  64           HG       SER  64  -3.244  -8.169  -4.740
  495    H    GLU  65           HN       GLU  65  -1.991  -5.145  -8.539
  496    HA   GLU  65           HA       GLU  65   0.704  -5.672  -9.191
  497   1HB   GLU  65          HB2       GLU  65  -1.426  -4.038 -10.600
  498   2HB   GLU  65          HB1       GLU  65   0.169  -4.342 -11.290
  499   1HG   GLU  65          HG2       GLU  65  -1.701  -6.544 -10.376
  500   2HG   GLU  65          HG1       GLU  65  -1.623  -5.964 -12.038
  501    H    ILE  66           HN       ILE  66  -0.982  -2.668  -8.382
  502    HA   ILE  66           HA       ILE  66   1.169  -0.921  -8.825
  503    HB   ILE  66           HB       ILE  66  -1.218  -0.775  -6.981
  504   1HG1  ILE  66          HG12      ILE  66  -0.513   0.704  -9.535
  505   2HG1  ILE  66          HG11      ILE  66  -1.521  -0.741  -9.477
  506   1HG2  ILE  66          HG21      ILE  66   0.896   1.330  -7.532
  507   2HG2  ILE  66          HG22      ILE  66   0.468   0.645  -5.962
  508   3HG2  ILE  66          HG23      ILE  66  -0.678   1.668  -6.817
  509   1HD1  ILE  66          HD11      ILE  66  -3.146   0.409  -8.058
  510   2HD1  ILE  66          HD12      ILE  66  -2.867   1.355  -9.520
  511   3HD1  ILE  66          HD13      ILE  66  -2.115   1.839  -7.999
  512    H    LEU  67           HN       LEU  67   0.194  -2.655  -5.904
  513    HA   LEU  67           HA       LEU  67   2.198  -1.628  -4.208
  514   1HB   LEU  67          HB2       LEU  67   0.338  -2.846  -3.238
  515   2HB   LEU  67          HB1       LEU  67   0.693  -4.264  -4.213
  516    HG   LEU  67           HG       LEU  67   2.914  -4.450  -2.979
  517   1HD1  LEU  67          HD11      LEU  67   3.298  -2.319  -2.018
  518   2HD1  LEU  67          HD12      LEU  67   2.772  -3.289  -0.647
  519   3HD1  LEU  67          HD13      LEU  67   1.642  -2.185  -1.426
  520   1HD2  LEU  67          HD21      LEU  67   1.865  -5.443  -0.980
  521   2HD2  LEU  67          HD22      LEU  67   0.939  -5.829  -2.431
  522   3HD2  LEU  67          HD23      LEU  67   0.368  -4.577  -1.327
  523    H    GLN  68           HN       GLN  68   2.153  -4.365  -6.431
  524    HA   GLN  68           HA       GLN  68   4.733  -5.360  -5.767
  525   1HB   GLN  68          HB2       GLN  68   3.086  -6.657  -7.088
  526   2HB   GLN  68          HB1       GLN  68   3.246  -5.497  -8.405
  527   1HG   GLN  68          HG2       GLN  68   5.649  -6.044  -8.603
  528   2HG   GLN  68          HG1       GLN  68   5.490  -7.202  -7.282
  529   1HE2  GLN  68          HE21      GLN  68   5.166  -9.310  -7.982
  530   2HE2  GLN  68          HE22      GLN  68   4.446  -9.750  -9.455
  531    H    GLU  69           HN       GLU  69   3.743  -3.140  -8.446
  532    HA   GLU  69           HA       GLU  69   6.337  -2.714  -9.382
  533   1HB   GLU  69          HB2       GLU  69   3.849  -1.008  -9.518
  534   2HB   GLU  69          HB1       GLU  69   5.339  -0.609 -10.375
  535   1HG   GLU  69          HG2       GLU  69   5.270  -2.792 -11.520
  536   2HG   GLU  69          HG1       GLU  69   3.784  -3.196 -10.665
  537    H    THR  70           HN       THR  70   4.521  -0.751  -6.984
  538    HA   THR  70           HA       THR  70   6.495   1.227  -6.687
  539    HB   THR  70           HB       THR  70   4.551   0.214  -4.646
  540    HG1  THR  70           HG1      THR  70   3.220   1.145  -5.963
  541   1HG2  THR  70          HG21      THR  70   4.891   2.607  -3.767
  542   2HG2  THR  70          HG22      THR  70   6.349   2.629  -4.760
  543   3HG2  THR  70          HG23      THR  70   6.185   1.451  -3.457
  544    H    TRP  71           HN       TRP  71   5.926  -1.757  -4.975
  545    HA   TRP  71           HA       TRP  71   7.995  -1.652  -3.146
  546   1HB   TRP  71          HB2       TRP  71   6.041  -3.147  -3.111
  547   2HB   TRP  71          HB1       TRP  71   6.707  -4.016  -4.479
  548    HD1  TRP  71           HD1      TRP  71   7.505  -6.251  -3.633
  549    HE1  TRP  71           HE1      TRP  71   8.885  -7.112  -1.642
  550    HE3  TRP  71           HE3      TRP  71   8.076  -1.902  -0.959
  551    HZ2  TRP  71           HZ2      TRP  71  10.053  -6.120   0.757
  552    HZ3  TRP  71           HZ3      TRP  71   9.314  -1.912   1.172
  553    HH2  TRP  71           HH2      TRP  71  10.298  -4.012   2.042
  554    H    GLU  72           HN       GLU  72   7.963  -2.861  -6.445
  555    HA   GLU  72           HA       GLU  72  10.664  -3.798  -6.355
  556   1HB   GLU  72          HB2       GLU  72   8.742  -3.368  -8.644
  557   2HB   GLU  72          HB1       GLU  72  10.395  -3.932  -8.893
  558   1HG   GLU  72          HG2       GLU  72   9.976  -5.837  -7.386
  559   2HG   GLU  72          HG1       GLU  72   8.323  -5.279  -7.135
  560    H    SER  73           HN       SER  73   9.337  -0.638  -6.820
  561    HA   SER  73           HA       SER  73  11.881   0.259  -8.065
  562   1HB   SER  73          HB2       SER  73  10.700   2.245  -8.760
  563   2HB   SER  73          HB1       SER  73   9.746   0.842  -9.230
  564    HG   SER  73           HG       SER  73   8.289   2.060  -8.220
  565    H    ALA  74           HN       ALA  74  11.270  -0.367  -5.146
  566    HA   ALA  74           HA       ALA  74  11.045   1.772  -3.527
  567   1HB   ALA  74          HB1       ALA  74  12.909  -0.544  -3.085
  568   2HB   ALA  74          HB2       ALA  74  11.156  -0.613  -2.891
  569   3HB   ALA  74          HB3       ALA  74  12.119   0.445  -1.857
  570    H    ASP  75           HN       ASP  75  14.063   0.849  -5.166
  571    HA   ASP  75           HA       ASP  75  15.772   2.469  -3.579
  572   1HB   ASP  75          HB2       ASP  75  16.043   1.363  -6.374
  573   2HB   ASP  75          HB1       ASP  75  17.327   2.252  -5.558
  574    H    ASP  76           HN       ASP  76  13.550   3.305  -6.111
  575    HA   ASP  76           HA       ASP  76  14.918   5.846  -6.709
  576   1HB   ASP  76          HB2       ASP  76  13.950   4.502  -8.545
  577   2HB   ASP  76          HB1       ASP  76  12.354   4.707  -7.823
  578    H    TRP  77           HN       TRP  77  11.746   4.806  -5.362
  579    HA   TRP  77           HA       TRP  77  11.140   7.618  -4.789
  580   1HB   TRP  77          HB2       TRP  77   8.939   6.971  -4.348
  581   2HB   TRP  77          HB1       TRP  77   9.449   6.024  -5.730
  582    HD1  TRP  77           HD1      TRP  77   9.397   3.406  -5.492
  583    HE1  TRP  77           HE1      TRP  77   8.758   1.800  -3.602
  584    HE3  TRP  77           HE3      TRP  77   9.049   6.690  -1.486
  585    HZ2  TRP  77           HZ2      TRP  77   8.192   1.846  -0.826
  586    HZ3  TRP  77           HZ3      TRP  77   8.461   5.827   0.723
  587    HH2  TRP  77           HH2      TRP  77   8.037   3.432   1.064
  588    H    PHE  78           HN       PHE  78  12.379   4.917  -2.957
  589    HA   PHE  78           HA       PHE  78  11.538   6.158  -0.419
  590   1HB   PHE  78          HB2       PHE  78  11.539   3.713  -0.479
  591   2HB   PHE  78          HB1       PHE  78  13.239   3.712  -0.932
  592    HD1  PHE  78           HD1      PHE  78  11.085   5.361   1.694
  593    HD2  PHE  78           HD2      PHE  78  14.762   3.277   0.829
  594    HE1  PHE  78           HE1      PHE  78  11.739   5.502   4.073
  595    HE2  PHE  78           HE2      PHE  78  15.392   3.422   3.215
  596    HZ   PHE  78           HZ       PHE  78  13.886   4.532   4.836
  597    H    VAL  79           HN       VAL  79  12.657   7.556   0.666
  598    HA   VAL  79           HA       VAL  79  15.519   7.947   0.021
  599    HB   VAL  79           HB       VAL  79  13.727  10.144   1.060
  600   1HG1  VAL  79          HG11      VAL  79  15.987  10.324  -0.933
  601   2HG1  VAL  79          HG12      VAL  79  16.301  10.256   0.802
  602   3HG1  VAL  79          HG13      VAL  79  15.351  11.580   0.129
  603   1HG2  VAL  79          HG21      VAL  79  13.249  10.779  -1.302
  604   2HG2  VAL  79          HG22      VAL  79  12.505   9.236  -0.874
  605   3HG2  VAL  79          HG23      VAL  79  13.985   9.271  -1.840
  606    H    SER  80           HN       SER  80  16.924   7.984   1.885
  607    HA   SER  80           HA       SER  80  15.573   7.871   4.531
  608   1HB   SER  80          HB2       SER  80  17.465   6.404   5.212
  609   2HB   SER  80          HB1       SER  80  16.534   5.684   3.895
  610    HG   SER  80           HG       SER  80  19.017   5.908   3.831
  611    H    GLU  81           HN       GLU  81  16.377   9.122   6.116
  612    HA   GLU  81           HA       GLU  81  17.827  11.438   5.548
  613   1HB   GLU  81          HB2       GLU  81  17.563  10.012   8.208
  614   2HB   GLU  81          HB1       GLU  81  18.076  11.685   7.990
  615   1HG   GLU  81          HG2       GLU  81  15.912  12.214   6.932
  616   2HG   GLU  81          HG1       GLU  81  15.395  10.543   7.151
  Start of MODEL   13
    1   1H    MET   1          HT1       MET   1 -14.145   4.194  -1.695
    2   2H    MET   1          HT2       MET   1 -13.442   4.667  -0.223
    3   3H    MET   1          HT3       MET   1 -14.893   3.783  -0.230
    4    HA   MET   1           HA       MET   1 -13.875   1.832  -0.439
    5   1HB   MET   1          HB2       MET   1 -13.318   2.435  -2.803
    6   2HB   MET   1          HB1       MET   1 -11.833   3.191  -2.229
    7   1HG   MET   1          HG2       MET   1 -11.050   1.052  -1.335
    8   2HG   MET   1          HG1       MET   1 -12.564   0.280  -1.802
    9   1HE   MET   1          HE1       MET   1  -9.104   1.698  -4.398
   10   2HE   MET   1          HE2       MET   1  -9.450   2.049  -2.706
   11   3HE   MET   1          HE3       MET   1 -10.283   2.943  -3.972
   12    H    ARG   2           HN       ARG   2 -12.392   0.852   0.964
   13    HA   ARG   2           HA       ARG   2 -10.351   2.629   2.183
   14   1HB   ARG   2          HB2       ARG   2 -12.169   0.628   3.541
   15   2HB   ARG   2          HB1       ARG   2 -10.736   1.308   4.311
   16   1HG   ARG   2          HG2       ARG   2 -11.638   3.583   3.985
   17   2HG   ARG   2          HG1       ARG   2 -13.075   2.903   3.219
   18   1HD   ARG   2          HD2       ARG   2 -13.603   1.676   5.292
   19   2HD   ARG   2          HD1       ARG   2 -12.168   2.349   6.059
   20    HE   ARG   2           HE       ARG   2 -13.626   4.528   5.171
   21   1HH1  ARG   2          HH11      ARG   2 -13.100   3.004   8.013
   22   2HH1  ARG   2          HH12      ARG   2 -14.652   3.297   8.725
   23   1HH2  ARG   2          HH21      ARG   2 -16.095   4.392   5.766
   24   2HH2  ARG   2          HH22      ARG   2 -16.348   4.084   7.451
   25    H    ILE   3           HN       ILE   3  -8.360   1.856   2.267
   26    HA   ILE   3           HA       ILE   3  -7.876  -0.990   1.535
   27    HB   ILE   3           HB       ILE   3  -6.229   1.476   0.965
   28   1HG1  ILE   3          HG12      ILE   3  -7.633  -0.429  -0.924
   29   2HG1  ILE   3          HG11      ILE   3  -8.359   1.076  -0.360
   30   1HG2  ILE   3          HG21      ILE   3  -4.712  -0.341   1.315
   31   2HG2  ILE   3          HG22      ILE   3  -4.925  -0.221  -0.431
   32   3HG2  ILE   3          HG23      ILE   3  -5.770  -1.475   0.475
   33   1HD1  ILE   3          HD11      ILE   3  -6.700   2.401  -1.412
   34   2HD1  ILE   3          HD12      ILE   3  -7.109   1.161  -2.596
   35   3HD1  ILE   3          HD13      ILE   3  -5.631   1.017  -1.648
   36    H    GLU   4           HN       GLU   4  -6.903  -2.125   3.127
   37    HA   GLU   4           HA       GLU   4  -5.245  -0.666   5.133
   38   1HB   GLU   4          HB2       GLU   4  -6.984  -3.119   5.610
   39   2HB   GLU   4          HB1       GLU   4  -6.022  -2.274   6.824
   40   1HG   GLU   4          HG2       GLU   4  -8.215  -0.933   5.225
   41   2HG   GLU   4          HG1       GLU   4  -8.490  -1.677   6.798
   42    H    VAL   5           HN       VAL   5  -3.226  -1.307   5.340
   43    HA   VAL   5           HA       VAL   5  -2.445  -3.963   4.241
   44    HB   VAL   5           HB       VAL   5  -0.845  -1.396   4.278
   45   1HG1  VAL   5          HG11      VAL   5  -0.242  -4.192   3.291
   46   2HG1  VAL   5          HG12      VAL   5   0.652  -3.261   4.492
   47   3HG1  VAL   5          HG13      VAL   5   0.688  -2.778   2.797
   48   1HG2  VAL   5          HG21      VAL   5  -2.056  -2.925   1.954
   49   2HG2  VAL   5          HG22      VAL   5  -1.126  -1.429   1.850
   50   3HG2  VAL   5          HG23      VAL   5  -2.710  -1.431   2.624
   51    H    THR   6           HN       THR   6  -1.323  -5.313   5.534
   52    HA   THR   6           HA       THR   6  -0.254  -4.243   8.098
   53    HB   THR   6           HB       THR   6  -0.794  -6.508   9.048
   54    HG1  THR   6           HG1      THR   6  -1.824  -6.729   6.467
   55   1HG2  THR   6          HG21      THR   6  -3.248  -5.091   7.992
   56   2HG2  THR   6          HG22      THR   6  -2.240  -4.400   9.264
   57   3HG2  THR   6          HG23      THR   6  -3.062  -5.940   9.525
   58    H    ILE   7           HN       ILE   7   1.724  -4.779   8.641
   59    HA   ILE   7           HA       ILE   7   3.252  -6.606   6.880
   60    HB   ILE   7           HB       ILE   7   3.940  -4.033   8.294
   61   1HG1  ILE   7          HG12      ILE   7   4.463  -4.956   5.453
   62   2HG1  ILE   7          HG11      ILE   7   3.008  -4.086   5.939
   63   1HG2  ILE   7          HG21      ILE   7   5.796  -6.218   7.297
   64   2HG2  ILE   7          HG22      ILE   7   5.812  -5.406   8.863
   65   3HG2  ILE   7          HG23      ILE   7   6.325  -4.539   7.417
   66   1HD1  ILE   7          HD11      ILE   7   5.853  -3.085   6.255
   67   2HD1  ILE   7          HD12      ILE   7   4.403  -2.218   6.762
   68   3HD1  ILE   7          HD13      ILE   7   4.693  -2.527   5.050
   69    H    ALA   8           HN       ALA   8   4.232  -8.315   7.829
   70    HA   ALA   8           HA       ALA   8   3.682  -9.003  10.509
   71   1HB   ALA   8          HB1       ALA   8   4.101 -10.734   8.900
   72   2HB   ALA   8          HB2       ALA   8   5.403 -10.800  10.088
   73   3HB   ALA   8          HB3       ALA   8   5.684 -10.062   8.510
   74    H    LYS   9           HN       LYS   9   4.646  -8.614  12.246
   75    HA   LYS   9           HA       LYS   9   6.598  -6.654  12.558
   76   1HB   LYS   9          HB2       LYS   9   4.986  -7.162  14.328
   77   2HB   LYS   9          HB1       LYS   9   5.652  -8.780  14.508
   78   1HG   LYS   9          HG2       LYS   9   7.806  -7.814  15.263
   79   2HG   LYS   9          HG1       LYS   9   7.140  -6.187  15.089
   80   1HD   LYS   9          HD2       LYS   9   5.454  -6.643  16.772
   81   2HD   LYS   9          HD1       LYS   9   5.963  -8.329  16.875
   82   1HE   LYS   9          HE2       LYS   9   8.118  -7.698  17.760
   83   2HE   LYS   9          HE1       LYS   9   7.789  -5.988  17.470
   84   1HZ   LYS   9          HZ1       LYS   9   6.104  -7.665  19.235
   85   2HZ   LYS   9          HZ2       LYS   9   6.134  -5.970  19.117
   86   3HZ   LYS   9          HZ3       LYS   9   7.445  -6.800  19.808
   87    H    THR  10           HN       THR  10   6.959 -10.058  12.029
   88    HA   THR  10           HA       THR  10   9.566 -10.423  13.068
   89    HB   THR  10           HB       THR  10   9.629 -12.312  11.388
   90    HG1  THR  10           HG1      THR  10   6.990 -11.417  10.877
   91   1HG2  THR  10          HG21      THR  10   8.150 -13.657  12.631
   92   2HG2  THR  10          HG22      THR  10   7.017 -12.334  12.893
   93   3HG2  THR  10          HG23      THR  10   8.551 -12.364  13.759
   94    H    SER  11           HN       SER  11   8.412  -8.531  10.501
   95    HA   SER  11           HA       SER  11  11.123  -8.384   9.284
   96   1HB   SER  11          HB2       SER  11   8.403  -8.097   7.990
   97   2HB   SER  11          HB1       SER  11   9.918  -7.660   7.203
   98    HG   SER  11           HG       SER  11  10.302 -10.038   8.192
   99    HA   PRO  12           HA       PRO  12  10.010  -4.203  10.995
  100   1HB   PRO  12          HB2       PRO  12  12.694  -4.002  12.049
  101   2HB   PRO  12          HB1       PRO  12  11.188  -4.161  12.971
  102   1HG   PRO  12          HG2       PRO  12  13.178  -6.092  12.818
  103   2HG   PRO  12          HG1       PRO  12  11.501  -6.387  13.305
  104   1HD   PRO  12          HD2       PRO  12  12.828  -6.951  10.681
  105   2HD   PRO  12          HD1       PRO  12  11.515  -7.817  11.497
  106    H    LEU  13           HN       LEU  13  10.075  -2.446   9.965
  107    HA   LEU  13           HA       LEU  13  12.195  -2.092   7.937
  108   1HB   LEU  13          HB2       LEU  13   9.468  -0.787   8.040
  109   2HB   LEU  13          HB1       LEU  13  10.613  -0.757   6.702
  110    HG   LEU  13           HG       LEU  13   9.115  -3.171   7.762
  111   1HD1  LEU  13          HD11      LEU  13   9.109  -1.773   5.063
  112   2HD1  LEU  13          HD12      LEU  13   7.797  -1.769   6.242
  113   3HD1  LEU  13          HD13      LEU  13   8.248  -3.265   5.431
  114   1HD2  LEU  13          HD21      LEU  13  10.312  -4.277   5.715
  115   2HD2  LEU  13          HD22      LEU  13  11.219  -4.083   7.212
  116   3HD2  LEU  13          HD23      LEU  13  11.469  -2.957   5.879
  117    HA   PRO  14           HA       PRO  14  13.954   1.101  10.294
  118   1HB   PRO  14          HB2       PRO  14  14.058   3.163   8.238
  119   2HB   PRO  14          HB1       PRO  14  15.379   2.132   8.814
  120   1HG   PRO  14          HG2       PRO  14  13.756   1.876   6.393
  121   2HG   PRO  14          HG1       PRO  14  15.296   1.102   6.795
  122   1HD   PRO  14          HD2       PRO  14  12.861  -0.226   6.681
  123   2HD   PRO  14          HD1       PRO  14  14.264  -0.798   7.604
  124    H    ALA  15           HN       ALA  15  13.549   2.872  11.447
  125    HA   ALA  15           HA       ALA  15  10.940   3.503  12.146
  126   1HB   ALA  15          HB1       ALA  15  11.891   5.149  13.586
  127   2HB   ALA  15          HB2       ALA  15  13.343   5.263  12.592
  128   3HB   ALA  15          HB3       ALA  15  13.018   3.794  13.510
  129    H    GLY  16           HN       GLY  16  10.804   3.932   9.419
  130   1HA   GLY  16          HA2       GLY  16   9.717   6.567   9.245
  131   2HA   GLY  16          HA1       GLY  16  11.256   6.492   8.424
  132    H    ALA  17           HN       ALA  17  10.630   3.534   8.031
  133    HA   ALA  17           HA       ALA  17   9.736   3.761   5.328
  134   1HB   ALA  17          HB1       ALA  17  11.259   2.028   5.656
  135   2HB   ALA  17          HB2       ALA  17   9.721   1.165   5.595
  136   3HB   ALA  17          HB3       ALA  17  10.485   1.510   7.150
  137    H    ILE  18           HN       ILE  18   7.958   2.575   8.182
  138    HA   ILE  18           HA       ILE  18   5.799   1.678   6.653
  139    HB   ILE  18           HB       ILE  18   6.197   2.480   9.512
  140   1HG1  ILE  18          HG12      ILE  18   5.310   0.193   9.876
  141   2HG1  ILE  18          HG11      ILE  18   5.023   0.038   8.145
  142   1HG2  ILE  18          HG21      ILE  18   4.062   3.515   9.204
  143   2HG2  ILE  18          HG22      ILE  18   3.742   1.942   9.934
  144   3HG2  ILE  18          HG23      ILE  18   3.487   2.181   8.208
  145   1HD1  ILE  18          HD11      ILE  18   7.157  -1.025   8.839
  146   2HD1  ILE  18          HD12      ILE  18   7.733   0.544   9.406
  147   3HD1  ILE  18          HD13      ILE  18   7.409   0.291   7.692
  148    H    ASP  19           HN       ASP  19   6.359   4.839   8.219
  149    HA   ASP  19           HA       ASP  19   3.983   6.043   7.227
  150   1HB   ASP  19          HB2       ASP  19   6.602   7.205   8.208
  151   2HB   ASP  19          HB1       ASP  19   5.275   8.224   7.654
  152    H    ALA  20           HN       ALA  20   7.246   5.785   5.835
  153    HA   ALA  20           HA       ALA  20   6.646   7.509   3.687
  154   1HB   ALA  20          HB1       ALA  20   8.617   5.266   3.351
  155   2HB   ALA  20          HB2       ALA  20   8.959   6.554   4.498
  156   3HB   ALA  20          HB3       ALA  20   8.723   6.936   2.794
  157    H    LEU  21           HN       LEU  21   6.325   4.013   4.079
  158    HA   LEU  21           HA       LEU  21   5.605   3.356   1.475
  159   1HB   LEU  21          HB2       LEU  21   6.270   1.662   3.045
  160   2HB   LEU  21          HB1       LEU  21   4.974   2.103   4.152
  161    HG   LEU  21           HG       LEU  21   3.322   1.376   2.485
  162   1HD1  LEU  21          HD11      LEU  21   5.793   0.670   0.898
  163   2HD1  LEU  21          HD12      LEU  21   4.448   1.690   0.391
  164   3HD1  LEU  21          HD13      LEU  21   4.220  -0.046   0.562
  165   1HD2  LEU  21          HD21      LEU  21   3.706  -1.022   2.709
  166   2HD2  LEU  21          HD22      LEU  21   4.180  -0.198   4.194
  167   3HD2  LEU  21          HD23      LEU  21   5.411  -0.732   3.051
  168    H    ALA  22           HN       ALA  22   3.582   4.162   4.265
  169    HA   ALA  22           HA       ALA  22   1.064   3.882   2.973
  170   1HB   ALA  22          HB1       ALA  22   1.878   5.653   5.294
  171   2HB   ALA  22          HB2       ALA  22   1.214   4.022   5.412
  172   3HB   ALA  22          HB3       ALA  22   0.216   5.338   4.793
  173    H    GLY  23           HN       GLY  23   3.316   6.615   3.147
  174   1HA   GLY  23          HA2       GLY  23   1.530   8.458   1.885
  175   2HA   GLY  23          HA1       GLY  23   3.290   8.617   2.082
  176    H    GLU  24           HN       GLU  24   4.205   6.417   0.579
  177    HA   GLU  24           HA       GLU  24   3.883   7.436  -2.032
  178   1HB   GLU  24          HB2       GLU  24   5.907   6.159  -1.259
  179   2HB   GLU  24          HB1       GLU  24   4.940   4.687  -1.251
  180   1HG   GLU  24          HG2       GLU  24   6.147   4.794  -3.353
  181   2HG   GLU  24          HG1       GLU  24   4.440   5.072  -3.686
  182    H    LEU  25           HN       LEU  25   2.391   4.710  -0.380
  183    HA   LEU  25           HA       LEU  25   1.061   3.676  -2.645
  184   1HB   LEU  25          HB2       LEU  25   0.427   3.464   0.288
  185   2HB   LEU  25          HB1       LEU  25  -0.529   2.648  -0.944
  186    HG   LEU  25           HG       LEU  25   2.468   2.310  -0.644
  187   1HD1  LEU  25          HD11      LEU  25   1.322   1.504   1.365
  188   2HD1  LEU  25          HD12      LEU  25   1.883   0.131   0.414
  189   3HD1  LEU  25          HD13      LEU  25   0.183   0.597   0.378
  190   1HD2  LEU  25          HD21      LEU  25   1.968   1.570  -2.816
  191   2HD2  LEU  25          HD22      LEU  25   0.338   1.057  -2.379
  192   3HD2  LEU  25          HD23      LEU  25   1.729   0.089  -1.898
  193    H    SER  26           HN       SER  26   0.006   6.080  -0.274
  194    HA   SER  26           HA       SER  26  -2.667   6.278  -1.151
  195   1HB   SER  26          HB2       SER  26  -1.834   7.189   0.989
  196   2HB   SER  26          HB1       SER  26  -0.946   8.425   0.102
  197    HG   SER  26           HG       SER  26  -2.828   9.400   0.505
  198    H    ARG  27           HN       ARG  27   0.199   8.228  -2.077
  199    HA   ARG  27           HA       ARG  27  -1.180   9.984  -3.813
  200   1HB   ARG  27          HB2       ARG  27   1.131  10.386  -3.041
  201   2HB   ARG  27          HB1       ARG  27   1.680   8.999  -3.984
  202   1HG   ARG  27          HG2       ARG  27   0.996  10.058  -6.054
  203   2HG   ARG  27          HG1       ARG  27   0.245  11.388  -5.172
  204   1HD   ARG  27          HD2       ARG  27   2.400  12.117  -4.335
  205   2HD   ARG  27          HD1       ARG  27   3.191  10.706  -5.033
  206    HE   ARG  27           HE       ARG  27   1.800  12.240  -7.016
  207   1HH1  ARG  27          HH21      ARG  27   4.403  12.737  -4.856
  208   2HH1  ARG  27          HH22      ARG  27   5.501  13.312  -6.064
  209   1HH2  ARG  27          HH11      ARG  27   3.334  12.692  -8.702
  210   2HH2  ARG  27          HH12      ARG  27   4.894  13.290  -8.246
  211    H    ARG  28           HN       ARG  28   0.352   6.827  -4.451
  212    HA   ARG  28           HA       ARG  28  -0.097   6.860  -7.234
  213   1HB   ARG  28          HB2       ARG  28   1.443   5.282  -6.190
  214   2HB   ARG  28          HB1       ARG  28   0.099   4.495  -5.365
  215   1HG   ARG  28          HG2       ARG  28   0.780   3.272  -7.410
  216   2HG   ARG  28          HG1       ARG  28  -0.882   3.840  -7.518
  217   1HD   ARG  28          HD2       ARG  28   0.780   4.202  -9.542
  218   2HD   ARG  28          HD1       ARG  28  -0.353   5.474  -9.097
  219    HE   ARG  28           HE       ARG  28   1.447   6.769  -8.397
  220   1HH1  ARG  28          HH21      ARG  28   2.855   4.701 -10.376
  221   2HH1  ARG  28          HH22      ARG  28   4.339   4.470  -9.514
  222   1HH2  ARG  28          HH11      ARG  28   3.178   5.948  -6.597
  223   2HH2  ARG  28          HH12      ARG  28   4.522   5.176  -7.369
  224    H    ILE  29           HN       ILE  29  -2.049   5.748  -4.544
  225    HA   ILE  29           HA       ILE  29  -4.132   4.542  -6.006
  226    HB   ILE  29           HB       ILE  29  -3.986   5.766  -3.260
  227   1HG1  ILE  29          HG12      ILE  29  -2.762   3.578  -3.960
  228   2HG1  ILE  29          HG11      ILE  29  -3.708   3.565  -2.478
  229   1HG2  ILE  29          HG21      ILE  29  -6.330   4.467  -4.643
  230   2HG2  ILE  29          HG22      ILE  29  -6.280   5.996  -3.766
  231   3HG2  ILE  29          HG23      ILE  29  -6.172   4.473  -2.886
  232   1HD1  ILE  29          HD11      ILE  29  -4.653   2.524  -5.177
  233   2HD1  ILE  29          HD12      ILE  29  -5.582   2.492  -3.688
  234   3HD1  ILE  29          HD13      ILE  29  -4.117   1.538  -3.826
  235    H    GLN  30           HN       GLN  30  -3.757   7.816  -4.769
  236    HA   GLN  30           HA       GLN  30  -6.301   8.806  -5.636
  237   1HB   GLN  30          HB2       GLN  30  -3.678  10.222  -5.089
  238   2HB   GLN  30          HB1       GLN  30  -5.166  11.061  -5.513
  239   1HG   GLN  30          HG2       GLN  30  -6.284  10.134  -3.524
  240   2HG   GLN  30          HG1       GLN  30  -4.827   9.243  -3.097
  241   1HE2  GLN  30          HE21      GLN  30  -6.146  11.381  -1.516
  242   2HE2  GLN  30          HE22      GLN  30  -4.981  12.603  -1.333
  243    H    TYR  31           HN       TYR  31  -3.158   8.674  -7.327
  244    HA   TYR  31           HA       TYR  31  -4.125  10.086  -9.587
  245   1HB   TYR  31          HB2       TYR  31  -1.718   9.805  -9.184
  246   2HB   TYR  31          HB1       TYR  31  -1.880   8.062  -9.399
  247    HD1  TYR  31           HD1      TYR  31  -2.317  11.346 -11.130
  248    HD2  TYR  31           HD2      TYR  31  -1.913   7.090 -11.567
  249    HE1  TYR  31           HE1      TYR  31  -2.084  11.618 -13.583
  250    HE2  TYR  31           HE2      TYR  31  -1.680   7.364 -14.019
  251    HH   TYR  31           HH       TYR  31  -2.334  10.359 -15.604
  252    H    ALA  32           HN       ALA  32  -4.069   6.665  -8.701
  253    HA   ALA  32           HA       ALA  32  -5.008   5.711 -11.203
  254   1HB   ALA  32          HB1       ALA  32  -3.834   4.262  -9.649
  255   2HB   ALA  32          HB2       ALA  32  -5.445   3.616  -9.961
  256   3HB   ALA  32          HB3       ALA  32  -5.112   4.465  -8.451
  257    H    PHE  33           HN       PHE  33  -6.584   6.645  -8.183
  258    HA   PHE  33           HA       PHE  33  -9.253   6.319  -9.462
  259   1HB   PHE  33          HB2       PHE  33  -8.495   6.093  -6.550
  260   2HB   PHE  33          HB1       PHE  33 -10.138   6.022  -7.185
  261    HD1  PHE  33           HD1      PHE  33  -6.907   4.272  -6.946
  262    HD2  PHE  33           HD2      PHE  33 -10.897   4.124  -8.530
  263    HE1  PHE  33           HE1      PHE  33  -6.615   1.864  -7.461
  264    HE2  PHE  33           HE2      PHE  33 -10.608   1.717  -9.039
  265    HZ   PHE  33           HZ       PHE  33  -8.467   0.584  -8.504
  266    HA   PRO  34           HA       PRO  34  -8.760  10.821  -8.586
  267   1HB   PRO  34          HB2       PRO  34 -10.328  11.372 -10.957
  268   2HB   PRO  34          HB1       PRO  34  -8.619  11.709 -10.655
  269   1HG   PRO  34          HG2       PRO  34  -9.597   9.822 -12.441
  270   2HG   PRO  34          HG1       PRO  34  -7.949   9.872 -11.796
  271   1HD   PRO  34          HD2       PRO  34 -10.215   8.089 -11.027
  272   2HD   PRO  34          HD1       PRO  34  -8.462   7.794 -10.972
  273    H    ASP  35           HN       ASP  35 -11.568   8.924  -9.424
  274    HA   ASP  35           HA       ASP  35 -13.493  10.906  -8.502
  275   1HB   ASP  35          HB2       ASP  35 -13.761   8.199  -9.790
  276   2HB   ASP  35          HB1       ASP  35 -15.143   9.152  -9.253
  277    H    ASN  36           HN       ASN  36 -11.837   8.264  -6.968
  278    HA   ASN  36           HA       ASN  36 -14.064   8.043  -5.004
  279   1HB   ASN  36          HB2       ASN  36 -12.170   5.961  -6.045
  280   2HB   ASN  36          HB1       ASN  36 -13.160   5.726  -4.607
  281   1HD2  ASN  36          HD21      ASN  36 -13.465   4.207  -7.099
  282   2HD2  ASN  36          HD22      ASN  36 -15.013   4.557  -7.701
  283    H    GLU  37           HN       GLU  37 -13.464   8.578  -2.811
  284    HA   GLU  37           HA       GLU  37 -10.924   9.488  -2.131
  285   1HB   GLU  37          HB2       GLU  37 -11.803   9.272   0.155
  286   2HB   GLU  37          HB1       GLU  37 -12.898  10.104  -0.944
  287   1HG   GLU  37          HG2       GLU  37 -14.019   7.796  -1.280
  288   2HG   GLU  37          HG1       GLU  37 -13.121   7.296   0.149
  289    H    GLY  38           HN       GLY  38  -9.108   8.274  -1.791
  290   1HA   GLY  38          HA2       GLY  38  -9.380   5.371  -1.118
  291   2HA   GLY  38          HA1       GLY  38  -8.049   5.952  -1.868
  292    H    HIS  39           HN       HIS  39  -8.866   4.887   1.141
  293    HA   HIS  39           HA       HIS  39  -6.986   6.757   2.439
  294   1HB   HIS  39          HB2       HIS  39  -9.177   5.057   3.669
  295   2HB   HIS  39          HB1       HIS  39  -8.062   6.088   4.567
  296    HD1  HIS  39           HD1      HIS  39  -8.052   8.713   3.485
  297    HD2  HIS  39           HD2      HIS  39 -11.510   6.416   3.096
  298    HE1  HIS  39           HE1      HIS  39  -9.940  10.335   3.020
  299    H    VAL  40           HN       VAL  40  -5.032   5.783   2.897
  300    HA   VAL  40           HA       VAL  40  -4.905   2.841   2.903
  301    HB   VAL  40           HB       VAL  40  -2.800   4.886   2.197
  302   1HG1  VAL  40          HG11      VAL  40  -1.692   2.718   1.326
  303   2HG1  VAL  40          HG12      VAL  40  -2.811   1.874   2.392
  304   3HG1  VAL  40          HG13      VAL  40  -1.646   3.016   3.062
  305   1HG2  VAL  40          HG21      VAL  40  -3.125   3.902  -0.091
  306   2HG2  VAL  40          HG22      VAL  40  -4.562   4.741   0.500
  307   3HG2  VAL  40          HG23      VAL  40  -4.488   2.979   0.537
  308    H    SER  41           HN       SER  41  -4.218   1.855   4.675
  309    HA   SER  41           HA       SER  41  -2.748   3.406   6.736
  310   1HB   SER  41          HB2       SER  41  -4.955   3.153   7.637
  311   2HB   SER  41          HB1       SER  41  -5.021   1.459   7.165
  312    HG   SER  41           HG       SER  41  -3.477   0.993   8.693
  313    H    VAL  42           HN       VAL  42  -1.090   2.418   7.768
  314    HA   VAL  42           HA       VAL  42  -0.510  -0.387   7.055
  315    HB   VAL  42           HB       VAL  42   1.493   1.891   7.078
  316   1HG1  VAL  42          HG11      VAL  42   2.548  -0.118   7.896
  317   2HG1  VAL  42          HG12      VAL  42   3.048   0.090   6.219
  318   3HG1  VAL  42          HG13      VAL  42   1.801  -1.089   6.625
  319   1HG2  VAL  42          HG21      VAL  42   1.602   1.725   4.730
  320   2HG2  VAL  42          HG22      VAL  42  -0.124   1.609   5.062
  321   3HG2  VAL  42          HG23      VAL  42   0.807   0.154   4.709
  322    H    ARG  43           HN       ARG  43  -0.076  -1.646   8.737
  323    HA   ARG  43           HA       ARG  43   1.103  -0.470  11.143
  324   1HB   ARG  43          HB2       ARG  43  -1.449  -2.095  11.316
  325   2HB   ARG  43          HB1       ARG  43  -0.610  -1.280  12.636
  326   1HG   ARG  43          HG2       ARG  43  -1.008   0.899  11.453
  327   2HG   ARG  43          HG1       ARG  43  -1.999   0.018  10.285
  328   1HD   ARG  43          HD2       ARG  43  -3.417  -0.797  12.173
  329   2HD   ARG  43          HD1       ARG  43  -2.487   0.224  13.267
  330    HE   ARG  43           HE       ARG  43  -3.371   1.890  11.233
  331   1HH1  ARG  43          HH11      ARG  43  -4.103   1.840  14.278
  332   2HH1  ARG  43          HH12      ARG  43  -5.831   1.872  14.171
  333   1HH2  ARG  43          HH21      ARG  43  -5.903   1.048  10.804
  334   2HH2  ARG  43          HH22      ARG  43  -6.851   1.423  12.204
  335    H    TYR  44           HN       TYR  44   1.816  -2.088  12.705
  336    HA   TYR  44           HA       TYR  44   2.803  -4.506  11.393
  337   1HB   TYR  44          HB2       TYR  44   3.215  -3.319  14.151
  338   2HB   TYR  44          HB1       TYR  44   3.875  -4.878  13.670
  339    HD1  TYR  44           HD1      TYR  44   5.191  -4.846  11.343
  340    HD2  TYR  44           HD2      TYR  44   4.564  -1.427  13.871
  341    HE1  TYR  44           HE1      TYR  44   7.165  -3.735  10.336
  342    HE2  TYR  44           HE2      TYR  44   6.533  -0.316  12.855
  343    HH   TYR  44           HH       TYR  44   8.485  -1.954  10.360
  344    H    ALA  45           HN       ALA  45   2.155  -6.537  11.737
  345    HA   ALA  45           HA       ALA  45   0.134  -7.087  13.805
  346   1HB   ALA  45          HB1       ALA  45  -0.182  -7.843  10.886
  347   2HB   ALA  45          HB2       ALA  45  -1.093  -6.574  11.707
  348   3HB   ALA  45          HB3       ALA  45  -1.286  -8.257  12.198
  349    H    ALA  46           HN       ALA  46  -0.210  -9.526  13.981
  350    HA   ALA  46           HA       ALA  46   2.299 -10.774  14.306
  351   1HB   ALA  46          HB1       ALA  46  -0.293 -12.301  13.990
  352   2HB   ALA  46          HB2       ALA  46   0.062 -11.386  15.455
  353   3HB   ALA  46          HB3       ALA  46   1.105 -12.724  14.977
  354    H    ALA  47           HN       ALA  47   0.151 -10.607  11.559
  355    HA   ALA  47           HA       ALA  47   2.168 -12.122  10.015
  356   1HB   ALA  47          HB1       ALA  47  -0.776 -12.582   9.589
  357   2HB   ALA  47          HB2       ALA  47   0.148 -13.540  10.746
  358   3HB   ALA  47          HB3       ALA  47   0.585 -13.560   9.037
  359    H    ASN  48           HN       ASN  48   2.256 -11.722   7.784
  360    HA   ASN  48           HA       ASN  48   1.588  -9.028   6.990
  361   1HB   ASN  48          HB2       ASN  48   2.642 -11.421   5.453
  362   2HB   ASN  48          HB1       ASN  48   2.404  -9.827   4.742
  363   1HD2  ASN  48          HD21      ASN  48   4.762 -11.746   6.109
  364   2HD2  ASN  48          HD22      ASN  48   5.809 -10.532   6.668
  365    H    ASN  49           HN       ASN  49  -0.341  -8.392   6.121
  366    HA   ASN  49           HA       ASN  49  -1.936 -10.251   4.532
  367   1HB   ASN  49          HB2       ASN  49  -2.608 -10.624   6.933
  368   2HB   ASN  49          HB1       ASN  49  -3.154  -8.949   6.970
  369   1HD2  ASN  49          HD21      ASN  49  -5.414  -9.036   6.831
  370   2HD2  ASN  49          HD22      ASN  49  -6.271  -9.955   5.690
  371    H    LEU  50           HN       LEU  50  -3.465  -9.196   3.230
  372    HA   LEU  50           HA       LEU  50  -3.414  -6.232   3.238
  373   1HB   LEU  50          HB2       LEU  50  -1.982  -7.171   1.437
  374   2HB   LEU  50          HB1       LEU  50  -3.361  -8.072   0.821
  375    HG   LEU  50           HG       LEU  50  -3.872  -5.151   1.188
  376   1HD1  LEU  50          HD11      LEU  50  -1.988  -6.082  -1.006
  377   2HD1  LEU  50          HD12      LEU  50  -1.526  -5.082   0.372
  378   3HD1  LEU  50          HD13      LEU  50  -2.660  -4.462  -0.825
  379   1HD2  LEU  50          HD21      LEU  50  -4.976  -5.401  -0.967
  380   2HD2  LEU  50          HD22      LEU  50  -5.446  -6.748   0.071
  381   3HD2  LEU  50          HD23      LEU  50  -4.246  -6.989  -1.201
  382    H    SER  51           HN       SER  51  -5.500  -5.498   3.528
  383    HA   SER  51           HA       SER  51  -7.745  -7.255   2.672
  384   1HB   SER  51          HB2       SER  51  -7.700  -7.242   5.061
  385   2HB   SER  51          HB1       SER  51  -7.455  -5.499   5.112
  386    HG   SER  51           HG       SER  51  -9.752  -6.988   4.610
  387    H    VAL  52           HN       VAL  52  -9.176  -6.292   1.289
  388    HA   VAL  52           HA       VAL  52  -9.140  -3.348   1.059
  389    HB   VAL  52           HB       VAL  52  -9.570  -5.340  -1.183
  390   1HG1  VAL  52          HG11      VAL  52  -9.486  -2.321  -1.051
  391   2HG1  VAL  52          HG12      VAL  52 -10.797  -3.343  -1.640
  392   3HG1  VAL  52          HG13      VAL  52  -9.299  -3.212  -2.562
  393   1HG2  VAL  52          HG21      VAL  52  -7.260  -5.415  -0.623
  394   2HG2  VAL  52          HG22      VAL  52  -7.187  -3.673  -0.354
  395   3HG2  VAL  52          HG23      VAL  52  -7.370  -4.307  -1.991
  396    H    ILE  53           HN       ILE  53 -11.087  -2.427   1.472
  397    HA   ILE  53           HA       ILE  53 -13.510  -4.132   1.251
  398    HB   ILE  53           HB       ILE  53 -12.965  -1.860   3.180
  399   1HG1  ILE  53          HG12      ILE  53 -13.286  -4.800   3.839
  400   2HG1  ILE  53          HG11      ILE  53 -11.703  -4.079   3.540
  401   1HG2  ILE  53          HG21      ILE  53 -15.308  -1.972   2.699
  402   2HG2  ILE  53          HG22      ILE  53 -15.081  -2.810   4.235
  403   3HG2  ILE  53          HG23      ILE  53 -15.300  -3.735   2.749
  404   1HD1  ILE  53          HD11      ILE  53 -11.902  -2.608   5.392
  405   2HD1  ILE  53          HD12      ILE  53 -12.484  -4.164   5.984
  406   3HD1  ILE  53          HD13      ILE  53 -13.635  -2.902   5.541
  407    H    GLY  54           HN       GLY  54 -15.035  -3.417  -0.120
  408   1HA   GLY  54          HA2       GLY  54 -16.470  -1.790  -1.062
  409   2HA   GLY  54          HA1       GLY  54 -15.309  -0.540  -0.626
  410    H    ALA  55           HN       ALA  55 -13.929  -3.297  -2.194
  411    HA   ALA  55           HA       ALA  55 -13.861  -1.789  -4.756
  412   1HB   ALA  55          HB1       ALA  55 -11.591  -3.538  -3.837
  413   2HB   ALA  55          HB2       ALA  55 -11.713  -1.865  -3.296
  414   3HB   ALA  55          HB3       ALA  55 -11.576  -2.226  -5.017
  415    H    THR  56           HN       THR  56 -13.369  -3.024  -6.643
  416    HA   THR  56           HA       THR  56 -14.812  -5.601  -6.868
  417    HB   THR  56           HB       THR  56 -14.685  -5.148  -9.201
  418    HG1  THR  56           HG1      THR  56 -13.015  -4.113  -9.885
  419   1HG2  THR  56          HG21      THR  56 -15.876  -3.024  -9.345
  420   2HG2  THR  56          HG22      THR  56 -15.257  -2.541  -7.766
  421   3HG2  THR  56          HG23      THR  56 -16.390  -3.887  -7.894
  422    H    LYS  57           HN       LYS  57 -13.890  -7.331  -7.944
  423    HA   LYS  57           HA       LYS  57 -11.407  -8.149  -7.010
  424   1HB   LYS  57          HB2       LYS  57 -12.885  -9.112  -9.482
  425   2HB   LYS  57          HB1       LYS  57 -11.597  -9.984  -8.662
  426   1HG   LYS  57          HG2       LYS  57 -13.004 -10.145  -6.618
  427   2HG   LYS  57          HG1       LYS  57 -14.294  -9.265  -7.448
  428   1HD   LYS  57          HD2       LYS  57 -14.401 -11.048  -9.154
  429   2HD   LYS  57          HD1       LYS  57 -13.117 -11.922  -8.319
  430   1HE   LYS  57          HE2       LYS  57 -14.508 -12.213  -6.356
  431   2HE   LYS  57          HE1       LYS  57 -15.759 -11.174  -7.038
  432   1HZ   LYS  57          HZ1       LYS  57 -15.376 -13.935  -7.414
  433   2HZ   LYS  57          HZ2       LYS  57 -15.207 -13.154  -8.913
  434   3HZ   LYS  57          HZ3       LYS  57 -16.625 -12.951  -8.002
  435    H    GLU  58           HN       GLU  58 -12.159  -6.619 -10.192
  436    HA   GLU  58           HA       GLU  58  -9.535  -6.989 -11.241
  437   1HB   GLU  58          HB2       GLU  58 -11.588  -6.488 -12.594
  438   2HB   GLU  58          HB1       GLU  58 -11.563  -4.853 -11.931
  439   1HG   GLU  58          HG2       GLU  58  -9.304  -4.506 -12.850
  440   2HG   GLU  58          HG1       GLU  58  -9.314  -6.142 -13.502
  441    H    ASP  59           HN       ASP  59 -11.062  -4.382  -9.359
  442    HA   ASP  59           HA       ASP  59  -8.945  -2.526  -9.590
  443   1HB   ASP  59          HB2       ASP  59 -11.035  -2.939  -7.444
  444   2HB   ASP  59          HB1       ASP  59  -9.890  -1.597  -7.435
  445    H    LYS  60           HN       LYS  60  -9.723  -5.075  -7.309
  446    HA   LYS  60           HA       LYS  60  -7.534  -4.666  -5.557
  447   1HB   LYS  60          HB2       LYS  60  -9.520  -6.029  -4.940
  448   2HB   LYS  60          HB1       LYS  60  -9.031  -7.246  -6.118
  449   1HG   LYS  60          HG2       LYS  60  -6.909  -7.581  -4.893
  450   2HG   LYS  60          HG1       LYS  60  -7.400  -6.364  -3.714
  451   1HD   LYS  60          HD2       LYS  60  -9.347  -7.722  -3.093
  452   2HD   LYS  60          HD1       LYS  60  -8.913  -8.925  -4.308
  453   1HE   LYS  60          HE2       LYS  60  -8.083  -9.746  -2.215
  454   2HE   LYS  60          HE1       LYS  60  -6.682  -9.158  -3.109
  455   1HZ   LYS  60          HZ1       LYS  60  -7.279  -8.439  -0.602
  456   2HZ   LYS  60          HZ2       LYS  60  -8.009  -7.177  -1.475
  457   3HZ   LYS  60          HZ3       LYS  60  -6.352  -7.497  -1.665
  458    H    GLN  61           HN       GLN  61  -7.744  -6.628  -8.537
  459    HA   GLN  61           HA       GLN  61  -5.165  -7.782  -8.154
  460   1HB   GLN  61          HB2       GLN  61  -6.817  -7.246 -10.643
  461   2HB   GLN  61          HB1       GLN  61  -5.273  -8.102 -10.666
  462   1HG   GLN  61          HG2       GLN  61  -6.130  -9.847  -9.244
  463   2HG   GLN  61          HG1       GLN  61  -7.608  -8.939  -8.931
  464   1HE2  GLN  61          HE21      GLN  61  -7.903 -11.510  -9.962
  465   2HE2  GLN  61          HE22      GLN  61  -8.396 -11.429 -11.584
  466    H    ARG  62           HN       ARG  62  -6.351  -4.793  -9.758
  467    HA   ARG  62           HA       ARG  62  -3.859  -3.997 -10.756
  468   1HB   ARG  62          HB2       ARG  62  -5.977  -2.909 -11.455
  469   2HB   ARG  62          HB1       ARG  62  -6.178  -2.255  -9.831
  470   1HG   ARG  62          HG2       ARG  62  -4.070  -0.981 -10.083
  471   2HG   ARG  62          HG1       ARG  62  -3.869  -1.635 -11.706
  472   1HD   ARG  62          HD2       ARG  62  -5.986  -0.579 -12.395
  473   2HD   ARG  62          HD1       ARG  62  -6.193   0.067 -10.768
  474    HE   ARG  62           HE       ARG  62  -3.741   0.999 -11.489
  475   1HH1  ARG  62          HH11      ARG  62  -6.728   2.252 -11.615
  476   2HH1  ARG  62          HH12      ARG  62  -6.533   3.199 -13.052
  477   1HH2  ARG  62          HH21      ARG  62  -3.532   1.706 -13.946
  478   2HH2  ARG  62          HH22      ARG  62  -4.722   2.890 -14.373
  479    H    ILE  63           HN       ILE  63  -5.439  -3.321  -7.665
  480    HA   ILE  63           HA       ILE  63  -3.381  -1.692  -6.655
  481    HB   ILE  63           HB       ILE  63  -5.432  -3.370  -5.248
  482   1HG1  ILE  63          HG12      ILE  63  -5.173  -0.366  -5.420
  483   2HG1  ILE  63          HG11      ILE  63  -6.077  -1.307  -6.606
  484   1HG2  ILE  63          HG21      ILE  63  -3.384  -1.476  -4.077
  485   2HG2  ILE  63          HG22      ILE  63  -3.596  -3.183  -3.688
  486   3HG2  ILE  63          HG23      ILE  63  -4.821  -2.012  -3.208
  487   1HD1  ILE  63          HD11      ILE  63  -7.582  -0.459  -4.856
  488   2HD1  ILE  63          HD12      ILE  63  -6.600  -1.244  -3.618
  489   3HD1  ILE  63          HD13      ILE  63  -7.492  -2.219  -4.787
  490    H    SER  64           HN       SER  64  -3.773  -5.193  -6.484
  491    HA   SER  64           HA       SER  64  -1.479  -5.652  -4.874
  492   1HB   SER  64          HB2       SER  64  -3.114  -7.435  -5.363
  493   2HB   SER  64          HB1       SER  64  -2.649  -7.400  -7.062
  494    HG   SER  64           HG       SER  64  -0.639  -7.696  -5.147
  495    H    GLU  65           HN       GLU  65  -1.890  -5.344  -8.461
  496    HA   GLU  65           HA       GLU  65   0.809  -5.834  -9.076
  497   1HB   GLU  65          HB2       GLU  65  -1.310  -4.205 -10.513
  498   2HB   GLU  65          HB1       GLU  65   0.293  -4.517 -11.185
  499   1HG   GLU  65          HG2       GLU  65  -0.103  -6.944 -11.020
  500   2HG   GLU  65          HG1       GLU  65  -1.700  -6.643 -10.341
  501    H    ILE  66           HN       ILE  66  -0.892  -2.844  -8.236
  502    HA   ILE  66           HA       ILE  66   1.247  -1.068  -8.635
  503    HB   ILE  66           HB       ILE  66  -1.136  -0.990  -6.782
  504   1HG1  ILE  66          HG12      ILE  66  -0.444   0.625  -9.257
  505   2HG1  ILE  66          HG11      ILE  66  -1.418  -0.843  -9.289
  506   1HG2  ILE  66          HG21      ILE  66  -0.515   1.515  -6.650
  507   2HG2  ILE  66          HG22      ILE  66   1.100   1.004  -7.148
  508   3HG2  ILE  66          HG23      ILE  66   0.407   0.397  -5.646
  509   1HD1  ILE  66          HD11      ILE  66  -3.177   0.153  -8.072
  510   2HD1  ILE  66          HD12      ILE  66  -2.656   1.433  -9.165
  511   3HD1  ILE  66          HD13      ILE  66  -2.151   1.457  -7.478
  512    H    LEU  67           HN       LEU  67   0.267  -2.838  -5.725
  513    HA   LEU  67           HA       LEU  67   2.266  -1.817  -4.023
  514   1HB   LEU  67          HB2       LEU  67   0.428  -3.034  -3.033
  515   2HB   LEU  67          HB1       LEU  67   0.766  -4.453  -4.014
  516    HG   LEU  67           HG       LEU  67   2.999  -4.658  -2.819
  517   1HD1  LEU  67          HD11      LEU  67   1.855  -2.284  -1.355
  518   2HD1  LEU  67          HD12      LEU  67   3.523  -2.608  -1.834
  519   3HD1  LEU  67          HD13      LEU  67   2.824  -3.448  -0.455
  520   1HD2  LEU  67          HD21      LEU  67   0.418  -4.782  -1.235
  521   2HD2  LEU  67          HD22      LEU  67   1.935  -5.503  -0.696
  522   3HD2  LEU  67          HD23      LEU  67   1.160  -6.079  -2.172
  523    H    GLN  68           HN       GLN  68   2.236  -4.524  -6.280
  524    HA   GLN  68           HA       GLN  68   4.819  -5.515  -5.609
  525   1HB   GLN  68          HB2       GLN  68   3.182  -5.691  -8.147
  526   2HB   GLN  68          HB1       GLN  68   4.732  -6.507  -7.930
  527   1HG   GLN  68          HG2       GLN  68   3.846  -7.714  -5.985
  528   2HG   GLN  68          HG1       GLN  68   2.308  -6.875  -6.148
  529   1HE2  GLN  68          HE21      GLN  68   0.765  -7.874  -7.469
  530   2HE2  GLN  68          HE22      GLN  68   1.104  -9.125  -8.565
  531    H    GLU  69           HN       GLU  69   3.840  -3.299  -8.300
  532    HA   GLU  69           HA       GLU  69   6.444  -2.868  -9.214
  533   1HB   GLU  69          HB2       GLU  69   3.996  -1.108  -9.367
  534   2HB   GLU  69          HB1       GLU  69   5.502  -0.771 -10.220
  535   1HG   GLU  69          HG2       GLU  69   5.353  -2.957 -11.355
  536   2HG   GLU  69          HG1       GLU  69   3.848  -3.296 -10.505
  537    H    THR  70           HN       THR  70   4.623  -0.977  -6.798
  538    HA   THR  70           HA       THR  70   6.523   1.059  -6.430
  539    HB   THR  70           HB       THR  70   4.586  -0.148  -4.487
  540    HG1  THR  70           HG1      THR  70   3.553   0.714  -6.237
  541   1HG2  THR  70          HG21      THR  70   5.953   1.078  -3.060
  542   2HG2  THR  70          HG22      THR  70   4.798   2.313  -3.561
  543   3HG2  THR  70          HG23      THR  70   6.390   2.239  -4.316
  544    H    TRP  71           HN       TRP  71   6.023  -1.959  -4.765
  545    HA   TRP  71           HA       TRP  71   8.084  -1.834  -2.937
  546   1HB   TRP  71          HB2       TRP  71   6.143  -3.362  -2.931
  547   2HB   TRP  71          HB1       TRP  71   6.872  -4.234  -4.265
  548    HD1  TRP  71           HD1      TRP  71   7.600  -6.447  -3.310
  549    HE1  TRP  71           HE1      TRP  71   8.986  -7.248  -1.301
  550    HE3  TRP  71           HE3      TRP  71   8.263  -2.003  -0.790
  551    HZ2  TRP  71           HZ2      TRP  71  10.189  -6.190   1.045
  552    HZ3  TRP  71           HZ3      TRP  71   9.521  -1.965   1.323
  553    HH2  TRP  71           HH2      TRP  71  10.478  -4.047   2.254
  554    H    GLU  72           HN       GLU  72   8.074  -2.995  -6.235
  555    HA   GLU  72           HA       GLU  72  10.782  -3.901  -6.161
  556   1HB   GLU  72          HB2       GLU  72   8.853  -3.430  -8.441
  557   2HB   GLU  72          HB1       GLU  72  10.491  -4.038  -8.683
  558   1HG   GLU  72          HG2       GLU  72   8.500  -5.338  -6.811
  559   2HG   GLU  72          HG1       GLU  72   8.714  -5.835  -8.488
  560    H    SER  73           HN       SER  73   9.395  -0.740  -6.591
  561    HA   SER  73           HA       SER  73  11.918   0.201  -7.832
  562   1HB   SER  73          HB2       SER  73  10.647   2.255  -8.376
  563   2HB   SER  73          HB1       SER  73   9.874   0.820  -9.047
  564    HG   SER  73           HG       SER  73   8.474   2.338  -7.884
  565    H    ALA  74           HN       ALA  74  11.311  -0.449  -4.917
  566    HA   ALA  74           HA       ALA  74  11.066   1.689  -3.292
  567   1HB   ALA  74          HB1       ALA  74  12.268   0.376  -1.639
  568   2HB   ALA  74          HB2       ALA  74  12.882  -0.677  -2.914
  569   3HB   ALA  74          HB3       ALA  74  11.152  -0.625  -2.569
  570    H    ASP  75           HN       ASP  75  14.109   0.734  -4.869
  571    HA   ASP  75           HA       ASP  75  15.793   2.401  -3.323
  572   1HB   ASP  75          HB2       ASP  75  16.084   1.259  -6.096
  573   2HB   ASP  75          HB1       ASP  75  17.357   2.181  -5.301
  574    H    ASP  76           HN       ASP  76  13.589   3.217  -5.892
  575    HA   ASP  76           HA       ASP  76  14.967   5.751  -6.490
  576   1HB   ASP  76          HB2       ASP  76  12.509   4.409  -7.619
  577   2HB   ASP  76          HB1       ASP  76  13.067   6.005  -8.116
  578    H    TRP  77           HN       TRP  77  11.790   4.738  -5.170
  579    HA   TRP  77           HA       TRP  77  11.181   7.555  -4.586
  580   1HB   TRP  77          HB2       TRP  77   8.981   6.908  -4.187
  581   2HB   TRP  77          HB1       TRP  77   9.512   5.958  -5.556
  582    HD1  TRP  77           HD1      TRP  77   9.515   3.334  -5.302
  583    HE1  TRP  77           HE1      TRP  77   8.808   1.738  -3.429
  584    HE3  TRP  77           HE3      TRP  77   8.972   6.651  -1.349
  585    HZ2  TRP  77           HZ2      TRP  77   8.114   1.805  -0.685
  586    HZ3  TRP  77           HZ3      TRP  77   8.282   5.800   0.839
  587    HH2  TRP  77           HH2      TRP  77   7.859   3.404   1.178
  588    H    PHE  78           HN       PHE  78  12.435   4.867  -2.765
  589    HA   PHE  78           HA       PHE  78  11.572   6.089  -0.220
  590   1HB   PHE  78          HB2       PHE  78  11.529   3.697  -0.193
  591   2HB   PHE  78          HB1       PHE  78  13.165   3.602  -0.815
  592    HD1  PHE  78           HD1      PHE  78  15.118   4.057   0.577
  593    HD2  PHE  78           HD2      PHE  78  11.127   4.426   2.153
  594    HE1  PHE  78           HE1      PHE  78  16.033   4.188   2.864
  595    HE2  PHE  78           HE2      PHE  78  12.057   4.549   4.445
  596    HZ   PHE  78           HZ       PHE  78  14.508   4.430   4.804
  597    H    VAL  79           HN       VAL  79  12.677   7.467   0.889
  598    HA   VAL  79           HA       VAL  79  15.527   7.930   0.244
  599    HB   VAL  79           HB       VAL  79  13.724  10.105   1.301
  600   1HG1  VAL  79          HG11      VAL  79  16.123  10.552   1.091
  601   2HG1  VAL  79          HG12      VAL  79  15.230  11.501  -0.096
  602   3HG1  VAL  79          HG13      VAL  79  16.091  10.048  -0.600
  603   1HG2  VAL  79          HG21      VAL  79  12.407   9.214  -0.539
  604   2HG2  VAL  79          HG22      VAL  79  13.839   9.126  -1.571
  605   3HG2  VAL  79          HG23      VAL  79  13.196  10.695  -1.092
  606    H    SER  80           HN       SER  80  16.886   8.541   2.148
  607    HA   SER  80           HA       SER  80  15.559   8.312   4.774
  608   1HB   SER  80          HB2       SER  80  16.368   6.035   4.221
  609   2HB   SER  80          HB1       SER  80  17.990   6.674   3.975
  610    HG   SER  80           HG       SER  80  17.304   7.605   6.269
  611    H    GLU  81           HN       GLU  81  16.427   9.563   6.308
  612    HA   GLU  81           HA       GLU  81  19.085  10.735   5.972
  613   1HB   GLU  81          HB2       GLU  81  17.597  12.256   4.709
  614   2HB   GLU  81          HB1       GLU  81  16.606  12.466   6.154
  615   1HG   GLU  81          HG2       GLU  81  18.471  13.446   7.359
  616   2HG   GLU  81          HG1       GLU  81  19.566  13.104   6.018
  Start of MODEL   14
    1   1H    MET   1          HT1       MET   1 -13.498   4.362  -0.086
    2   2H    MET   1          HT2       MET   1 -14.494   3.604  -1.235
    3   3H    MET   1          HT3       MET   1 -13.050   4.357  -1.722
    4    HA   MET   1           HA       MET   1 -13.470   1.737  -0.531
    5   1HB   MET   1          HB2       MET   1 -11.340   2.973  -2.294
    6   2HB   MET   1          HB1       MET   1 -11.441   1.266  -1.870
    7   1HG   MET   1          HG2       MET   1 -13.844   1.377  -2.834
    8   2HG   MET   1          HG1       MET   1 -13.323   2.886  -3.579
    9   1HE   MET   1          HE1       MET   1 -10.007   1.804  -3.817
   10   2HE   MET   1          HE2       MET   1 -10.953   3.072  -4.596
   11   3HE   MET   1          HE3       MET   1 -10.184   1.828  -5.578
   12    H    ARG   2           HN       ARG   2 -12.071   0.817   0.980
   13    HA   ARG   2           HA       ARG   2 -10.085   2.629   2.238
   14   1HB   ARG   2          HB2       ARG   2 -12.009   2.307   3.745
   15   2HB   ARG   2          HB1       ARG   2 -11.823   0.557   3.619
   16   1HG   ARG   2          HG2       ARG   2  -9.579   0.704   4.622
   17   2HG   ARG   2          HG1       ARG   2  -9.721   2.460   4.708
   18   1HD   ARG   2          HD2       ARG   2 -11.530   0.473   6.113
   19   2HD   ARG   2          HD1       ARG   2 -10.245   1.404   6.879
   20    HE   ARG   2           HE       ARG   2 -12.040   3.153   5.543
   21   1HH1  ARG   2          HH21      ARG   2 -13.965   1.326   6.979
   22   2HH1  ARG   2          HH22      ARG   2 -14.125   2.105   8.517
   23   1HH2  ARG   2          HH11      ARG   2 -11.291   4.065   8.117
   24   2HH2  ARG   2          HH12      ARG   2 -12.610   3.655   9.163
   25    H    ILE   3           HN       ILE   3  -8.089   1.857   2.387
   26    HA   ILE   3           HA       ILE   3  -7.607  -0.999   1.694
   27    HB   ILE   3           HB       ILE   3  -5.932   1.452   1.123
   28   1HG1  ILE   3          HG12      ILE   3  -6.327   0.358  -1.291
   29   2HG1  ILE   3          HG11      ILE   3  -7.760  -0.304  -0.514
   30   1HG2  ILE   3          HG21      ILE   3  -5.400  -1.501   0.819
   31   2HG2  ILE   3          HG22      ILE   3  -4.390  -0.274   1.582
   32   3HG2  ILE   3          HG23      ILE   3  -4.564  -0.304  -0.172
   33   1HD1  ILE   3          HD11      ILE   3  -7.073   2.651  -0.476
   34   2HD1  ILE   3          HD12      ILE   3  -8.598   1.897  -0.009
   35   3HD1  ILE   3          HD13      ILE   3  -8.102   1.907  -1.697
   36    H    GLU   4           HN       GLU   4  -6.699  -2.115   3.333
   37    HA   GLU   4           HA       GLU   4  -5.042  -0.652   5.335
   38   1HB   GLU   4          HB2       GLU   4  -7.195  -1.364   6.321
   39   2HB   GLU   4          HB1       GLU   4  -6.862  -3.030   5.853
   40   1HG   GLU   4          HG2       GLU   4  -4.832  -3.022   7.266
   41   2HG   GLU   4          HG1       GLU   4  -5.164  -1.356   7.731
   42    H    VAL   5           HN       VAL   5  -3.049  -1.331   5.550
   43    HA   VAL   5           HA       VAL   5  -2.294  -4.004   4.470
   44    HB   VAL   5           HB       VAL   5  -0.557  -1.535   4.566
   45   1HG1  VAL   5          HG11      VAL   5   0.603  -3.724   4.527
   46   2HG1  VAL   5          HG12      VAL   5   0.861  -2.820   3.036
   47   3HG1  VAL   5          HG13      VAL   5  -0.289  -4.156   3.069
   48   1HG2  VAL   5          HG21      VAL   5  -2.217  -0.935   3.002
   49   2HG2  VAL   5          HG22      VAL   5  -2.418  -2.590   2.439
   50   3HG2  VAL   5          HG23      VAL   5  -0.981  -1.678   1.988
   51    H    THR   6           HN       THR   6  -1.195  -5.360   5.774
   52    HA   THR   6           HA       THR   6  -0.124  -4.283   8.326
   53    HB   THR   6           HB       THR   6  -0.651  -6.555   9.276
   54    HG1  THR   6           HG1      THR   6  -2.588  -6.897   7.351
   55   1HG2  THR   6          HG21      THR   6  -2.038  -4.506   9.660
   56   2HG2  THR   6          HG22      THR   6  -2.986  -5.994   9.691
   57   3HG2  THR   6          HG23      THR   6  -3.021  -4.957   8.266
   58    H    ILE   7           HN       ILE   7   1.862  -4.811   8.854
   59    HA   ILE   7           HA       ILE   7   3.389  -6.641   7.092
   60    HB   ILE   7           HB       ILE   7   4.056  -4.072   8.508
   61   1HG1  ILE   7          HG12      ILE   7   3.063  -4.262   6.094
   62   2HG1  ILE   7          HG11      ILE   7   4.426  -3.187   6.372
   63   1HG2  ILE   7          HG21      ILE   7   6.433  -4.560   7.496
   64   2HG2  ILE   7          HG22      ILE   7   5.917  -6.249   7.550
   65   3HG2  ILE   7          HG23      ILE   7   5.986  -5.299   9.034
   66   1HD1  ILE   7          HD11      ILE   7   5.073  -6.005   5.602
   67   2HD1  ILE   7          HD12      ILE   7   5.889  -4.502   5.179
   68   3HD1  ILE   7          HD13      ILE   7   4.399  -4.956   4.356
   69    H    ALA   8           HN       ALA   8   4.415  -8.343   8.065
   70    HA   ALA   8           HA       ALA   8   3.861  -8.999  10.749
   71   1HB   ALA   8          HB1       ALA   8   4.338 -10.723   9.109
   72   2HB   ALA   8          HB2       ALA   8   5.547 -10.810  10.390
   73   3HB   ALA   8          HB3       ALA   8   5.952 -10.066   8.842
   74    H    LYS   9           HN       LYS   9   4.789  -8.546  12.500
   75    HA   LYS   9           HA       LYS   9   6.717  -6.557  12.805
   76   1HB   LYS   9          HB2       LYS   9   5.045  -7.135  14.547
   77   2HB   LYS   9          HB1       LYS   9   5.865  -8.667  14.812
   78   1HG   LYS   9          HG2       LYS   9   6.596  -7.169  16.546
   79   2HG   LYS   9          HG1       LYS   9   7.943  -7.342  15.429
   80   1HD   LYS   9          HD2       LYS   9   7.501  -5.199  14.431
   81   2HD   LYS   9          HD1       LYS   9   5.944  -5.072  15.253
   82   1HE   LYS   9          HE2       LYS   9   7.728  -3.709  16.343
   83   2HE   LYS   9          HE1       LYS   9   7.068  -4.943  17.416
   84   1HZ   LYS   9          HZ1       LYS   9   9.388  -5.619  15.760
   85   2HZ   LYS   9          HZ2       LYS   9   8.948  -6.198  17.295
   86   3HZ   LYS   9          HZ3       LYS   9   9.633  -4.652  17.131
   87    H    THR  10           HN       THR  10   7.095  -9.954  12.340
   88    HA   THR  10           HA       THR  10   9.693 -10.298  13.403
   89    HB   THR  10           HB       THR  10   9.757 -12.208  11.730
   90    HG1  THR  10           HG1      THR  10   8.401 -11.947  10.161
   91   1HG2  THR  10          HG21      THR  10   8.129 -13.515  12.963
   92   2HG2  THR  10          HG22      THR  10   7.274 -12.057  13.463
   93   3HG2  THR  10          HG23      THR  10   8.892 -12.386  14.081
   94    H    SER  11           HN       SER  11   8.519  -8.460  10.808
   95    HA   SER  11           HA       SER  11  11.220  -8.283   9.572
   96   1HB   SER  11          HB2       SER  11   8.492  -8.017   8.292
   97   2HB   SER  11          HB1       SER  11  10.004  -7.591   7.495
   98    HG   SER  11           HG       SER  11  10.230 -10.013   8.607
   99    HA   PRO  12           HA       PRO  12  10.081  -4.072  11.206
  100   1HB   PRO  12          HB2       PRO  12  12.751  -3.829  12.271
  101   2HB   PRO  12          HB1       PRO  12  11.245  -4.006  13.188
  102   1HG   PRO  12          HG2       PRO  12  13.268  -5.902  13.064
  103   2HG   PRO  12          HG1       PRO  12  11.595  -6.221  13.548
  104   1HD   PRO  12          HD2       PRO  12  12.937  -6.775  10.927
  105   2HD   PRO  12          HD1       PRO  12  11.652  -7.675  11.753
  106    H    LEU  13           HN       LEU  13  10.182  -2.328  10.151
  107    HA   LEU  13           HA       LEU  13  12.304  -2.042   8.105
  108   1HB   LEU  13          HB2       LEU  13   9.688  -0.536   8.227
  109   2HB   LEU  13          HB1       LEU  13  10.779  -0.710   6.853
  110    HG   LEU  13           HG       LEU  13   9.149  -2.925   8.137
  111   1HD1  LEU  13          HD11      LEU  13   9.003  -1.862   5.301
  112   2HD1  LEU  13          HD12      LEU  13   7.965  -1.265   6.596
  113   3HD1  LEU  13          HD13      LEU  13   7.878  -2.955   6.106
  114   1HD2  LEU  13          HD21      LEU  13  10.052  -4.212   6.084
  115   2HD2  LEU  13          HD22      LEU  13  11.168  -3.958   7.423
  116   3HD2  LEU  13          HD23      LEU  13  11.275  -2.947   5.982
  117    HA   PRO  14           HA       PRO  14  14.176   1.116  10.461
  118   1HB   PRO  14          HB2       PRO  14  14.334   3.150   8.384
  119   2HB   PRO  14          HB1       PRO  14  15.629   2.101   8.984
  120   1HG   PRO  14          HG2       PRO  14  14.041   1.852   6.543
  121   2HG   PRO  14          HG1       PRO  14  15.540   1.028   6.990
  122   1HD   PRO  14          HD2       PRO  14  13.045  -0.201   6.854
  123   2HD   PRO  14          HD1       PRO  14  14.423  -0.827   7.781
  124    H    ALA  15           HN       ALA  15  13.781   2.919  11.595
  125    HA   ALA  15           HA       ALA  15  11.164   3.560  12.256
  126   1HB   ALA  15          HB1       ALA  15  12.077   5.114  13.756
  127   2HB   ALA  15          HB2       ALA  15  13.473   5.426  12.722
  128   3HB   ALA  15          HB3       ALA  15  13.328   3.885  13.567
  129    H    GLY  16           HN       GLY  16  10.991   3.960   9.535
  130   1HA   GLY  16          HA2       GLY  16   9.917   6.595   9.332
  131   2HA   GLY  16          HA1       GLY  16  11.459   6.525   8.524
  132    H    ALA  17           HN       ALA  17  10.827   3.563   8.078
  133    HA   ALA  17           HA       ALA  17   9.957   3.868   5.372
  134   1HB   ALA  17          HB1       ALA  17  10.750   1.587   7.130
  135   2HB   ALA  17          HB2       ALA  17  11.477   2.129   5.619
  136   3HB   ALA  17          HB3       ALA  17   9.953   1.241   5.593
  137    H    ILE  18           HN       ILE  18   8.148   2.532   8.130
  138    HA   ILE  18           HA       ILE  18   6.018   1.664   6.523
  139    HB   ILE  18           HB       ILE  18   6.093   2.581   9.401
  140   1HG1  ILE  18          HG12      ILE  18   7.229   0.385   8.450
  141   2HG1  ILE  18          HG11      ILE  18   6.304   0.317   9.942
  142   1HG2  ILE  18          HG21      ILE  18   3.832   1.333   9.497
  143   2HG2  ILE  18          HG22      ILE  18   3.791   1.550   7.747
  144   3HG2  ILE  18          HG23      ILE  18   3.834   2.958   8.808
  145   1HD1  ILE  18          HD11      ILE  18   4.954  -0.219   7.302
  146   2HD1  ILE  18          HD12      ILE  18   4.472  -0.737   8.916
  147   3HD1  ILE  18          HD13      ILE  18   5.855  -1.491   8.124
  148    H    ASP  19           HN       ASP  19   6.465   4.764   8.225
  149    HA   ASP  19           HA       ASP  19   4.063   5.944   7.252
  150   1HB   ASP  19          HB2       ASP  19   6.655   7.207   8.198
  151   2HB   ASP  19          HB1       ASP  19   5.219   8.134   7.766
  152    H    ALA  20           HN       ALA  20   7.319   5.773   5.887
  153    HA   ALA  20           HA       ALA  20   6.720   7.506   3.743
  154   1HB   ALA  20          HB1       ALA  20   8.780   6.894   2.819
  155   2HB   ALA  20          HB2       ALA  20   8.694   5.254   3.467
  156   3HB   ALA  20          HB3       ALA  20   9.031   6.609   4.542
  157    H    LEU  21           HN       LEU  21   6.400   4.015   4.159
  158    HA   LEU  21           HA       LEU  21   5.682   3.342   1.555
  159   1HB   LEU  21          HB2       LEU  21   6.352   1.642   3.111
  160   2HB   LEU  21          HB1       LEU  21   5.091   2.101   4.247
  161    HG   LEU  21           HG       LEU  21   3.384   1.367   2.634
  162   1HD1  LEU  21          HD11      LEU  21   4.473   1.669   0.513
  163   2HD1  LEU  21          HD12      LEU  21   4.218  -0.065   0.696
  164   3HD1  LEU  21          HD13      LEU  21   5.812   0.627   0.989
  165   1HD2  LEU  21          HD21      LEU  21   3.686  -0.987   2.968
  166   2HD2  LEU  21          HD22      LEU  21   4.427  -0.177   4.349
  167   3HD2  LEU  21          HD23      LEU  21   5.439  -0.807   3.049
  168    H    ALA  22           HN       ALA  22   3.675   4.153   4.367
  169    HA   ALA  22           HA       ALA  22   1.149   3.877   3.097
  170   1HB   ALA  22          HB1       ALA  22   0.300   5.253   4.944
  171   2HB   ALA  22          HB2       ALA  22   1.945   5.717   5.372
  172   3HB   ALA  22          HB3       ALA  22   1.424   4.044   5.563
  173    H    GLY  23           HN       GLY  23   3.354   6.651   3.285
  174   1HA   GLY  23          HA2       GLY  23   1.540   8.461   1.990
  175   2HA   GLY  23          HA1       GLY  23   3.298   8.635   2.196
  176    H    GLU  24           HN       GLU  24   4.175   6.370   0.731
  177    HA   GLU  24           HA       GLU  24   3.865   7.354  -1.895
  178   1HB   GLU  24          HB2       GLU  24   5.868   6.052  -1.029
  179   2HB   GLU  24          HB1       GLU  24   4.880   4.595  -1.103
  180   1HG   GLU  24          HG2       GLU  24   6.130   4.695  -3.152
  181   2HG   GLU  24          HG1       GLU  24   4.465   5.120  -3.548
  182    H    LEU  25           HN       LEU  25   2.353   4.659  -0.187
  183    HA   LEU  25           HA       LEU  25   1.021   3.595  -2.442
  184   1HB   LEU  25          HB2       LEU  25   0.435   3.396   0.503
  185   2HB   LEU  25          HB1       LEU  25  -0.563   2.587  -0.700
  186    HG   LEU  25           HG       LEU  25   2.438   2.225  -0.467
  187   1HD1  LEU  25          HD11      LEU  25   1.314   1.394   1.553
  188   2HD1  LEU  25          HD12      LEU  25   1.878   0.040   0.574
  189   3HD1  LEU  25          HD13      LEU  25   0.173   0.489   0.562
  190   1HD2  LEU  25          HD21      LEU  25   0.290   1.087  -2.240
  191   2HD2  LEU  25          HD22      LEU  25   1.592   0.016  -1.738
  192   3HD2  LEU  25          HD23      LEU  25   1.964   1.486  -2.621
  193    H    SER  26           HN       SER  26  -0.044   6.039  -0.092
  194    HA   SER  26           HA       SER  26  -2.714   6.206  -0.995
  195   1HB   SER  26          HB2       SER  26  -2.743   8.411   0.107
  196   2HB   SER  26          HB1       SER  26  -2.014   7.174   1.125
  197    HG   SER  26           HG       SER  26  -0.808   9.275  -0.312
  198    H    ARG  27           HN       ARG  27   0.172   8.088  -1.995
  199    HA   ARG  27           HA       ARG  27  -1.208   9.787  -3.794
  200   1HB   ARG  27          HB2       ARG  27   1.648   8.772  -3.794
  201   2HB   ARG  27          HB1       ARG  27   1.043   9.987  -4.920
  202   1HG   ARG  27          HG2       ARG  27   0.404  11.435  -3.026
  203   2HG   ARG  27          HG1       ARG  27   1.010  10.225  -1.894
  204   1HD   ARG  27          HD2       ARG  27   3.263  10.432  -2.897
  205   2HD   ARG  27          HD1       ARG  27   2.654  11.668  -3.993
  206    HE   ARG  27           HE       ARG  27   2.010  12.696  -1.577
  207   1HH1  ARG  27          HH21      ARG  27   4.542  13.298  -3.388
  208   2HH1  ARG  27          HH22      ARG  27   5.762  13.356  -2.160
  209   1HH2  ARG  27          HH11      ARG  27   3.760  11.902   0.269
  210   2HH2  ARG  27          HH12      ARG  27   5.320  12.566  -0.090
  211    H    ARG  28           HN       ARG  28   0.197   6.549  -4.202
  212    HA   ARG  28           HA       ARG  28  -0.248   6.347  -6.988
  213   1HB   ARG  28          HB2       ARG  28   0.018   4.255  -4.834
  214   2HB   ARG  28          HB1       ARG  28  -0.150   3.861  -6.548
  215   1HG   ARG  28          HG2       ARG  28   1.837   5.229  -7.058
  216   2HG   ARG  28          HG1       ARG  28   2.014   5.615  -5.346
  217   1HD   ARG  28          HD2       ARG  28   2.280   3.201  -4.846
  218   2HD   ARG  28          HD1       ARG  28   2.141   2.842  -6.566
  219    HE   ARG  28           HE       ARG  28   4.461   3.895  -5.212
  220   1HH1  ARG  28          HH21      ARG  28   2.961   3.002  -8.163
  221   2HH1  ARG  28          HH22      ARG  28   4.246   3.584  -9.166
  222   1HH2  ARG  28          HH11      ARG  28   6.032   4.965  -6.538
  223   2HH2  ARG  28          HH12      ARG  28   5.984   4.696  -8.247
  224    H    ILE  29           HN       ILE  29  -2.265   5.556  -4.200
  225    HA   ILE  29           HA       ILE  29  -4.343   4.272  -5.635
  226    HB   ILE  29           HB       ILE  29  -4.345   5.674  -2.961
  227   1HG1  ILE  29          HG12      ILE  29  -2.963   3.480  -3.494
  228   2HG1  ILE  29          HG11      ILE  29  -3.905   3.578  -2.013
  229   1HG2  ILE  29          HG21      ILE  29  -6.509   4.178  -4.436
  230   2HG2  ILE  29          HG22      ILE  29  -6.622   5.693  -3.539
  231   3HG2  ILE  29          HG23      ILE  29  -6.458   4.166  -2.673
  232   1HD1  ILE  29          HD11      ILE  29  -4.155   1.419  -3.356
  233   2HD1  ILE  29          HD12      ILE  29  -5.021   2.370  -4.559
  234   3HD1  ILE  29          HD13      ILE  29  -5.657   2.231  -2.924
  235    H    GLN  30           HN       GLN  30  -3.900   7.613  -4.583
  236    HA   GLN  30           HA       GLN  30  -6.402   8.602  -5.536
  237   1HB   GLN  30          HB2       GLN  30  -4.865   9.818  -3.934
  238   2HB   GLN  30          HB1       GLN  30  -3.796  10.131  -5.298
  239   1HG   GLN  30          HG2       GLN  30  -5.497  11.421  -6.433
  240   2HG   GLN  30          HG1       GLN  30  -6.713  10.971  -5.237
  241   1HE2  GLN  30          HE21      GLN  30  -5.646  13.718  -5.946
  242   2HE2  GLN  30          HE22      GLN  30  -5.083  14.353  -4.476
  243    H    TYR  31           HN       TYR  31  -3.241   8.308  -7.203
  244    HA   TYR  31           HA       TYR  31  -4.171   9.683  -9.499
  245   1HB   TYR  31          HB2       TYR  31  -1.759   9.348  -9.080
  246   2HB   TYR  31          HB1       TYR  31  -1.968   7.607  -9.284
  247    HD1  TYR  31           HD1      TYR  31  -2.468   6.641 -11.489
  248    HD2  TYR  31           HD2      TYR  31  -1.884  10.866 -10.981
  249    HE1  TYR  31           HE1      TYR  31  -2.244   6.906 -13.947
  250    HE2  TYR  31           HE2      TYR  31  -1.659  11.131 -13.434
  251    HH   TYR  31           HH       TYR  31  -2.583   9.661 -15.532
  252    H    ALA  32           HN       ALA  32  -4.199   6.265  -8.573
  253    HA   ALA  32           HA       ALA  32  -5.164   5.340 -11.085
  254   1HB   ALA  32          HB1       ALA  32  -5.079   4.133  -8.328
  255   2HB   ALA  32          HB2       ALA  32  -4.101   3.728  -9.738
  256   3HB   ALA  32          HB3       ALA  32  -5.807   3.282  -9.693
  257    H    PHE  33           HN       PHE  33  -6.704   6.359  -8.080
  258    HA   PHE  33           HA       PHE  33  -9.388   6.050  -9.323
  259   1HB   PHE  33          HB2       PHE  33  -8.571   5.897  -6.418
  260   2HB   PHE  33          HB1       PHE  33 -10.224   5.817  -7.021
  261    HD1  PHE  33           HD1      PHE  33  -6.998   4.058  -6.807
  262    HD2  PHE  33           HD2      PHE  33 -11.030   3.875  -8.271
  263    HE1  PHE  33           HE1      PHE  33  -6.732   1.630  -7.235
  264    HE2  PHE  33           HE2      PHE  33 -10.766   1.449  -8.700
  265    HZ   PHE  33           HZ       PHE  33  -8.617   0.325  -8.181
  266    HA   PRO  34           HA       PRO  34  -8.765  10.570  -8.559
  267   1HB   PRO  34          HB2       PRO  34 -10.313  11.086 -10.956
  268   2HB   PRO  34          HB1       PRO  34  -8.601  11.410 -10.652
  269   1HG   PRO  34          HG2       PRO  34  -9.582   9.491 -12.397
  270   2HG   PRO  34          HG1       PRO  34  -7.944   9.524 -11.725
  271   1HD   PRO  34          HD2       PRO  34 -10.260   7.810 -10.945
  272   2HD   PRO  34          HD1       PRO  34  -8.516   7.476 -10.862
  273    H    ASP  35           HN       ASP  35 -11.606   8.727  -9.383
  274    HA   ASP  35           HA       ASP  35 -13.491  10.752  -8.473
  275   1HB   ASP  35          HB2       ASP  35 -13.913   7.981  -9.582
  276   2HB   ASP  35          HB1       ASP  35 -15.191   9.140  -9.218
  277    H    ASN  36           HN       ASN  36 -11.836   8.164  -6.871
  278    HA   ASN  36           HA       ASN  36 -14.057   8.012  -4.892
  279   1HB   ASN  36          HB2       ASN  36 -13.775   5.931  -6.099
  280   2HB   ASN  36          HB1       ASN  36 -12.074   5.886  -5.651
  281   1HD2  ASN  36          HD21      ASN  36 -15.365   5.805  -4.253
  282   2HD2  ASN  36          HD22      ASN  36 -14.903   5.007  -2.826
  283    H    GLU  37           HN       GLU  37 -13.458   8.647  -2.735
  284    HA   GLU  37           HA       GLU  37 -10.926   9.585  -2.050
  285   1HB   GLU  37          HB2       GLU  37 -13.019  10.141  -0.945
  286   2HB   GLU  37          HB1       GLU  37 -13.216   8.474  -0.428
  287   1HG   GLU  37          HG2       GLU  37 -11.156   8.654   0.941
  288   2HG   GLU  37          HG1       GLU  37 -10.957  10.332   0.431
  289    H    GLY  38           HN       GLY  38  -9.113   8.349  -1.665
  290   1HA   GLY  38          HA2       GLY  38  -9.426   5.463  -0.936
  291   2HA   GLY  38          HA1       GLY  38  -8.084   6.003  -1.695
  292    H    HIS  39           HN       HIS  39  -8.895   4.985   1.311
  293    HA   HIS  39           HA       HIS  39  -7.012   6.854   2.605
  294   1HB   HIS  39          HB2       HIS  39  -9.251   6.912   3.605
  295   2HB   HIS  39          HB1       HIS  39  -9.212   5.163   3.830
  296    HD1  HIS  39           HD1      HIS  39  -6.874   8.064   4.733
  297    HD2  HIS  39           HD2      HIS  39  -8.417   4.560   6.386
  298    HE1  HIS  39           HE1      HIS  39  -5.909   7.890   7.068
  299    H    VAL  40           HN       VAL  40  -5.064   5.870   3.119
  300    HA   VAL  40           HA       VAL  40  -4.951   2.927   3.157
  301    HB   VAL  40           HB       VAL  40  -2.834   4.961   2.457
  302   1HG1  VAL  40          HG11      VAL  40  -1.627   2.855   1.705
  303   2HG1  VAL  40          HG12      VAL  40  -2.837   1.937   2.600
  304   3HG1  VAL  40          HG13      VAL  40  -1.768   3.053   3.451
  305   1HG2  VAL  40          HG21      VAL  40  -3.171   4.261   0.196
  306   2HG2  VAL  40          HG22      VAL  40  -4.794   4.531   0.834
  307   3HG2  VAL  40          HG23      VAL  40  -4.160   2.891   0.687
  308    H    SER  41           HN       SER  41  -4.294   1.950   4.945
  309    HA   SER  41           HA       SER  41  -2.826   3.499   7.006
  310   1HB   SER  41          HB2       SER  41  -5.096   1.546   7.456
  311   2HB   SER  41          HB1       SER  41  -4.023   2.099   8.739
  312    HG   SER  41           HG       SER  41  -5.658   3.530   8.772
  313    H    VAL  42           HN       VAL  42  -1.171   2.480   8.046
  314    HA   VAL  42           HA       VAL  42  -0.622  -0.329   7.305
  315    HB   VAL  42           HB       VAL  42   1.506   1.819   7.419
  316   1HG1  VAL  42          HG11      VAL  42   2.770   0.013   6.137
  317   2HG1  VAL  42          HG12      VAL  42   1.451  -1.079   6.552
  318   3HG1  VAL  42          HG13      VAL  42   2.425  -0.350   7.827
  319   1HG2  VAL  42          HG21      VAL  42   1.534   1.784   4.980
  320   2HG2  VAL  42          HG22      VAL  42  -0.085   2.214   5.534
  321   3HG2  VAL  42          HG23      VAL  42   0.246   0.585   4.956
  322    H    ARG  43           HN       ARG  43  -0.145  -1.614   8.958
  323    HA   ARG  43           HA       ARG  43   1.054  -0.464  11.366
  324   1HB   ARG  43          HB2       ARG  43  -1.493  -2.096  11.540
  325   2HB   ARG  43          HB1       ARG  43  -0.642  -1.308  12.867
  326   1HG   ARG  43          HG2       ARG  43  -1.054   0.895  11.723
  327   2HG   ARG  43          HG1       ARG  43  -2.064   0.030  10.560
  328   1HD   ARG  43          HD2       ARG  43  -3.413  -0.842  12.501
  329   2HD   ARG  43          HD1       ARG  43  -2.498   0.239  13.548
  330    HE   ARG  43           HE       ARG  43  -3.573   1.728  11.397
  331   1HH1  ARG  43          HH11      ARG  43  -5.773  -0.245  12.478
  332   2HH1  ARG  43          HH12      ARG  43  -6.625   0.820  13.545
  333   1HH2  ARG  43          HH21      ARG  43  -4.130   3.230  13.554
  334   2HH2  ARG  43          HH22      ARG  43  -5.694   2.791  14.155
  335    H    TYR  44           HN       TYR  44   1.778  -2.136  12.910
  336    HA   TYR  44           HA       TYR  44   2.726  -4.533  11.509
  337   1HB   TYR  44          HB2       TYR  44   3.203  -3.477  14.314
  338   2HB   TYR  44          HB1       TYR  44   3.887  -4.977  13.696
  339    HD1  TYR  44           HD1      TYR  44   5.188  -4.785  11.412
  340    HD2  TYR  44           HD2      TYR  44   4.413  -1.488  14.053
  341    HE1  TYR  44           HE1      TYR  44   7.070  -3.531  10.397
  342    HE2  TYR  44           HE2      TYR  44   6.287  -0.231  13.037
  343    HH   TYR  44           HH       TYR  44   7.651  -0.159  11.168
  344    H    ALA  45           HN       ALA  45   2.107  -6.579  11.858
  345    HA   ALA  45           HA       ALA  45   0.097  -7.147  13.920
  346   1HB   ALA  45          HB1       ALA  45  -1.011  -6.548  11.681
  347   2HB   ALA  45          HB2       ALA  45  -1.448  -8.102  12.390
  348   3HB   ALA  45          HB3       ALA  45  -0.294  -8.034  11.058
  349    H    ALA  46           HN       ALA  46  -0.238  -9.590  14.059
  350    HA   ALA  46           HA       ALA  46   2.275 -10.837  14.301
  351   1HB   ALA  46          HB1       ALA  46   1.108 -12.822  14.915
  352   2HB   ALA  46          HB2       ALA  46  -0.319 -12.360  13.987
  353   3HB   ALA  46          HB3       ALA  46   0.082 -11.501  15.474
  354    H    ALA  47           HN       ALA  47   0.108 -10.577  11.549
  355    HA   ALA  47           HA       ALA  47   2.123 -12.051   9.981
  356   1HB   ALA  47          HB1       ALA  47   0.283 -13.196   8.742
  357   2HB   ALA  47          HB2       ALA  47  -0.853 -12.575   9.941
  358   3HB   ALA  47          HB3       ALA  47   0.421 -13.694  10.428
  359    H    ASN  48           HN       ASN  48   2.183 -11.582   7.744
  360    HA   ASN  48           HA       ASN  48   1.494  -8.866   7.012
  361   1HB   ASN  48          HB2       ASN  48   3.523 -10.003   6.170
  362   2HB   ASN  48          HB1       ASN  48   2.505 -11.166   5.320
  363   1HD2  ASN  48          HD21      ASN  48   3.273  -7.669   5.486
  364   2HD2  ASN  48          HD22      ASN  48   2.807  -7.334   3.889
  365    H    ASN  49           HN       ASN  49  -0.407  -8.207   6.057
  366    HA   ASN  49           HA       ASN  49  -1.992 -10.063   4.445
  367   1HB   ASN  49          HB2       ASN  49  -3.104  -8.808   6.958
  368   2HB   ASN  49          HB1       ASN  49  -4.054  -9.631   5.729
  369   1HD2  ASN  49          HD21      ASN  49  -2.621 -11.885   5.132
  370   2HD2  ASN  49          HD22      ASN  49  -2.374 -12.833   6.519
  371    H    LEU  50           HN       LEU  50  -3.508  -9.016   3.083
  372    HA   LEU  50           HA       LEU  50  -3.433  -6.051   3.041
  373   1HB   LEU  50          HB2       LEU  50  -2.046  -7.000   1.200
  374   2HB   LEU  50          HB1       LEU  50  -3.427  -7.956   0.671
  375    HG   LEU  50           HG       LEU  50  -4.712  -5.850   0.286
  376   1HD1  LEU  50          HD11      LEU  50  -3.859  -4.223   1.687
  377   2HD1  LEU  50          HD12      LEU  50  -3.154  -3.748   0.144
  378   3HD1  LEU  50          HD13      LEU  50  -2.180  -4.626   1.324
  379   1HD2  LEU  50          HD21      LEU  50  -2.044  -6.140  -1.129
  380   2HD2  LEU  50          HD22      LEU  50  -3.311  -5.043  -1.675
  381   3HD2  LEU  50          HD23      LEU  50  -3.606  -6.780  -1.642
  382    H    SER  51           HN       SER  51  -5.519  -5.271   3.315
  383    HA   SER  51           HA       SER  51  -7.774  -7.009   2.450
  384   1HB   SER  51          HB2       SER  51  -7.592  -6.856   4.909
  385   2HB   SER  51          HB1       SER  51  -7.682  -5.100   4.796
  386    HG   SER  51           HG       SER  51  -9.733  -6.064   5.185
  387    H    VAL  52           HN       VAL  52  -9.148  -6.048   1.015
  388    HA   VAL  52           HA       VAL  52  -9.105  -3.107   0.768
  389    HB   VAL  52           HB       VAL  52  -9.369  -5.143  -1.460
  390   1HG1  VAL  52          HG11      VAL  52 -10.823  -3.303  -1.967
  391   2HG1  VAL  52          HG12      VAL  52  -9.337  -3.015  -2.874
  392   3HG1  VAL  52          HG13      VAL  52  -9.645  -2.127  -1.384
  393   1HG2  VAL  52          HG21      VAL  52  -7.256  -3.058  -0.817
  394   2HG2  VAL  52          HG22      VAL  52  -7.278  -4.063  -2.267
  395   3HG2  VAL  52          HG23      VAL  52  -7.055  -4.805  -0.682
  396    H    ILE  53           HN       ILE  53 -11.078  -2.210   1.126
  397    HA   ILE  53           HA       ILE  53 -13.483  -3.943   0.872
  398    HB   ILE  53           HB       ILE  53 -12.986  -1.671   2.816
  399   1HG1  ILE  53          HG12      ILE  53 -13.299  -4.633   3.402
  400   2HG1  ILE  53          HG11      ILE  53 -11.727  -3.843   3.245
  401   1HG2  ILE  53          HG21      ILE  53 -15.332  -1.812   2.218
  402   2HG2  ILE  53          HG22      ILE  53 -15.130  -2.522   3.818
  403   3HG2  ILE  53          HG23      ILE  53 -15.318  -3.565   2.409
  404   1HD1  ILE  53          HD11      ILE  53 -12.507  -3.986   5.613
  405   2HD1  ILE  53          HD12      ILE  53 -13.894  -2.985   5.183
  406   3HD1  ILE  53          HD13      ILE  53 -12.261  -2.325   5.072
  407    H    GLY  54           HN       GLY  54 -15.041  -3.249  -0.473
  408   1HA   GLY  54          HA2       GLY  54 -16.482  -1.640  -1.446
  409   2HA   GLY  54          HA1       GLY  54 -15.327  -0.384  -1.010
  410    H    ALA  55           HN       ALA  55 -13.934  -3.133  -2.577
  411    HA   ALA  55           HA       ALA  55 -13.864  -1.616  -5.135
  412   1HB   ALA  55          HB1       ALA  55 -11.622  -3.377  -4.163
  413   2HB   ALA  55          HB2       ALA  55 -11.710  -1.666  -3.743
  414   3HB   ALA  55          HB3       ALA  55 -11.588  -2.155  -5.433
  415    H    THR  56           HN       THR  56 -13.379  -2.849  -7.031
  416    HA   THR  56           HA       THR  56 -14.865  -5.394  -7.266
  417    HB   THR  56           HB       THR  56 -14.686  -4.954  -9.606
  418    HG1  THR  56           HG1      THR  56 -13.513  -2.941 -10.177
  419   1HG2  THR  56          HG21      THR  56 -15.201  -2.319  -8.191
  420   2HG2  THR  56          HG22      THR  56 -16.378  -3.625  -8.347
  421   3HG2  THR  56          HG23      THR  56 -15.797  -2.783  -9.784
  422    H    LYS  57           HN       LYS  57 -13.958  -7.173  -8.294
  423    HA   LYS  57           HA       LYS  57 -11.484  -7.978  -7.323
  424   1HB   LYS  57          HB2       LYS  57 -12.980  -9.012  -9.744
  425   2HB   LYS  57          HB1       LYS  57 -11.664  -9.857  -8.940
  426   1HG   LYS  57          HG2       LYS  57 -13.022  -9.949  -6.844
  427   2HG   LYS  57          HG1       LYS  57 -14.340  -9.137  -7.685
  428   1HD   LYS  57          HD2       LYS  57 -13.133 -11.707  -8.717
  429   2HD   LYS  57          HD1       LYS  57 -14.427 -11.713  -7.525
  430   1HE   LYS  57          HE2       LYS  57 -14.523 -10.614 -10.345
  431   2HE   LYS  57          HE1       LYS  57 -15.473 -11.931  -9.670
  432   1HZ   LYS  57          HZ1       LYS  57 -16.978 -10.284  -9.444
  433   2HZ   LYS  57          HZ2       LYS  57 -15.807  -9.055  -9.363
  434   3HZ   LYS  57          HZ3       LYS  57 -16.138 -10.008  -7.995
  435    H    GLU  58           HN       GLU  58 -12.228  -6.544 -10.556
  436    HA   GLU  58           HA       GLU  58  -9.600  -6.944 -11.589
  437   1HB   GLU  58          HB2       GLU  58 -11.569  -6.448 -13.015
  438   2HB   GLU  58          HB1       GLU  58 -11.648  -4.833 -12.308
  439   1HG   GLU  58          HG2       GLU  58  -9.412  -4.314 -13.145
  440   2HG   GLU  58          HG1       GLU  58  -9.233  -5.954 -13.763
  441    H    ASP  59           HN       ASP  59 -11.141  -4.396  -9.691
  442    HA   ASP  59           HA       ASP  59  -9.041  -2.515  -9.882
  443   1HB   ASP  59          HB2       ASP  59 -11.181  -2.957  -7.790
  444   2HB   ASP  59          HB1       ASP  59 -10.048  -1.609  -7.742
  445    H    LYS  60           HN       LYS  60  -9.840  -5.089  -7.617
  446    HA   LYS  60           HA       LYS  60  -7.680  -4.696  -5.826
  447   1HB   LYS  60          HB2       LYS  60  -9.327  -7.155  -6.490
  448   2HB   LYS  60          HB1       LYS  60  -8.125  -7.115  -5.202
  449   1HG   LYS  60          HG2       LYS  60  -9.336  -5.257  -4.123
  450   2HG   LYS  60          HG1       LYS  60 -10.545  -5.296  -5.405
  451   1HD   LYS  60          HD2       LYS  60 -11.010  -7.693  -4.808
  452   2HD   LYS  60          HD1       LYS  60  -9.925  -7.509  -3.429
  453   1HE   LYS  60          HE2       LYS  60 -11.354  -5.582  -2.657
  454   2HE   LYS  60          HE1       LYS  60 -12.490  -5.980  -3.947
  455   1HZ   LYS  60          HZ1       LYS  60 -12.866  -6.977  -1.630
  456   2HZ   LYS  60          HZ2       LYS  60 -11.607  -8.044  -2.035
  457   3HZ   LYS  60          HZ3       LYS  60 -13.019  -7.994  -2.978
  458    H    GLN  61           HN       GLN  61  -7.831  -6.630  -8.834
  459    HA   GLN  61           HA       GLN  61  -5.248  -7.784  -8.428
  460   1HB   GLN  61          HB2       GLN  61  -6.866  -7.253 -10.935
  461   2HB   GLN  61          HB1       GLN  61  -5.320  -8.104 -10.937
  462   1HG   GLN  61          HG2       GLN  61  -6.232  -9.789  -9.395
  463   2HG   GLN  61          HG1       GLN  61  -7.776  -8.938  -9.365
  464   1HE2  GLN  61          HE21      GLN  61  -7.454 -11.678 -10.308
  465   2HE2  GLN  61          HE22      GLN  61  -7.853 -11.689 -11.958
  466    H    ARG  62           HN       ARG  62  -6.391  -4.799 -10.053
  467    HA   ARG  62           HA       ARG  62  -3.879  -4.030 -11.032
  468   1HB   ARG  62          HB2       ARG  62  -6.020  -2.959 -11.738
  469   2HB   ARG  62          HB1       ARG  62  -6.159  -2.230 -10.143
  470   1HG   ARG  62          HG2       ARG  62  -5.215  -0.522 -11.481
  471   2HG   ARG  62          HG1       ARG  62  -3.838  -1.183 -10.612
  472   1HD   ARG  62          HD2       ARG  62  -3.396  -0.830 -13.047
  473   2HD   ARG  62          HD1       ARG  62  -3.186  -2.503 -12.556
  474    HE   ARG  62           HE       ARG  62  -5.023  -3.071 -13.876
  475   1HH1  ARG  62          HH11      ARG  62  -4.067  -0.332 -15.191
  476   2HH1  ARG  62          HH12      ARG  62  -5.615   0.349 -15.565
  477   1HH2  ARG  62          HH21      ARG  62  -7.370  -1.892 -13.583
  478   2HH2  ARG  62          HH22      ARG  62  -7.487  -0.536 -14.655
  479    H    ILE  63           HN       ILE  63  -5.485  -3.310  -7.970
  480    HA   ILE  63           HA       ILE  63  -3.432  -1.676  -6.961
  481    HB   ILE  63           HB       ILE  63  -5.443  -3.372  -5.505
  482   1HG1  ILE  63          HG12      ILE  63  -5.313  -0.364  -5.802
  483   2HG1  ILE  63          HG11      ILE  63  -6.214  -1.388  -6.917
  484   1HG2  ILE  63          HG21      ILE  63  -3.378  -1.431  -4.476
  485   2HG2  ILE  63          HG22      ILE  63  -3.682  -3.083  -3.938
  486   3HG2  ILE  63          HG23      ILE  63  -4.838  -1.806  -3.559
  487   1HD1  ILE  63          HD11      ILE  63  -7.825  -1.927  -5.343
  488   2HD1  ILE  63          HD12      ILE  63  -7.384  -0.318  -4.773
  489   3HD1  ILE  63          HD13      ILE  63  -6.717  -1.744  -3.980
  490    H    SER  64           HN       SER  64  -3.839  -5.177  -6.767
  491    HA   SER  64           HA       SER  64  -1.579  -5.645  -5.117
  492   1HB   SER  64          HB2       SER  64  -1.643  -7.918  -5.928
  493   2HB   SER  64          HB1       SER  64  -3.314  -7.376  -5.802
  494    HG   SER  64           HG       SER  64  -3.344  -7.031  -8.003
  495    H    GLU  65           HN       GLU  65  -1.936  -5.338  -8.707
  496    HA   GLU  65           HA       GLU  65   0.728  -5.810  -9.322
  497   1HB   GLU  65          HB2       GLU  65  -1.230  -5.727 -10.927
  498   2HB   GLU  65          HB1       GLU  65  -1.195  -3.967 -10.768
  499   1HG   GLU  65          HG2       GLU  65   1.129  -3.947 -11.498
  500   2HG   GLU  65          HG1       GLU  65   1.091  -5.698 -11.658
  501    H    ILE  66           HN       ILE  66  -0.995  -2.806  -8.514
  502    HA   ILE  66           HA       ILE  66   1.164  -1.055  -8.936
  503    HB   ILE  66           HB       ILE  66  -1.207  -0.861  -7.067
  504   1HG1  ILE  66          HG12      ILE  66  -0.538   0.550  -9.673
  505   2HG1  ILE  66          HG11      ILE  66  -1.572  -0.873  -9.560
  506   1HG2  ILE  66          HG21      ILE  66   0.491   0.569  -6.113
  507   2HG2  ILE  66          HG22      ILE  66  -0.589   1.612  -7.030
  508   3HG2  ILE  66          HG23      ILE  66   0.972   1.153  -7.706
  509   1HD1  ILE  66          HD11      ILE  66  -2.956   1.145  -9.603
  510   2HD1  ILE  66          HD12      ILE  66  -2.066   1.808  -8.233
  511   3HD1  ILE  66          HD13      ILE  66  -3.076   0.379  -8.019
  512    H    LEU  67           HN       LEU  67   0.150  -2.788  -6.019
  513    HA   LEU  67           HA       LEU  67   2.129  -1.753  -4.302
  514   1HB   LEU  67          HB2       LEU  67   0.307  -2.954  -3.293
  515   2HB   LEU  67          HB1       LEU  67   0.593  -4.365  -4.302
  516    HG   LEU  67           HG       LEU  67   2.776  -4.739  -3.140
  517   1HD1  LEU  67          HD11      LEU  67   2.949  -3.445  -0.881
  518   2HD1  LEU  67          HD12      LEU  67   1.891  -2.268  -1.647
  519   3HD1  LEU  67          HD13      LEU  67   3.471  -2.624  -2.347
  520   1HD2  LEU  67          HD21      LEU  67   0.573  -5.741  -2.370
  521   2HD2  LEU  67          HD22      LEU  67   0.500  -4.461  -1.157
  522   3HD2  LEU  67          HD23      LEU  67   1.818  -5.633  -1.125
  523    H    GLN  68           HN       GLN  68   2.135  -4.535  -6.473
  524    HA   GLN  68           HA       GLN  68   4.711  -5.478  -5.723
  525   1HB   GLN  68          HB2       GLN  68   3.170  -5.709  -8.322
  526   2HB   GLN  68          HB1       GLN  68   4.708  -6.516  -8.018
  527   1HG   GLN  68          HG2       GLN  68   2.291  -6.838  -6.227
  528   2HG   GLN  68          HG1       GLN  68   2.652  -7.929  -7.563
  529   1HE2  GLN  68          HE21      GLN  68   5.224  -8.582  -7.446
  530   2HE2  GLN  68          HE22      GLN  68   5.703  -9.128  -5.912
  531    H    GLU  69           HN       GLU  69   3.753  -3.289  -8.428
  532    HA   GLU  69           HA       GLU  69   6.356  -2.853  -9.323
  533   1HB   GLU  69          HB2       GLU  69   3.875  -1.144  -9.488
  534   2HB   GLU  69          HB1       GLU  69   5.385  -0.725 -10.301
  535   1HG   GLU  69          HG2       GLU  69   3.990  -3.392 -10.651
  536   2HG   GLU  69          HG1       GLU  69   3.739  -2.020 -11.729
  537    H    THR  70           HN       THR  70   4.521  -0.925  -6.924
  538    HA   THR  70           HA       THR  70   6.457   1.084  -6.571
  539    HB   THR  70           HB       THR  70   4.568  -0.033  -4.527
  540    HG1  THR  70           HG1      THR  70   4.305   1.686  -6.685
  541   1HG2  THR  70          HG21      THR  70   6.160   2.519  -4.704
  542   2HG2  THR  70          HG22      THR  70   6.182   1.320  -3.412
  543   3HG2  THR  70          HG23      THR  70   4.766   2.346  -3.638
  544    H    TRP  71           HN       TRP  71   5.875  -1.902  -4.877
  545    HA   TRP  71           HA       TRP  71   7.931  -1.827  -3.040
  546   1HB   TRP  71          HB2       TRP  71   6.070  -3.319  -2.859
  547   2HB   TRP  71          HB1       TRP  71   6.479  -4.084  -4.383
  548    HD1  TRP  71           HD1      TRP  71   7.387  -6.391  -3.946
  549    HE1  TRP  71           HE1      TRP  71   8.959  -7.491  -2.230
  550    HE3  TRP  71           HE3      TRP  71   8.304  -2.395  -0.869
  551    HZ2  TRP  71           HZ2      TRP  71  10.392  -6.788   0.136
  552    HZ3  TRP  71           HZ3      TRP  71   9.759  -2.656   1.111
  553    HH2  TRP  71           HH2      TRP  71  10.802  -4.843   1.619
  554    H    GLU  72           HN       GLU  72   7.913  -2.949  -6.360
  555    HA   GLU  72           HA       GLU  72  10.614  -3.894  -6.279
  556   1HB   GLU  72          HB2       GLU  72   8.691  -3.449  -8.566
  557   2HB   GLU  72          HB1       GLU  72  10.338  -4.036  -8.809
  558   1HG   GLU  72          HG2       GLU  72   9.899  -5.929  -7.298
  559   2HG   GLU  72          HG1       GLU  72   8.262  -5.346  -7.024
  560    H    SER  73           HN       SER  73   9.277  -0.721  -6.721
  561    HA   SER  73           HA       SER  73  11.826   0.186  -7.944
  562   1HB   SER  73          HB2       SER  73  10.634   2.229  -8.555
  563   2HB   SER  73          HB1       SER  73   9.740   0.826  -9.135
  564    HG   SER  73           HG       SER  73   9.156   1.715  -6.569
  565    H    ALA  74           HN       ALA  74  11.209  -0.480  -5.034
  566    HA   ALA  74           HA       ALA  74  10.985   1.640  -3.397
  567   1HB   ALA  74          HB1       ALA  74  12.915  -0.595  -2.885
  568   2HB   ALA  74          HB2       ALA  74  11.165  -0.824  -2.875
  569   3HB   ALA  74          HB3       ALA  74  11.917   0.283  -1.725
  570    H    ASP  75           HN       ASP  75  14.017   0.726  -5.006
  571    HA   ASP  75           HA       ASP  75  15.701   2.364  -3.413
  572   1HB   ASP  75          HB2       ASP  75  17.337   2.094  -5.223
  573   2HB   ASP  75          HB1       ASP  75  16.581   0.559  -4.798
  574    H    ASP  76           HN       ASP  76  13.490   3.198  -5.959
  575    HA   ASP  76           HA       ASP  76  14.861   5.740  -6.549
  576   1HB   ASP  76          HB2       ASP  76  12.440   4.362  -7.707
  577   2HB   ASP  76          HB1       ASP  76  12.955   5.980  -8.184
  578    H    TRP  77           HN       TRP  77  11.672   4.716  -5.238
  579    HA   TRP  77           HA       TRP  77  11.050   7.532  -4.692
  580   1HB   TRP  77          HB2       TRP  77   8.859   6.870  -4.242
  581   2HB   TRP  77          HB1       TRP  77   9.377   5.894  -5.600
  582    HD1  TRP  77           HD1      TRP  77   9.420   3.279  -5.286
  583    HE1  TRP  77           HE1      TRP  77   8.785   1.712  -3.364
  584    HE3  TRP  77           HE3      TRP  77   8.896   6.668  -1.382
  585    HZ2  TRP  77           HZ2      TRP  77   8.157   1.821  -0.606
  586    HZ3  TRP  77           HZ3      TRP  77   8.279   5.846   0.834
  587    HH2  TRP  77           HH2      TRP  77   7.915   3.448   1.230
  588    H    PHE  78           HN       PHE  78  12.338   4.880  -2.842
  589    HA   PHE  78           HA       PHE  78  11.486   6.135  -0.314
  590   1HB   PHE  78          HB2       PHE  78  11.463   3.703  -0.348
  591   2HB   PHE  78          HB1       PHE  78  13.160   3.672  -0.814
  592    HD1  PHE  78           HD1      PHE  78  11.027   5.347   1.815
  593    HD2  PHE  78           HD2      PHE  78  14.713   3.285   0.932
  594    HE1  PHE  78           HE1      PHE  78  11.704   5.514   4.189
  595    HE2  PHE  78           HE2      PHE  78  15.369   3.462   3.309
  596    HZ   PHE  78           HZ       PHE  78  13.870   4.572   4.937
  597    H    VAL  79           HN       VAL  79  12.617   7.531   0.758
  598    HA   VAL  79           HA       VAL  79  15.484   7.895   0.137
  599    HB   VAL  79           HB       VAL  79  14.924  10.324   0.902
  600   1HG1  VAL  79          HG11      VAL  79  14.311  10.945  -1.378
  601   2HG1  VAL  79          HG12      VAL  79  13.764   9.301  -1.710
  602   3HG1  VAL  79          HG13      VAL  79  15.478   9.625  -1.439
  603   1HG2  VAL  79          HG21      VAL  79  12.158   9.441   0.014
  604   2HG2  VAL  79          HG22      VAL  79  12.635  11.019   0.644
  605   3HG2  VAL  79          HG23      VAL  79  12.613   9.619   1.712
  606    H    SER  80           HN       SER  80  16.864   8.041   2.023
  607    HA   SER  80           HA       SER  80  15.479   7.926   4.650
  608   1HB   SER  80          HB2       SER  80  17.278   6.389   5.377
  609   2HB   SER  80          HB1       SER  80  16.375   5.700   4.025
  610    HG   SER  80           HG       SER  80  18.029   6.404   2.649
  611    H    GLU  81           HN       GLU  81  16.294   9.141   6.232
  612    HA   GLU  81           HA       GLU  81  17.817  11.417   5.665
  613   1HB   GLU  81          HB2       GLU  81  16.308  11.234   7.597
  614   2HB   GLU  81          HB1       GLU  81  17.381  10.041   8.327
  615   1HG   GLU  81          HG2       GLU  81  19.184  11.690   8.460
  616   2HG   GLU  81          HG1       GLU  81  18.179  12.884   7.637
  Start of MODEL   15
    1   1H    MET   1          HT1       MET   1 -13.774   4.264  -1.688
    2   2H    MET   1          HT2       MET   1 -13.436   4.582  -0.053
    3   3H    MET   1          HT3       MET   1 -14.827   3.705  -0.481
    4    HA   MET   1           HA       MET   1 -13.730   1.808  -0.399
    5   1HB   MET   1          HB2       MET   1 -13.142   2.240  -2.746
    6   2HB   MET   1          HB1       MET   1 -11.732   3.168  -2.234
    7   1HG   MET   1          HG2       MET   1 -10.746   1.191  -1.208
    8   2HG   MET   1          HG1       MET   1 -12.197   0.251  -1.549
    9   1HE   MET   1          HE1       MET   1  -8.911   1.714  -4.297
   10   2HE   MET   1          HE2       MET   1  -9.440   2.361  -2.745
   11   3HE   MET   1          HE3       MET   1 -10.270   2.842  -4.222
   12    H    ARG   2           HN       ARG   2 -12.262   0.852   1.028
   13    HA   ARG   2           HA       ARG   2 -10.237   2.644   2.252
   14   1HB   ARG   2          HB2       ARG   2 -12.078   0.658   3.606
   15   2HB   ARG   2          HB1       ARG   2 -10.658   1.350   4.392
   16   1HG   ARG   2          HG2       ARG   2 -11.557   3.623   4.003
   17   2HG   ARG   2          HG1       ARG   2 -12.984   2.922   3.238
   18   1HD   ARG   2          HD2       ARG   2 -13.508   1.727   5.348
   19   2HD   ARG   2          HD1       ARG   2 -12.109   2.478   6.108
   20    HE   ARG   2           HE       ARG   2 -13.881   4.428   4.971
   21   1HH1  ARG   2          HH11      ARG   2 -12.354   4.348   7.696
   22   2HH1  ARG   2          HH12      ARG   2 -13.690   4.423   8.798
   23   1HH2  ARG   2          HH21      ARG   2 -16.062   3.652   6.390
   24   2HH2  ARG   2          HH22      ARG   2 -15.788   4.029   8.058
   25    H    ILE   3           HN       ILE   3  -8.236   1.863   2.345
   26    HA   ILE   3           HA       ILE   3  -7.764  -0.994   1.636
   27    HB   ILE   3           HB       ILE   3  -6.053   1.425   1.049
   28   1HG1  ILE   3          HG12      ILE   3  -7.527  -0.413  -0.857
   29   2HG1  ILE   3          HG11      ILE   3  -8.211   1.108  -0.281
   30   1HG2  ILE   3          HG21      ILE   3  -4.807  -0.295  -0.341
   31   2HG2  ILE   3          HG22      ILE   3  -5.738  -1.538   0.495
   32   3HG2  ILE   3          HG23      ILE   3  -4.642  -0.496   1.403
   33   1HD1  ILE   3          HD11      ILE   3  -5.473   0.987  -1.545
   34   2HD1  ILE   3          HD12      ILE   3  -6.514   2.393  -1.322
   35   3HD1  ILE   3          HD13      ILE   3  -6.931   1.169  -2.520
   36    H    GLU   4           HN       GLU   4  -6.784  -2.130   3.233
   37    HA   GLU   4           HA       GLU   4  -5.089  -0.676   5.210
   38   1HB   GLU   4          HB2       GLU   4  -6.907  -3.036   5.758
   39   2HB   GLU   4          HB1       GLU   4  -5.799  -2.307   6.919
   40   1HG   GLU   4          HG2       GLU   4  -6.985  -0.156   6.703
   41   2HG   GLU   4          HG1       GLU   4  -8.097  -0.884   5.544
   42    H    VAL   5           HN       VAL   5  -3.096  -1.354   5.443
   43    HA   VAL   5           HA       VAL   5  -2.343  -4.025   4.360
   44    HB   VAL   5           HB       VAL   5  -0.526  -1.624   4.510
   45   1HG1  VAL   5          HG11      VAL   5   0.649  -2.920   2.693
   46   2HG1  VAL   5          HG12      VAL   5  -0.474  -4.245   2.989
   47   3HG1  VAL   5          HG13      VAL   5   0.632  -3.726   4.261
   48   1HG2  VAL   5          HG21      VAL   5  -1.046  -1.565   1.945
   49   2HG2  VAL   5          HG22      VAL   5  -2.183  -0.809   3.057
   50   3HG2  VAL   5          HG23      VAL   5  -2.531  -2.402   2.394
   51    H    THR   6           HN       THR   6  -1.263  -5.385   5.663
   52    HA   THR   6           HA       THR   6  -0.220  -4.347   8.250
   53    HB   THR   6           HB       THR   6  -0.898  -6.364   9.320
   54    HG1  THR   6           HG1      THR   6  -0.742  -8.050   8.089
   55   1HG2  THR   6          HG21      THR   6  -3.086  -5.398   7.454
   56   2HG2  THR   6          HG22      THR   6  -2.728  -4.784   9.068
   57   3HG2  THR   6          HG23      THR   6  -3.361  -6.417   8.867
   58    H    ILE   7           HN       ILE   7   1.787  -4.807   8.731
   59    HA   ILE   7           HA       ILE   7   3.324  -6.626   6.970
   60    HB   ILE   7           HB       ILE   7   3.949  -4.042   8.375
   61   1HG1  ILE   7          HG12      ILE   7   3.132  -4.334   5.892
   62   2HG1  ILE   7          HG11      ILE   7   4.445  -3.217   6.241
   63   1HG2  ILE   7          HG21      ILE   7   5.867  -6.264   7.692
   64   2HG2  ILE   7          HG22      ILE   7   5.885  -5.151   9.062
   65   3HG2  ILE   7          HG23      ILE   7   6.401  -4.595   7.471
   66   1HD1  ILE   7          HD11      ILE   7   6.052  -4.578   5.268
   67   2HD1  ILE   7          HD12      ILE   7   4.656  -4.992   4.274
   68   3HD1  ILE   7          HD13      ILE   7   5.151  -6.060   5.586
   69    H    ALA   8           HN       ALA   8   4.314  -8.347   7.914
   70    HA   ALA   8           HA       ALA   8   3.772  -9.035  10.595
   71   1HB   ALA   8          HB1       ALA   8   5.497 -10.837  10.158
   72   2HB   ALA   8          HB2       ALA   8   5.745 -10.103   8.572
   73   3HB   ALA   8          HB3       ALA   8   4.169 -10.774   8.997
   74    H    LYS   9           HN       LYS   9   4.752  -8.641  12.335
   75    HA   LYS   9           HA       LYS   9   6.706  -6.678  12.619
   76   1HB   LYS   9          HB2       LYS   9   5.092  -7.204  14.408
   77   2HB   LYS   9          HB1       LYS   9   5.845  -8.777  14.633
   78   1HG   LYS   9          HG2       LYS   9   7.958  -7.676  15.319
   79   2HG   LYS   9          HG1       LYS   9   7.205  -6.092  15.101
   80   1HD   LYS   9          HD2       LYS   9   5.599  -6.535  16.842
   81   2HD   LYS   9          HD1       LYS   9   6.126  -8.213  16.972
   82   1HE   LYS   9          HE2       LYS   9   8.041  -5.922  17.424
   83   2HE   LYS   9          HE1       LYS   9   7.038  -6.558  18.727
   84   1HZ   LYS   9          HZ1       LYS   9   9.424  -7.530  18.142
   85   2HZ   LYS   9          HZ2       LYS   9   8.481  -8.512  17.126
   86   3HZ   LYS   9          HZ3       LYS   9   8.183  -8.480  18.799
   87    H    THR  10           HN       THR  10   7.112 -10.074  12.096
   88    HA   THR  10           HA       THR  10   9.733 -10.382  13.135
   89    HB   THR  10           HB       THR  10   9.854 -12.255  11.431
   90    HG1  THR  10           HG1      THR  10   8.402 -11.311   9.947
   91   1HG2  THR  10          HG21      THR  10   7.954 -13.531  12.560
   92   2HG2  THR  10          HG22      THR  10   7.577 -12.030  13.405
   93   3HG2  THR  10          HG23      THR  10   9.145 -12.803  13.637
   94    H    SER  11           HN       SER  11   8.510  -8.533  10.565
   95    HA   SER  11           HA       SER  11  11.199  -8.315   9.305
   96   1HB   SER  11          HB2       SER  11  10.152  -7.919   7.204
   97   2HB   SER  11          HB1       SER  11   9.353  -9.335   7.883
   98    HG   SER  11           HG       SER  11   7.838  -7.830   7.105
   99    HA   PRO  12           HA       PRO  12  10.048  -4.128  10.999
  100   1HB   PRO  12          HB2       PRO  12  12.719  -3.888  12.061
  101   2HB   PRO  12          HB1       PRO  12  11.219  -4.093  12.981
  102   1HG   PRO  12          HG2       PRO  12  13.255  -5.971  12.817
  103   2HG   PRO  12          HG1       PRO  12  11.583  -6.315  13.293
  104   1HD   PRO  12          HD2       PRO  12  12.929  -6.791  10.657
  105   2HD   PRO  12          HD1       PRO  12  11.667  -7.731  11.472
  106    H    LEU  13           HN       LEU  13  10.124  -2.358   9.980
  107    HA   LEU  13           HA       LEU  13  12.222  -2.024   7.920
  108   1HB   LEU  13          HB2       LEU  13   9.589  -0.548   8.127
  109   2HB   LEU  13          HB1       LEU  13  10.662  -0.656   6.733
  110    HG   LEU  13           HG       LEU  13   9.038  -2.909   7.952
  111   1HD1  LEU  13          HD11      LEU  13   8.963  -1.914   5.099
  112   2HD1  LEU  13          HD12      LEU  13   7.968  -1.171   6.353
  113   3HD1  LEU  13          HD13      LEU  13   7.765  -2.877   5.961
  114   1HD2  LEU  13          HD21      LEU  13  11.017  -4.002   7.289
  115   2HD2  LEU  13          HD22      LEU  13  11.282  -2.917   5.928
  116   3HD2  LEU  13          HD23      LEU  13  10.012  -4.137   5.849
  117    HA   PRO  14           HA       PRO  14  14.074   1.126  10.318
  118   1HB   PRO  14          HB2       PRO  14  14.187   3.202   8.278
  119   2HB   PRO  14          HB1       PRO  14  15.502   2.153   8.835
  120   1HG   PRO  14          HG2       PRO  14  13.870   1.940   6.419
  121   2HG   PRO  14          HG1       PRO  14  15.394   1.134   6.813
  122   1HD   PRO  14          HD2       PRO  14  12.922  -0.140   6.695
  123   2HD   PRO  14          HD1       PRO  14  14.326  -0.757   7.588
  124    H    ALA  15           HN       ALA  15  13.661   2.893  11.488
  125    HA   ALA  15           HA       ALA  15  11.048   3.507  12.177
  126   1HB   ALA  15          HB1       ALA  15  13.093   3.813  13.565
  127   2HB   ALA  15          HB2       ALA  15  11.982   5.184  13.609
  128   3HB   ALA  15          HB3       ALA  15  13.450   5.268  12.634
  129    H    GLY  16           HN       GLY  16  10.897   3.954   9.442
  130   1HA   GLY  16          HA2       GLY  16   9.789   6.576   9.307
  131   2HA   GLY  16          HA1       GLY  16  11.330   6.550   8.501
  132    H    ALA  17           HN       ALA  17  10.770   3.591   7.953
  133    HA   ALA  17           HA       ALA  17   9.897   3.991   5.270
  134   1HB   ALA  17          HB1       ALA  17  10.782   1.665   6.915
  135   2HB   ALA  17          HB2       ALA  17  11.426   2.256   5.387
  136   3HB   ALA  17          HB3       ALA  17   9.923   1.332   5.409
  137    H    ILE  18           HN       ILE  18   8.127   2.567   7.991
  138    HA   ILE  18           HA       ILE  18   5.997   1.706   6.385
  139    HB   ILE  18           HB       ILE  18   6.105   2.560   9.280
  140   1HG1  ILE  18          HG12      ILE  18   7.242   0.400   8.255
  141   2HG1  ILE  18          HG11      ILE  18   6.347   0.290   9.761
  142   1HG2  ILE  18          HG21      ILE  18   3.855   1.276   9.373
  143   2HG2  ILE  18          HG22      ILE  18   3.777   1.568   7.636
  144   3HG2  ILE  18          HG23      ILE  18   3.834   2.929   8.758
  145   1HD1  ILE  18          HD11      ILE  18   5.867  -1.495   7.955
  146   2HD1  ILE  18          HD12      ILE  18   4.984  -0.221   7.120
  147   3HD1  ILE  18          HD13      ILE  18   4.485  -0.728   8.732
  148    H    ASP  19           HN       ASP  19   6.439   4.775   8.150
  149    HA   ASP  19           HA       ASP  19   4.024   5.955   7.206
  150   1HB   ASP  19          HB2       ASP  19   5.441   6.852   9.130
  151   2HB   ASP  19          HB1       ASP  19   6.566   7.453   7.913
  152    H    ALA  20           HN       ALA  20   7.282   5.807   5.845
  153    HA   ALA  20           HA       ALA  20   6.698   7.557   3.714
  154   1HB   ALA  20          HB1       ALA  20   9.004   6.629   4.538
  155   2HB   ALA  20          HB2       ALA  20   8.780   6.971   2.827
  156   3HB   ALA  20          HB3       ALA  20   8.679   5.311   3.417
  157    H    LEU  21           HN       LEU  21   6.412   4.062   4.088
  158    HA   LEU  21           HA       LEU  21   5.710   3.381   1.478
  159   1HB   LEU  21          HB2       LEU  21   6.413   1.703   3.026
  160   2HB   LEU  21          HB1       LEU  21   5.163   2.149   4.179
  161    HG   LEU  21           HG       LEU  21   3.448   1.375   2.586
  162   1HD1  LEU  21          HD11      LEU  21   4.277  -0.063   0.661
  163   2HD1  LEU  21          HD12      LEU  21   5.874   0.625   0.941
  164   3HD1  LEU  21          HD13      LEU  21   4.538   1.667   0.456
  165   1HD2  LEU  21          HD21      LEU  21   5.619  -0.626   3.242
  166   2HD2  LEU  21          HD22      LEU  21   3.970  -1.051   2.783
  167   3HD2  LEU  21          HD23      LEU  21   4.269  -0.169   4.281
  168    H    ALA  22           HN       ALA  22   3.681   4.134   4.282
  169    HA   ALA  22           HA       ALA  22   1.154   3.826   3.011
  170   1HB   ALA  22          HB1       ALA  22   0.288   5.188   4.857
  171   2HB   ALA  22          HB2       ALA  22   1.928   5.662   5.296
  172   3HB   ALA  22          HB3       ALA  22   1.418   3.983   5.474
  173    H    GLY  23           HN       GLY  23   3.344   6.606   3.219
  174   1HA   GLY  23          HA2       GLY  23   1.533   8.421   1.949
  175   2HA   GLY  23          HA1       GLY  23   3.292   8.596   2.149
  176    H    GLU  24           HN       GLU  24   4.199   6.390   0.649
  177    HA   GLU  24           HA       GLU  24   3.883   7.399  -1.967
  178   1HB   GLU  24          HB2       GLU  24   5.804   5.900  -0.879
  179   2HB   GLU  24          HB1       GLU  24   4.830   4.571  -1.500
  180   1HG   GLU  24          HG2       GLU  24   5.856   6.899  -3.156
  181   2HG   GLU  24          HG1       GLU  24   6.552   5.282  -3.135
  182    H    LEU  25           HN       LEU  25   2.441   4.603  -0.327
  183    HA   LEU  25           HA       LEU  25   1.099   3.586  -2.581
  184   1HB   LEU  25          HB2       LEU  25   0.464   3.366   0.353
  185   2HB   LEU  25          HB1       LEU  25  -0.466   2.535  -0.889
  186    HG   LEU  25           HG       LEU  25   2.536   2.256  -0.555
  187   1HD1  LEU  25          HD11      LEU  25   0.261   0.515   0.438
  188   2HD1  LEU  25          HD12      LEU  25   1.439   1.375   1.425
  189   3HD1  LEU  25          HD13      LEU  25   1.952   0.018   0.424
  190   1HD2  LEU  25          HD21      LEU  25   2.127   1.519  -2.734
  191   2HD2  LEU  25          HD22      LEU  25   0.473   1.024  -2.374
  192   3HD2  LEU  25          HD23      LEU  25   1.829   0.026  -1.853
  193    H    SER  26           HN       SER  26   0.056   5.986  -0.192
  194    HA   SER  26           HA       SER  26  -2.612   6.200  -1.058
  195   1HB   SER  26          HB2       SER  26  -0.833   8.315   0.169
  196   2HB   SER  26          HB1       SER  26  -2.586   8.416   0.029
  197    HG   SER  26           HG       SER  26  -1.449   7.475   2.037
  198    H    ARG  27           HN       ARG  27   0.277   8.038  -2.102
  199    HA   ARG  27           HA       ARG  27  -1.093   9.744  -3.894
  200   1HB   ARG  27          HB2       ARG  27   1.243  10.136  -3.182
  201   2HB   ARG  27          HB1       ARG  27   1.748   8.692  -4.056
  202   1HG   ARG  27          HG2       ARG  27   0.972   9.696  -6.177
  203   2HG   ARG  27          HG1       ARG  27   0.458  11.141  -5.305
  204   1HD   ARG  27          HD2       ARG  27   3.295  10.078  -5.431
  205   2HD   ARG  27          HD1       ARG  27   2.680  11.452  -6.346
  206    HE   ARG  27           HE       ARG  27   2.270  11.751  -3.515
  207   1HH1  ARG  27          HH11      ARG  27   4.053  12.644  -6.295
  208   2HH1  ARG  27          HH12      ARG  27   5.228  13.581  -5.433
  209   1HH2  ARG  27          HH21      ARG  27   4.016  12.713  -2.303
  210   2HH2  ARG  27          HH22      ARG  27   5.206  13.619  -3.175
  211    H    ARG  28           HN       ARG  28   0.310   6.508  -4.367
  212    HA   ARG  28           HA       ARG  28  -0.169   6.386  -7.151
  213   1HB   ARG  28          HB2       ARG  28   0.068   4.196  -5.089
  214   2HB   ARG  28          HB1       ARG  28  -0.022   3.909  -6.828
  215   1HG   ARG  28          HG2       ARG  28   1.958   5.476  -7.091
  216   2HG   ARG  28          HG1       ARG  28   2.109   5.460  -5.337
  217   1HD   ARG  28          HD2       ARG  28   3.601   3.784  -6.111
  218   2HD   ARG  28          HD1       ARG  28   2.190   2.916  -5.508
  219    HE   ARG  28           HE       ARG  28   1.439   2.811  -7.905
  220   1HH1  ARG  28          HH21      ARG  28   3.826   4.531  -8.851
  221   2HH1  ARG  28          HH22      ARG  28   4.837   3.318  -9.561
  222   1HH2  ARG  28          HH11      ARG  28   3.163   0.675  -8.068
  223   2HH2  ARG  28          HH12      ARG  28   4.463   1.135  -9.117
  224    H    ILE  29           HN       ILE  29  -2.166   5.520  -4.370
  225    HA   ILE  29           HA       ILE  29  -4.268   4.292  -5.812
  226    HB   ILE  29           HB       ILE  29  -4.163   5.592  -3.095
  227   1HG1  ILE  29          HG12      ILE  29  -2.896   3.489  -3.367
  228   2HG1  ILE  29          HG11      ILE  29  -4.269   3.262  -2.297
  229   1HG2  ILE  29          HG21      ILE  29  -6.368   4.347  -2.732
  230   2HG2  ILE  29          HG22      ILE  29  -6.476   4.240  -4.489
  231   3HG2  ILE  29          HG23      ILE  29  -6.447   5.818  -3.701
  232   1HD1  ILE  29          HD11      ILE  29  -5.445   2.544  -4.621
  233   2HD1  ILE  29          HD12      ILE  29  -4.539   1.403  -3.635
  234   3HD1  ILE  29          HD13      ILE  29  -3.774   2.157  -5.027
  235    H    GLN  30           HN       GLN  30  -3.842   7.605  -4.675
  236    HA   GLN  30           HA       GLN  30  -6.344   8.624  -5.588
  237   1HB   GLN  30          HB2       GLN  30  -4.906   9.833  -3.969
  238   2HB   GLN  30          HB1       GLN  30  -3.690  10.054  -5.225
  239   1HG   GLN  30          HG2       GLN  30  -5.186  11.426  -6.533
  240   2HG   GLN  30          HG1       GLN  30  -6.540  11.065  -5.463
  241   1HE2  GLN  30          HE21      GLN  30  -5.888  13.752  -5.839
  242   2HE2  GLN  30          HE22      GLN  30  -5.165  14.371  -4.434
  243    H    TYR  31           HN       TYR  31  -3.181   8.431  -7.262
  244    HA   TYR  31           HA       TYR  31  -4.126   9.796  -9.555
  245   1HB   TYR  31          HB2       TYR  31  -1.784   8.010  -8.946
  246   2HB   TYR  31          HB1       TYR  31  -2.153   8.372 -10.632
  247    HD1  TYR  31           HD1      TYR  31  -2.108  10.273  -7.386
  248    HD2  TYR  31           HD2      TYR  31  -0.930  10.156 -11.516
  249    HE1  TYR  31           HE1      TYR  31  -1.020  12.485  -7.139
  250    HE2  TYR  31           HE2      TYR  31   0.156  12.369 -11.268
  251    HH   TYR  31           HH       TYR  31   0.092  14.297  -9.859
  252    H    ALA  32           HN       ALA  32  -4.099   6.380  -8.633
  253    HA   ALA  32           HA       ALA  32  -5.033   5.417 -11.139
  254   1HB   ALA  32          HB1       ALA  32  -4.979   4.238  -8.367
  255   2HB   ALA  32          HB2       ALA  32  -3.915   3.880  -9.727
  256   3HB   ALA  32          HB3       ALA  32  -5.598   3.356  -9.763
  257    H    PHE  33           HN       PHE  33  -6.601   6.425  -8.159
  258    HA   PHE  33           HA       PHE  33  -9.279   6.044  -9.401
  259   1HB   PHE  33          HB2       PHE  33  -8.415   5.876  -6.513
  260   2HB   PHE  33          HB1       PHE  33 -10.091   5.859  -7.058
  261    HD1  PHE  33           HD1      PHE  33 -10.914   4.023  -8.543
  262    HD2  PHE  33           HD2      PHE  33  -7.003   3.947  -6.766
  263    HE1  PHE  33           HE1      PHE  33 -10.735   1.600  -9.039
  264    HE2  PHE  33           HE2      PHE  33  -6.827   1.523  -7.261
  265    HZ   PHE  33           HZ       PHE  33  -8.691   0.350  -8.398
  266    HA   PRO  34           HA       PRO  34  -8.742  10.567  -8.687
  267   1HB   PRO  34          HB2       PRO  34 -10.337  11.070 -11.055
  268   2HB   PRO  34          HB1       PRO  34  -8.615  11.382 -10.796
  269   1HG   PRO  34          HG2       PRO  34  -9.671   9.451 -12.495
  270   2HG   PRO  34          HG1       PRO  34  -8.005   9.501 -11.898
  271   1HD   PRO  34          HD2       PRO  34 -10.268   7.772 -11.013
  272   2HD   PRO  34          HD1       PRO  34  -8.517   7.461 -10.981
  273    H    ASP  35           HN       ASP  35 -11.603   8.720  -9.480
  274    HA   ASP  35           HA       ASP  35 -13.425  10.772  -8.480
  275   1HB   ASP  35          HB2       ASP  35 -15.193   9.305  -9.308
  276   2HB   ASP  35          HB1       ASP  35 -13.980   9.617 -10.546
  277    H    ASN  36           HN       ASN  36 -11.778   8.147  -6.979
  278    HA   ASN  36           HA       ASN  36 -13.991   7.916  -5.002
  279   1HB   ASN  36          HB2       ASN  36 -12.005   5.790  -5.769
  280   2HB   ASN  36          HB1       ASN  36 -13.305   5.629  -4.596
  281   1HD2  ASN  36          HD21      ASN  36 -15.463   6.822  -5.877
  282   2HD2  ASN  36          HD22      ASN  36 -15.807   6.002  -7.323
  283    H    GLU  37           HN       GLU  37 -13.371   8.499  -2.823
  284    HA   GLU  37           HA       GLU  37 -10.823   9.442  -2.156
  285   1HB   GLU  37          HB2       GLU  37 -12.998   8.254  -0.431
  286   2HB   GLU  37          HB1       GLU  37 -11.694   9.303   0.109
  287   1HG   GLU  37          HG2       GLU  37 -12.582  11.141  -1.318
  288   2HG   GLU  37          HG1       GLU  37 -13.883  10.077  -1.858
  289    H    GLY  38           HN       GLY  38  -9.003   8.242  -1.779
  290   1HA   GLY  38          HA2       GLY  38  -9.270   5.349  -1.061
  291   2HA   GLY  38          HA1       GLY  38  -7.934   5.927  -1.803
  292    H    HIS  39           HN       HIS  39  -8.802   4.913   1.220
  293    HA   HIS  39           HA       HIS  39  -6.926   6.794   2.514
  294   1HB   HIS  39          HB2       HIS  39  -9.155   6.856   3.534
  295   2HB   HIS  39          HB1       HIS  39  -9.114   5.105   3.761
  296    HD1  HIS  39           HD1      HIS  39  -6.676   7.944   4.565
  297    HD2  HIS  39           HD2      HIS  39  -8.331   4.558   6.347
  298    HE1  HIS  39           HE1      HIS  39  -5.663   7.786   6.880
  299    H    VAL  40           HN       VAL  40  -4.984   5.818   3.040
  300    HA   VAL  40           HA       VAL  40  -4.882   2.875   3.085
  301    HB   VAL  40           HB       VAL  40  -2.669   4.846   2.506
  302   1HG1  VAL  40          HG11      VAL  40  -1.879   2.699   3.346
  303   2HG1  VAL  40          HG12      VAL  40  -1.569   2.795   1.612
  304   3HG1  VAL  40          HG13      VAL  40  -2.923   1.842   2.213
  305   1HG2  VAL  40          HG21      VAL  40  -3.008   4.141   0.145
  306   2HG2  VAL  40          HG22      VAL  40  -4.438   4.954   0.785
  307   3HG2  VAL  40          HG23      VAL  40  -4.412   3.197   0.639
  308    H    SER  41           HN       SER  41  -4.288   1.914   4.890
  309    HA   SER  41           HA       SER  41  -2.841   3.465   6.961
  310   1HB   SER  41          HB2       SER  41  -5.114   3.183   7.782
  311   2HB   SER  41          HB1       SER  41  -5.080   1.463   7.405
  312    HG   SER  41           HG       SER  41  -3.206   1.420   8.890
  313    H    VAL  42           HN       VAL  42  -1.169   2.478   7.959
  314    HA   VAL  42           HA       VAL  42  -0.613  -0.335   7.231
  315    HB   VAL  42           HB       VAL  42   1.485   1.849   7.299
  316   1HG1  VAL  42          HG11      VAL  42   2.383  -0.345   7.762
  317   2HG1  VAL  42          HG12      VAL  42   2.810   0.074   6.103
  318   3HG1  VAL  42          HG13      VAL  42   1.486  -1.048   6.417
  319   1HG2  VAL  42          HG21      VAL  42   0.191   0.540   4.889
  320   2HG2  VAL  42          HG22      VAL  42   1.489   1.729   4.850
  321   3HG2  VAL  42          HG23      VAL  42  -0.115   2.190   5.424
  322    H    ARG  43           HN       ARG  43  -0.116  -1.588   8.884
  323    HA   ARG  43           HA       ARG  43   1.093  -0.441  11.281
  324   1HB   ARG  43          HB2       ARG  43  -0.636  -1.331  12.780
  325   2HB   ARG  43          HB1       ARG  43  -1.323  -0.162  11.651
  326   1HG   ARG  43          HG2       ARG  43  -1.957  -2.115  10.166
  327   2HG   ARG  43          HG1       ARG  43  -1.487  -3.180  11.493
  328   1HD   ARG  43          HD2       ARG  43  -3.132  -2.167  12.961
  329   2HD   ARG  43          HD1       ARG  43  -3.534  -0.961  11.741
  330    HE   ARG  43           HE       ARG  43  -4.072  -3.234  10.419
  331   1HH1  ARG  43          HH11      ARG  43  -4.258  -3.678  13.686
  332   2HH1  ARG  43          HH12      ARG  43  -5.968  -3.941  13.769
  333   1HH2  ARG  43          HH21      ARG  43  -6.549  -2.944  10.499
  334   2HH2  ARG  43          HH22      ARG  43  -7.265  -3.526  11.966
  335    H    TYR  44           HN       TYR  44   1.770  -2.149  12.841
  336    HA   TYR  44           HA       TYR  44   2.669  -4.556  11.419
  337   1HB   TYR  44          HB2       TYR  44   3.153  -3.660  14.274
  338   2HB   TYR  44          HB1       TYR  44   3.873  -5.072  13.510
  339    HD1  TYR  44           HD1      TYR  44   3.855  -1.397  13.669
  340    HD2  TYR  44           HD2      TYR  44   5.554  -4.850  11.782
  341    HE1  TYR  44           HE1      TYR  44   5.689   0.006  12.766
  342    HE2  TYR  44           HE2      TYR  44   7.397  -3.462  10.877
  343    HH   TYR  44           HH       TYR  44   7.528   0.050  11.519
  344    H    ALA  45           HN       ALA  45   2.041  -6.595  11.769
  345    HA   ALA  45           HA       ALA  45   0.030  -7.160  13.832
  346   1HB   ALA  45          HB1       ALA  45  -1.116  -6.576  11.638
  347   2HB   ALA  45          HB2       ALA  45  -1.487  -8.173  12.286
  348   3HB   ALA  45          HB3       ALA  45  -0.345  -8.005  10.952
  349    H    ALA  46           HN       ALA  46  -0.315  -9.611  13.959
  350    HA   ALA  46           HA       ALA  46   2.203 -10.855  14.229
  351   1HB   ALA  46          HB1       ALA  46   1.029 -12.832  14.857
  352   2HB   ALA  46          HB2       ALA  46  -0.394 -12.374  13.922
  353   3HB   ALA  46          HB3       ALA  46   0.004 -11.504  15.403
  354    H    ALA  47           HN       ALA  47   0.038 -10.633  11.485
  355    HA   ALA  47           HA       ALA  47   2.051 -12.127   9.922
  356   1HB   ALA  47          HB1       ALA  47   0.313 -13.744  10.409
  357   2HB   ALA  47          HB2       ALA  47   0.215 -13.290   8.708
  358   3HB   ALA  47          HB3       ALA  47  -0.933 -12.620   9.867
  359    H    ASN  48           HN       ASN  48   2.154 -11.650   7.701
  360    HA   ASN  48           HA       ASN  48   1.482  -8.940   6.966
  361   1HB   ASN  48          HB2       ASN  48   3.452 -10.289   6.084
  362   2HB   ASN  48          HB1       ASN  48   2.289 -11.204   5.127
  363   1HD2  ASN  48          HD21      ASN  48   2.436 -10.422   3.013
  364   2HD2  ASN  48          HD22      ASN  48   2.462  -8.777   2.594
  365    H    ASN  49           HN       ASN  49  -0.457  -8.266   6.119
  366    HA   ASN  49           HA       ASN  49  -2.087 -10.122   4.558
  367   1HB   ASN  49          HB2       ASN  49  -3.133  -8.790   7.067
  368   2HB   ASN  49          HB1       ASN  49  -4.105  -9.682   5.899
  369   1HD2  ASN  49          HD21      ASN  49  -2.599 -11.939   5.374
  370   2HD2  ASN  49          HD22      ASN  49  -2.335 -12.820   6.801
  371    H    LEU  50           HN       LEU  50  -3.592  -9.084   3.209
  372    HA   LEU  50           HA       LEU  50  -3.519  -6.125   3.158
  373   1HB   LEU  50          HB2       LEU  50  -2.156  -7.210   1.307
  374   2HB   LEU  50          HB1       LEU  50  -3.637  -7.995   0.765
  375    HG   LEU  50           HG       LEU  50  -4.606  -5.531   0.749
  376   1HD1  LEU  50          HD11      LEU  50  -2.442  -4.644   1.793
  377   2HD1  LEU  50          HD12      LEU  50  -3.021  -3.790   0.370
  378   3HD1  LEU  50          HD13      LEU  50  -1.686  -4.929   0.228
  379   1HD2  LEU  50          HD21      LEU  50  -4.540  -6.662  -1.320
  380   2HD2  LEU  50          HD22      LEU  50  -2.782  -6.804  -1.297
  381   3HD2  LEU  50          HD23      LEU  50  -3.537  -5.243  -1.616
  382    H    SER  51           HN       SER  51  -5.596  -5.362   3.483
  383    HA   SER  51           HA       SER  51  -7.858  -7.102   2.651
  384   1HB   SER  51          HB2       SER  51  -7.747  -7.033   5.062
  385   2HB   SER  51          HB1       SER  51  -7.582  -5.280   5.051
  386    HG   SER  51           HG       SER  51  -9.664  -5.232   4.017
  387    H    VAL  52           HN       VAL  52  -9.257  -6.139   1.237
  388    HA   VAL  52           HA       VAL  52  -9.217  -3.196   0.999
  389    HB   VAL  52           HB       VAL  52  -9.539  -5.207  -1.244
  390   1HG1  VAL  52          HG11      VAL  52  -9.472  -3.127  -2.659
  391   2HG1  VAL  52          HG12      VAL  52  -9.593  -2.176  -1.179
  392   3HG1  VAL  52          HG13      VAL  52 -10.912  -3.248  -1.649
  393   1HG2  VAL  52          HG21      VAL  52  -7.318  -3.256  -0.554
  394   2HG2  VAL  52          HG22      VAL  52  -7.404  -4.193  -2.046
  395   3HG2  VAL  52          HG23      VAL  52  -7.214  -5.015  -0.497
  396    H    ILE  53           HN       ILE  53 -11.195  -2.299   1.358
  397    HA   ILE  53           HA       ILE  53 -13.597  -4.034   1.084
  398    HB   ILE  53           HB       ILE  53 -13.125  -1.781   3.056
  399   1HG1  ILE  53          HG12      ILE  53 -13.419  -4.754   3.600
  400   2HG1  ILE  53          HG11      ILE  53 -11.856  -3.945   3.480
  401   1HG2  ILE  53          HG21      ILE  53 -15.444  -3.660   2.541
  402   2HG2  ILE  53          HG22      ILE  53 -15.453  -1.898   2.468
  403   3HG2  ILE  53          HG23      ILE  53 -15.279  -2.714   4.021
  404   1HD1  ILE  53          HD11      ILE  53 -12.831  -4.191   5.836
  405   2HD1  ILE  53          HD12      ILE  53 -14.020  -2.982   5.356
  406   3HD1  ILE  53          HD13      ILE  53 -12.304  -2.573   5.372
  407    H    GLY  54           HN       GLY  54 -15.148  -3.324  -0.255
  408   1HA   GLY  54          HA2       GLY  54 -16.586  -1.706  -1.211
  409   2HA   GLY  54          HA1       GLY  54 -15.426  -0.453  -0.778
  410    H    ALA  55           HN       ALA  55 -14.049  -3.218  -2.334
  411    HA   ALA  55           HA       ALA  55 -13.968  -1.715  -4.899
  412   1HB   ALA  55          HB1       ALA  55 -11.680  -3.466  -4.063
  413   2HB   ALA  55          HB2       ALA  55 -11.838  -1.869  -3.339
  414   3HB   ALA  55          HB3       ALA  55 -11.680  -2.030  -5.088
  415    H    THR  56           HN       THR  56 -13.446  -2.965  -6.780
  416    HA   THR  56           HA       THR  56 -14.852  -5.573  -6.990
  417    HB   THR  56           HB       THR  56 -14.547  -5.158  -9.369
  418    HG1  THR  56           HG1      THR  56 -12.722  -3.536  -8.620
  419   1HG2  THR  56          HG21      THR  56 -16.595  -4.395  -8.220
  420   2HG2  THR  56          HG22      THR  56 -16.163  -3.296  -9.530
  421   3HG2  THR  56          HG23      THR  56 -15.823  -2.852  -7.857
  422    H    LYS  57           HN       LYS  57 -13.932  -7.208  -8.160
  423    HA   LYS  57           HA       LYS  57 -11.442  -8.059  -7.303
  424   1HB   LYS  57          HB2       LYS  57 -11.686  -9.853  -8.918
  425   2HB   LYS  57          HB1       LYS  57 -13.252  -9.507  -8.187
  426   1HG   LYS  57          HG2       LYS  57 -13.756  -8.020 -10.160
  427   2HG   LYS  57          HG1       LYS  57 -12.279  -8.624 -10.911
  428   1HD   LYS  57          HD2       LYS  57 -13.177 -10.962 -10.614
  429   2HD   LYS  57          HD1       LYS  57 -14.702 -10.248 -10.093
  430   1HE   LYS  57          HE2       LYS  57 -14.852 -10.758 -12.465
  431   2HE   LYS  57          HE1       LYS  57 -14.805  -9.008 -12.267
  432   1HZ   LYS  57          HZ1       LYS  57 -12.795 -10.812 -13.372
  433   2HZ   LYS  57          HZ2       LYS  57 -12.228  -9.481 -12.482
  434   3HZ   LYS  57          HZ3       LYS  57 -13.215  -9.238 -13.842
  435    H    GLU  58           HN       GLU  58 -12.216  -6.388 -10.416
  436    HA   GLU  58           HA       GLU  58  -9.585  -6.735 -11.452
  437   1HB   GLU  58          HB2       GLU  58 -11.862  -4.867 -12.113
  438   2HB   GLU  58          HB1       GLU  58 -10.305  -4.761 -12.932
  439   1HG   GLU  58          HG2       GLU  58 -10.508  -7.111 -13.642
  440   2HG   GLU  58          HG1       GLU  58 -12.067  -7.233 -12.833
  441    H    ASP  59           HN       ASP  59 -11.128  -4.232  -9.477
  442    HA   ASP  59           HA       ASP  59  -9.019  -2.358  -9.641
  443   1HB   ASP  59          HB2       ASP  59 -11.132  -2.836  -7.526
  444   2HB   ASP  59          HB1       ASP  59  -9.988  -1.495  -7.459
  445    H    LYS  60           HN       LYS  60  -9.786  -4.997  -7.436
  446    HA   LYS  60           HA       LYS  60  -7.592  -4.606  -5.685
  447   1HB   LYS  60          HB2       LYS  60  -9.603  -5.978  -5.113
  448   2HB   LYS  60          HB1       LYS  60  -9.058  -7.196  -6.265
  449   1HG   LYS  60          HG2       LYS  60  -6.959  -7.468  -4.992
  450   2HG   LYS  60          HG1       LYS  60  -7.502  -6.250  -3.838
  451   1HD   LYS  60          HD2       LYS  60  -9.449  -7.658  -3.267
  452   2HD   LYS  60          HD1       LYS  60  -8.900  -8.878  -4.417
  453   1HE   LYS  60          HE2       LYS  60  -6.900  -9.292  -3.150
  454   2HE   LYS  60          HE1       LYS  60  -7.204  -7.901  -2.109
  455   1HZ   LYS  60          HZ1       LYS  60  -8.840  -8.981  -0.978
  456   2HZ   LYS  60          HZ2       LYS  60  -7.853 -10.308  -1.365
  457   3HZ   LYS  60          HZ3       LYS  60  -9.250  -9.990  -2.277
  458    H    GLN  61           HN       GLN  61  -7.810  -6.578  -8.673
  459    HA   GLN  61           HA       GLN  61  -5.236  -7.756  -8.313
  460   1HB   GLN  61          HB2       GLN  61  -6.978  -8.516  -9.995
  461   2HB   GLN  61          HB1       GLN  61  -6.612  -7.067 -10.932
  462   1HG   GLN  61          HG2       GLN  61  -4.254  -7.770 -11.104
  463   2HG   GLN  61          HG1       GLN  61  -4.618  -9.219 -10.169
  464   1HE2  GLN  61          HE21      GLN  61  -4.083 -10.646 -11.976
  465   2HE2  GLN  61          HE22      GLN  61  -5.099 -10.765 -13.331
  466    H    ARG  62           HN       ARG  62  -6.385  -4.760  -9.890
  467    HA   ARG  62           HA       ARG  62  -3.882  -3.983 -10.873
  468   1HB   ARG  62          HB2       ARG  62  -5.984  -2.911 -11.604
  469   2HB   ARG  62          HB1       ARG  62  -6.206  -2.237  -9.990
  470   1HG   ARG  62          HG2       ARG  62  -4.104  -0.962 -10.230
  471   2HG   ARG  62          HG1       ARG  62  -3.876  -1.634 -11.843
  472   1HD   ARG  62          HD2       ARG  62  -6.008  -0.616 -12.557
  473   2HD   ARG  62          HD1       ARG  62  -6.215   0.071 -10.947
  474    HE   ARG  62           HE       ARG  62  -4.606   1.676 -11.473
  475   1HH1  ARG  62          HH11      ARG  62  -5.561   1.600 -14.285
  476   2HH1  ARG  62          HH12      ARG  62  -4.108   1.317 -15.184
  477   1HH2  ARG  62          HH21      ARG  62  -2.303   0.227 -12.429
  478   2HH2  ARG  62          HH22      ARG  62  -2.263   0.539 -14.133
  479    H    ILE  63           HN       ILE  63  -5.462  -3.279  -7.782
  480    HA   ILE  63           HA       ILE  63  -3.400  -1.640  -6.776
  481    HB   ILE  63           HB       ILE  63  -5.395  -3.347  -5.311
  482   1HG1  ILE  63          HG12      ILE  63  -5.297  -0.336  -5.539
  483   2HG1  ILE  63          HG11      ILE  63  -6.138  -1.330  -6.727
  484   1HG2  ILE  63          HG21      ILE  63  -3.605  -3.046  -3.760
  485   2HG2  ILE  63          HG22      ILE  63  -4.788  -1.802  -3.357
  486   3HG2  ILE  63          HG23      ILE  63  -3.346  -1.381  -4.282
  487   1HD1  ILE  63          HD11      ILE  63  -6.676  -1.421  -3.745
  488   2HD1  ILE  63          HD12      ILE  63  -7.581  -2.261  -5.005
  489   3HD1  ILE  63          HD13      ILE  63  -7.641  -0.502  -4.902
  490    H    SER  64           HN       SER  64  -3.789  -5.138  -6.579
  491    HA   SER  64           HA       SER  64  -1.516  -5.609  -4.942
  492   1HB   SER  64          HB2       SER  64  -3.162  -7.383  -5.477
  493   2HB   SER  64          HB1       SER  64  -2.654  -7.340  -7.163
  494    HG   SER  64           HG       SER  64  -0.655  -7.633  -5.262
  495    H    GLU  65           HN       GLU  65  -1.901  -5.288  -8.526
  496    HA   GLU  65           HA       GLU  65   0.799  -5.785  -9.135
  497   1HB   GLU  65          HB2       GLU  65  -1.302  -4.153 -10.584
  498   2HB   GLU  65          HB1       GLU  65   0.306  -4.463 -11.242
  499   1HG   GLU  65          HG2       GLU  65  -1.596  -6.648 -10.357
  500   2HG   GLU  65          HG1       GLU  65  -1.457  -6.090 -12.023
  501    H    ILE  66           HN       ILE  66  -0.894  -2.789  -8.331
  502    HA   ILE  66           HA       ILE  66   1.249  -1.021  -8.743
  503    HB   ILE  66           HB       ILE  66  -1.164  -0.941  -6.932
  504   1HG1  ILE  66          HG12      ILE  66  -0.417   0.735  -9.343
  505   2HG1  ILE  66          HG11      ILE  66  -1.347  -0.758  -9.457
  506   1HG2  ILE  66          HG21      ILE  66  -0.508   1.601  -6.821
  507   2HG2  ILE  66          HG22      ILE  66   1.119   1.006  -7.142
  508   3HG2  ILE  66          HG23      ILE  66   0.254   0.466  -5.708
  509   1HD1  ILE  66          HD11      ILE  66  -2.661   1.469  -9.308
  510   2HD1  ILE  66          HD12      ILE  66  -2.201   1.469  -7.606
  511   3HD1  ILE  66          HD13      ILE  66  -3.169   0.149  -8.258
  512    H    LEU  67           HN       LEU  67   0.237  -2.790  -5.847
  513    HA   LEU  67           HA       LEU  67   2.213  -1.783  -4.127
  514   1HB   LEU  67          HB2       LEU  67   0.352  -2.995  -3.175
  515   2HB   LEU  67          HB1       LEU  67   0.689  -4.404  -4.172
  516    HG   LEU  67           HG       LEU  67   2.890  -4.665  -2.945
  517   1HD1  LEU  67          HD11      LEU  67   3.364  -2.547  -2.004
  518   2HD1  LEU  67          HD12      LEU  67   2.820  -3.487  -0.620
  519   3HD1  LEU  67          HD13      LEU  67   1.720  -2.347  -1.394
  520   1HD2  LEU  67          HD21      LEU  67   1.040  -6.061  -2.316
  521   2HD2  LEU  67          HD22      LEU  67   0.271  -4.748  -1.423
  522   3HD2  LEU  67          HD23      LEU  67   1.764  -5.469  -0.820
  523    H    GLN  68           HN       GLN  68   2.198  -4.553  -6.319
  524    HA   GLN  68           HA       GLN  68   4.777  -5.520  -5.616
  525   1HB   GLN  68          HB2       GLN  68   3.167  -6.830  -6.977
  526   2HB   GLN  68          HB1       GLN  68   3.348  -5.663  -8.287
  527   1HG   GLN  68          HG2       GLN  68   5.740  -6.188  -8.461
  528   2HG   GLN  68          HG1       GLN  68   5.606  -7.306  -7.103
  529   1HE2  GLN  68          HE21      GLN  68   6.153  -9.199  -8.364
  530   2HE2  GLN  68          HE22      GLN  68   5.113  -9.811  -9.558
  531    H    GLU  69           HN       GLU  69   3.808  -3.273  -8.272
  532    HA   GLU  69           HA       GLU  69   6.421  -2.843  -9.157
  533   1HB   GLU  69          HB2       GLU  69   3.950  -1.129  -9.352
  534   2HB   GLU  69          HB1       GLU  69   5.474  -0.713 -10.136
  535   1HG   GLU  69          HG2       GLU  69   5.453  -2.870 -11.331
  536   2HG   GLU  69          HG1       GLU  69   3.929  -3.289 -10.553
  537    H    THR  70           HN       THR  70   4.559  -0.953  -6.759
  538    HA   THR  70           HA       THR  70   6.456   1.085  -6.396
  539    HB   THR  70           HB       THR  70   4.584  -0.081  -4.367
  540    HG1  THR  70           HG1      THR  70   4.269   2.102  -6.134
  541   1HG2  THR  70          HG21      THR  70   6.026   2.566  -4.533
  542   2HG2  THR  70          HG22      THR  70   6.245   1.320  -3.305
  543   3HG2  THR  70          HG23      THR  70   4.731   2.221  -3.386
  544    H    TRP  71           HN       TRP  71   5.928  -1.914  -4.715
  545    HA   TRP  71           HA       TRP  71   7.991  -1.790  -2.886
  546   1HB   TRP  71          HB2       TRP  71   6.160  -3.313  -2.676
  547   2HB   TRP  71          HB1       TRP  71   6.575  -4.084  -4.195
  548    HD1  TRP  71           HD1      TRP  71   7.423  -6.399  -3.673
  549    HE1  TRP  71           HE1      TRP  71   9.050  -7.458  -1.982
  550    HE3  TRP  71           HE3      TRP  71   8.538  -2.306  -0.783
  551    HZ2  TRP  71           HZ2      TRP  71  10.592  -6.696   0.288
  552    HZ3  TRP  71           HZ3      TRP  71  10.073  -2.522   1.135
  553    HH2  TRP  71           HH2      TRP  71  11.098  -4.709   1.682
  554    H    GLU  72           HN       GLU  72   7.989  -2.917  -6.199
  555    HA   GLU  72           HA       GLU  72  10.703  -3.828  -6.108
  556   1HB   GLU  72          HB2       GLU  72   8.796  -3.406  -8.407
  557   2HB   GLU  72          HB1       GLU  72  10.447  -3.982  -8.632
  558   1HG   GLU  72          HG2       GLU  72   8.464  -5.308  -6.766
  559   2HG   GLU  72          HG1       GLU  72   8.709  -5.813  -8.437
  560    H    SER  73           HN       SER  73   9.339  -0.667  -6.583
  561    HA   SER  73           HA       SER  73  11.881   0.241  -7.829
  562   1HB   SER  73          HB2       SER  73  10.710   2.200  -8.557
  563   2HB   SER  73          HB1       SER  73   9.690   0.821  -8.953
  564    HG   SER  73           HG       SER  73   9.128   1.570  -6.476
  565    H    ALA  74           HN       ALA  74  11.249  -0.407  -4.926
  566    HA   ALA  74           HA       ALA  74  11.016   1.722  -3.301
  567   1HB   ALA  74          HB1       ALA  74  12.163   0.392  -1.642
  568   2HB   ALA  74          HB2       ALA  74  12.838  -0.637  -2.904
  569   3HB   ALA  74          HB3       ALA  74  11.098  -0.619  -2.619
  570    H    ASP  75           HN       ASP  75  14.020   0.855  -4.989
  571    HA   ASP  75           HA       ASP  75  15.721   2.472  -3.379
  572   1HB   ASP  75          HB2       ASP  75  15.997   1.386  -6.180
  573   2HB   ASP  75          HB1       ASP  75  17.278   2.281  -5.364
  574    H    ASP  76           HN       ASP  76  13.510   3.325  -5.926
  575    HA   ASP  76           HA       ASP  76  14.901   5.855  -6.520
  576   1HB   ASP  76          HB2       ASP  76  12.470   4.489  -7.668
  577   2HB   ASP  76          HB1       ASP  76  12.969   6.115  -8.135
  578    H    TRP  77           HN       TRP  77  11.736   4.855  -5.172
  579    HA   TRP  77           HA       TRP  77  11.140   7.675  -4.603
  580   1HB   TRP  77          HB2       TRP  77   8.952   7.027  -4.119
  581   2HB   TRP  77          HB1       TRP  77   9.442   6.111  -5.525
  582    HD1  TRP  77           HD1      TRP  77   9.434   3.484  -5.339
  583    HE1  TRP  77           HE1      TRP  77   8.770   1.845  -3.489
  584    HE3  TRP  77           HE3      TRP  77   9.042   6.700  -1.289
  585    HZ2  TRP  77           HZ2      TRP  77   8.160   1.844  -0.721
  586    HZ3  TRP  77           HZ3      TRP  77   8.409   5.797   0.895
  587    HH2  TRP  77           HH2      TRP  77   7.975   3.399   1.191
  588    H    PHE  78           HN       PHE  78  12.483   5.038  -2.782
  589    HA   PHE  78           HA       PHE  78  11.671   6.294  -0.235
  590   1HB   PHE  78          HB2       PHE  78  11.643   3.894  -0.184
  591   2HB   PHE  78          HB1       PHE  78  13.273   3.811  -0.824
  592    HD1  PHE  78           HD1      PHE  78  15.240   4.309   0.550
  593    HD2  PHE  78           HD2      PHE  78  11.259   4.621   2.166
  594    HE1  PHE  78           HE1      PHE  78  16.174   4.443   2.835
  595    HE2  PHE  78           HE2      PHE  78  12.211   4.746   4.449
  596    HZ   PHE  78           HZ       PHE  78  14.664   4.654   4.786
  597    H    VAL  79           HN       VAL  79  12.824   7.798   0.718
  598    HA   VAL  79           HA       VAL  79  15.690   8.073   0.049
  599    HB   VAL  79           HB       VAL  79  15.151  10.577   0.585
  600   1HG1  VAL  79          HG11      VAL  79  14.484  10.949  -1.772
  601   2HG1  VAL  79          HG12      VAL  79  14.102   9.234  -1.927
  602   3HG1  VAL  79          HG13      VAL  79  15.768   9.747  -1.654
  603   1HG2  VAL  79          HG21      VAL  79  12.882  11.263   0.257
  604   2HG2  VAL  79          HG22      VAL  79  12.810   9.929   1.406
  605   3HG2  VAL  79          HG23      VAL  79  12.396   9.656  -0.291
  606    H    SER  80           HN       SER  80  17.075   8.258   1.927
  607    HA   SER  80           HA       SER  80  15.704   8.546   4.552
  608   1HB   SER  80          HB2       SER  80  17.566   7.071   5.414
  609   2HB   SER  80          HB1       SER  80  16.445   6.242   4.331
  610    HG   SER  80           HG       SER  80  18.328   7.366   2.849
  611    H    GLU  81           HN       GLU  81  16.557   9.931   5.953
  612    HA   GLU  81           HA       GLU  81  19.249  10.923   5.779
  613   1HB   GLU  81          HB2       GLU  81  18.197  12.189   3.929
  614   2HB   GLU  81          HB1       GLU  81  17.000  12.820   5.059
  615   1HG   GLU  81          HG2       GLU  81  18.801  13.868   6.387
  616   2HG   GLU  81          HG1       GLU  81  19.999  13.236   5.258
  Start of MODEL   16
    1   1H    MET   1          HT1       MET   1 -14.779   3.824  -0.509
    2   2H    MET   1          HT2       MET   1 -13.687   4.452  -1.650
    3   3H    MET   1          HT3       MET   1 -13.405   4.672   0.011
    4    HA   MET   1           HA       MET   1 -13.679   1.931  -0.436
    5   1HB   MET   1          HB2       MET   1 -13.152   2.433  -2.790
    6   2HB   MET   1          HB1       MET   1 -11.708   3.313  -2.284
    7   1HG   MET   1          HG2       MET   1 -10.717   1.308  -1.381
    8   2HG   MET   1          HG1       MET   1 -12.210   0.404  -1.614
    9   1HE   MET   1          HE1       MET   1  -9.082   1.884  -2.949
   10   2HE   MET   1          HE2       MET   1 -10.076   2.921  -3.967
   11   3HE   MET   1          HE3       MET   1  -9.091   1.661  -4.702
   12    H    ARG   2           HN       ARG   2 -12.145   0.937   0.927
   13    HA   ARG   2           HA       ARG   2 -10.099   2.720   2.137
   14   1HB   ARG   2          HB2       ARG   2 -11.932   0.728   3.489
   15   2HB   ARG   2          HB1       ARG   2 -10.507   1.417   4.269
   16   1HG   ARG   2          HG2       ARG   2 -11.402   3.690   3.912
   17   2HG   ARG   2          HG1       ARG   2 -12.830   3.003   3.136
   18   1HD   ARG   2          HD2       ARG   2 -11.959   2.481   5.992
   19   2HD   ARG   2          HD1       ARG   2 -13.281   3.537   5.501
   20    HE   ARG   2           HE       ARG   2 -13.686   0.960   4.400
   21   1HH1  ARG   2          HH11      ARG   2 -12.843   1.339   7.571
   22   2HH1  ARG   2          HH12      ARG   2 -14.366   0.881   8.254
   23   1HH2  ARG   2          HH21      ARG   2 -16.039   0.922   5.216
   24   2HH2  ARG   2          HH22      ARG   2 -16.179   0.644   6.920
   25    H    ILE   3           HN       ILE   3  -8.093   1.917   2.242
   26    HA   ILE   3           HA       ILE   3  -7.642  -0.947   1.516
   27    HB   ILE   3           HB       ILE   3  -5.901   1.463   0.979
   28   1HG1  ILE   3          HG12      ILE   3  -7.362  -0.322  -0.981
   29   2HG1  ILE   3          HG11      ILE   3  -8.044   1.190  -0.381
   30   1HG2  ILE   3          HG21      ILE   3  -4.661  -0.247  -0.430
   31   2HG2  ILE   3          HG22      ILE   3  -5.609  -1.491   0.385
   32   3HG2  ILE   3          HG23      ILE   3  -4.509  -0.470   1.313
   33   1HD1  ILE   3          HD11      ILE   3  -6.734   1.309  -2.594
   34   2HD1  ILE   3          HD12      ILE   3  -5.290   1.072  -1.611
   35   3HD1  ILE   3          HD13      ILE   3  -6.311   2.487  -1.352
   36    H    GLU   4           HN       GLU   4  -6.660  -2.104   3.104
   37    HA   GLU   4           HA       GLU   4  -4.973  -0.663   5.098
   38   1HB   GLU   4          HB2       GLU   4  -6.875  -2.975   5.583
   39   2HB   GLU   4          HB1       GLU   4  -5.717  -2.374   6.769
   40   1HG   GLU   4          HG2       GLU   4  -6.758  -0.139   6.654
   41   2HG   GLU   4          HG1       GLU   4  -7.919  -0.741   5.473
   42    H    VAL   5           HN       VAL   5  -2.976  -1.343   5.323
   43    HA   VAL   5           HA       VAL   5  -2.222  -4.016   4.244
   44    HB   VAL   5           HB       VAL   5  -0.429  -1.593   4.371
   45   1HG1  VAL   5          HG11      VAL   5   0.799  -2.929   2.610
   46   2HG1  VAL   5          HG12      VAL   5  -0.285  -4.271   2.971
   47   3HG1  VAL   5          HG13      VAL   5   0.797  -3.652   4.218
   48   1HG2  VAL   5          HG21      VAL   5  -0.880  -1.577   1.826
   49   2HG2  VAL   5          HG22      VAL   5  -2.130  -0.908   2.873
   50   3HG2  VAL   5          HG23      VAL   5  -2.314  -2.527   2.206
   51    H    THR   6           HN       THR   6  -1.161  -5.377   5.562
   52    HA   THR   6           HA       THR   6  -0.095  -4.330   8.133
   53    HB   THR   6           HB       THR   6  -0.630  -6.697   8.971
   54    HG1  THR   6           HG1      THR   6  -2.664  -7.262   7.579
   55   1HG2  THR   6          HG21      THR   6  -3.074  -6.083   9.293
   56   2HG2  THR   6          HG22      THR   6  -2.781  -4.699   8.242
   57   3HG2  THR   6          HG23      THR   6  -1.918  -4.841   9.773
   58    H    ILE   7           HN       ILE   7   1.887  -4.868   8.669
   59    HA   ILE   7           HA       ILE   7   3.405  -6.717   6.923
   60    HB   ILE   7           HB       ILE   7   4.120  -4.154   8.327
   61   1HG1  ILE   7          HG12      ILE   7   4.518  -5.031   5.452
   62   2HG1  ILE   7          HG11      ILE   7   3.100  -4.149   6.018
   63   1HG2  ILE   7          HG21      ILE   7   6.003  -5.563   8.800
   64   2HG2  ILE   7          HG22      ILE   7   6.471  -4.658   7.362
   65   3HG2  ILE   7          HG23      ILE   7   5.924  -6.330   7.215
   66   1HD1  ILE   7          HD11      ILE   7   4.682  -2.381   6.909
   67   2HD1  ILE   7          HD12      ILE   7   4.638  -2.515   5.152
   68   3HD1  ILE   7          HD13      ILE   7   5.979  -3.217   6.056
   69    H    ALA   8           HN       ALA   8   4.406  -8.411   7.905
   70    HA   ALA   8           HA       ALA   8   3.853  -9.081  10.593
   71   1HB   ALA   8          HB1       ALA   8   5.518 -10.905  10.193
   72   2HB   ALA   8          HB2       ALA   8   5.888 -10.160   8.637
   73   3HB   ALA   8          HB3       ALA   8   4.274 -10.800   8.948
   74    H    LYS   9           HN       LYS   9   4.832  -8.763  12.337
   75    HA   LYS   9           HA       LYS   9   6.807  -6.807  12.693
   76   1HB   LYS   9          HB2       LYS   9   5.680  -8.954  14.513
   77   2HB   LYS   9          HB1       LYS   9   6.937  -7.868  15.096
   78   1HG   LYS   9          HG2       LYS   9   5.455  -5.934  14.687
   79   2HG   LYS   9          HG1       LYS   9   4.202  -7.015  14.062
   80   1HD   LYS   9          HD2       LYS   9   4.126  -8.155  16.253
   81   2HD   LYS   9          HD1       LYS   9   5.360  -7.051  16.863
   82   1HE   LYS   9          HE2       LYS   9   3.879  -5.137  16.471
   83   2HE   LYS   9          HE1       LYS   9   2.652  -6.205  15.792
   84   1HZ   LYS   9          HZ1       LYS   9   2.121  -5.763  18.064
   85   2HZ   LYS   9          HZ2       LYS   9   3.676  -6.215  18.578
   86   3HZ   LYS   9          HZ3       LYS   9   2.615  -7.382  17.945
   87    H    THR  10           HN       THR  10   7.143 -10.201  12.068
   88    HA   THR  10           HA       THR  10   9.756 -10.595  13.066
   89    HB   THR  10           HB       THR  10   9.850 -12.381  11.278
   90    HG1  THR  10           HG1      THR  10   8.303 -11.055   9.964
   91   1HG2  THR  10          HG21      THR  10   8.330 -13.813  12.403
   92   2HG2  THR  10          HG22      THR  10   7.250 -12.481  12.814
   93   3HG2  THR  10          HG23      THR  10   8.811 -12.632  13.619
   94    H    SER  11           HN       SER  11   8.596  -8.539  10.628
   95    HA   SER  11           HA       SER  11  11.325  -8.286   9.467
   96   1HB   SER  11          HB2       SER  11   8.662  -7.892   8.090
   97   2HB   SER  11          HB1       SER  11  10.238  -7.577   7.372
   98    HG   SER  11           HG       SER  11  10.644  -9.690   7.303
   99    HA   PRO  12           HA       PRO  12  10.140  -4.168  11.300
  100   1HB   PRO  12          HB2       PRO  12  12.799  -4.000  12.413
  101   2HB   PRO  12          HB1       PRO  12  11.278  -4.196  13.300
  102   1HG   PRO  12          HG2       PRO  12  13.285  -6.113  13.108
  103   2HG   PRO  12          HG1       PRO  12  11.609  -6.425  13.584
  104   1HD   PRO  12          HD2       PRO  12  12.948  -6.945  10.962
  105   2HD   PRO  12          HD1       PRO  12  11.605  -7.802  11.738
  106    H    LEU  13           HN       LEU  13  10.263  -2.355  10.337
  107    HA   LEU  13           HA       LEU  13  12.414  -2.007   8.330
  108   1HB   LEU  13          HB2       LEU  13   9.702  -0.673   8.406
  109   2HB   LEU  13          HB1       LEU  13  10.849  -0.689   7.068
  110    HG   LEU  13           HG       LEU  13   9.329  -3.067   8.184
  111   1HD1  LEU  13          HD11      LEU  13   8.052  -1.555   6.666
  112   2HD1  LEU  13          HD12      LEU  13   8.310  -3.150   5.966
  113   3HD1  LEU  13          HD13      LEU  13   9.289  -1.789   5.430
  114   1HD2  LEU  13          HD21      LEU  13  11.425  -3.984   7.577
  115   2HD2  LEU  13          HD22      LEU  13  11.616  -2.888   6.212
  116   3HD2  LEU  13          HD23      LEU  13  10.451  -4.208   6.129
  117    HA   PRO  14           HA       PRO  14  14.087   1.303  10.649
  118   1HB   PRO  14          HB2       PRO  14  14.252   3.255   8.495
  119   2HB   PRO  14          HB1       PRO  14  15.557   2.288   9.199
  120   1HG   PRO  14          HG2       PRO  14  14.140   1.892   6.693
  121   2HG   PRO  14          HG1       PRO  14  15.599   1.087   7.285
  122   1HD   PRO  14          HD2       PRO  14  13.069  -0.106   7.040
  123   2HD   PRO  14          HD1       PRO  14  14.419  -0.750   7.991
  124    H    ALA  15           HN       ALA  15  13.662   3.199  11.647
  125    HA   ALA  15           HA       ALA  15  11.013   3.834  12.225
  126   1HB   ALA  15          HB1       ALA  15  13.122   4.250  13.582
  127   2HB   ALA  15          HB2       ALA  15  11.878   5.499  13.643
  128   3HB   ALA  15          HB3       ALA  15  13.310   5.730  12.639
  129    H    GLY  16           HN       GLY  16  10.822   4.078   9.519
  130   1HA   GLY  16          HA2       GLY  16   9.802   6.720   9.135
  131   2HA   GLY  16          HA1       GLY  16  11.336   6.537   8.306
  132    H    ALA  17           HN       ALA  17  10.560   3.582   8.168
  133    HA   ALA  17           HA       ALA  17   9.659   3.533   5.454
  134   1HB   ALA  17          HB1       ALA  17   9.472   1.042   5.982
  135   2HB   ALA  17          HB2       ALA  17  10.127   1.467   7.567
  136   3HB   ALA  17          HB3       ALA  17  11.071   1.780   6.113
  137    H    ILE  18           HN       ILE  18   7.807   2.694   8.391
  138    HA   ILE  18           HA       ILE  18   5.616   1.826   6.913
  139    HB   ILE  18           HB       ILE  18   5.685   3.137   9.640
  140   1HG1  ILE  18          HG12      ILE  18   6.970   1.059   9.547
  141   2HG1  ILE  18          HG11      ILE  18   5.487   0.803  10.453
  142   1HG2  ILE  18          HG21      ILE  18   3.461   1.684   8.194
  143   2HG2  ILE  18          HG22      ILE  18   3.428   3.317   8.860
  144   3HG2  ILE  18          HG23      ILE  18   3.476   1.925   9.941
  145   1HD1  ILE  18          HD11      ILE  18   6.275  -0.258   7.772
  146   2HD1  ILE  18          HD12      ILE  18   4.563   0.050   8.065
  147   3HD1  ILE  18          HD13      ILE  18   5.447  -1.066   9.099
  148    H    ASP  19           HN       ASP  19   6.273   5.037   8.297
  149    HA   ASP  19           HA       ASP  19   3.931   6.242   7.253
  150   1HB   ASP  19          HB2       ASP  19   6.570   7.448   8.129
  151   2HB   ASP  19          HB1       ASP  19   5.187   8.416   7.624
  152    H    ALA  20           HN       ALA  20   7.186   5.883   5.867
  153    HA   ALA  20           HA       ALA  20   6.604   7.566   3.684
  154   1HB   ALA  20          HB1       ALA  20   8.541   5.264   3.441
  155   2HB   ALA  20          HB2       ALA  20   8.917   6.643   4.472
  156   3HB   ALA  20          HB3       ALA  20   8.651   6.882   2.745
  157    H    LEU  21           HN       LEU  21   6.228   4.097   4.152
  158    HA   LEU  21           HA       LEU  21   5.509   3.412   1.556
  159   1HB   LEU  21          HB2       LEU  21   6.147   1.695   3.053
  160   2HB   LEU  21          HB1       LEU  21   4.996   2.218   4.276
  161    HG   LEU  21           HG       LEU  21   3.142   1.478   2.883
  162   1HD1  LEU  21          HD11      LEU  21   5.329   0.721   0.930
  163   2HD1  LEU  21          HD12      LEU  21   4.037   1.886   0.675
  164   3HD1  LEU  21          HD13      LEU  21   3.660   0.172   0.793
  165   1HD2  LEU  21          HD21      LEU  21   5.172  -0.758   2.887
  166   2HD2  LEU  21          HD22      LEU  21   3.436  -0.855   3.183
  167   3HD2  LEU  21          HD23      LEU  21   4.496  -0.123   4.386
  168    H    ALA  22           HN       ALA  22   3.479   4.263   4.328
  169    HA   ALA  22           HA       ALA  22   0.962   3.997   3.029
  170   1HB   ALA  22          HB1       ALA  22   1.409   4.241   5.543
  171   2HB   ALA  22          HB2       ALA  22   0.049   5.156   4.891
  172   3HB   ALA  22          HB3       ALA  22   1.576   5.969   5.230
  173    H    GLY  23           HN       GLY  23   3.191   6.747   3.207
  174   1HA   GLY  23          HA2       GLY  23   1.397   8.585   1.945
  175   2HA   GLY  23          HA1       GLY  23   3.158   8.736   2.142
  176    H    GLU  24           HN       GLU  24   4.042   6.555   0.587
  177    HA   GLU  24           HA       GLU  24   3.714   7.622  -2.008
  178   1HB   GLU  24          HB2       GLU  24   5.724   6.319  -1.366
  179   2HB   GLU  24          HB1       GLU  24   4.737   4.869  -1.188
  180   1HG   GLU  24          HG2       GLU  24   4.120   4.995  -3.586
  181   2HG   GLU  24          HG1       GLU  24   5.109   6.444  -3.760
  182    H    LEU  25           HN       LEU  25   2.217   4.878  -0.377
  183    HA   LEU  25           HA       LEU  25   0.841   3.907  -2.642
  184   1HB   LEU  25          HB2       LEU  25   0.618   3.490   0.299
  185   2HB   LEU  25          HB1       LEU  25  -0.735   2.981  -0.701
  186    HG   LEU  25           HG       LEU  25   1.137   1.255  -0.177
  187   1HD1  LEU  25          HD11      LEU  25  -0.688   0.951  -1.850
  188   2HD1  LEU  25          HD12      LEU  25   0.812   0.140  -2.299
  189   3HD1  LEU  25          HD13      LEU  25   0.363   1.654  -3.080
  190   1HD2  LEU  25          HD21      LEU  25   2.538   2.380  -2.596
  191   2HD2  LEU  25          HD22      LEU  25   3.142   1.304  -1.350
  192   3HD2  LEU  25          HD23      LEU  25   2.926   3.014  -0.996
  193    H    SER  26           HN       SER  26  -0.175   6.239  -0.174
  194    HA   SER  26           HA       SER  26  -2.854   6.472  -1.007
  195   1HB   SER  26          HB2       SER  26  -2.802   8.662   0.124
  196   2HB   SER  26          HB1       SER  26  -2.031   7.415   1.099
  197    HG   SER  26           HG       SER  26  -0.438   8.805   1.101
  198    H    ARG  27           HN       ARG  27   0.022   8.370  -2.014
  199    HA   ARG  27           HA       ARG  27  -1.376  10.101  -3.765
  200   1HB   ARG  27          HB2       ARG  27   1.485   9.115  -3.794
  201   2HB   ARG  27          HB1       ARG  27   0.867  10.353  -4.889
  202   1HG   ARG  27          HG2       ARG  27   0.206  11.737  -2.951
  203   2HG   ARG  27          HG1       ARG  27   0.838  10.502  -1.860
  204   1HD   ARG  27          HD2       ARG  27   3.080  10.770  -2.953
  205   2HD   ARG  27          HD1       ARG  27   2.418  12.109  -3.885
  206    HE   ARG  27           HE       ARG  27   2.484  13.429  -1.961
  207   1HH1  ARG  27          HH21      ARG  27   4.081  10.505  -1.446
  208   2HH1  ARG  27          HH22      ARG  27   4.089  10.604   0.283
  209   1HH2  ARG  27          HH11      ARG  27   2.023  13.387   0.396
  210   2HH2  ARG  27          HH12      ARG  27   2.922  12.236   1.327
  211    H    ARG  28           HN       ARG  28   0.052   6.898  -4.307
  212    HA   ARG  28           HA       ARG  28  -0.386   6.847  -7.089
  213   1HB   ARG  28          HB2       ARG  28   1.131   5.302  -5.986
  214   2HB   ARG  28          HB1       ARG  28  -0.215   4.560  -5.126
  215   1HG   ARG  28          HG2       ARG  28   0.446   3.226  -7.074
  216   2HG   ARG  28          HG1       ARG  28  -1.194   3.830  -7.268
  217   1HD   ARG  28          HD2       ARG  28  -0.481   5.481  -8.841
  218   2HD   ARG  28          HD1       ARG  28   1.217   5.251  -8.422
  219    HE   ARG  28           HE       ARG  28  -0.366   3.646 -10.231
  220   1HH1  ARG  28          HH11      ARG  28   2.127   3.420  -7.858
  221   2HH1  ARG  28          HH12      ARG  28   3.077   2.286  -8.760
  222   1HH2  ARG  28          HH21      ARG  28   0.974   2.304 -11.513
  223   2HH2  ARG  28          HH22      ARG  28   2.425   1.654 -10.826
  224    H    ILE  29           HN       ILE  29  -2.387   5.854  -4.370
  225    HA   ILE  29           HA       ILE  29  -4.474   4.640  -5.860
  226    HB   ILE  29           HB       ILE  29  -4.398   5.856  -3.101
  227   1HG1  ILE  29          HG12      ILE  29  -3.092   3.786  -3.428
  228   2HG1  ILE  29          HG11      ILE  29  -4.468   3.501  -2.376
  229   1HG2  ILE  29          HG21      ILE  29  -6.586   4.507  -2.822
  230   2HG2  ILE  29          HG22      ILE  29  -6.685   4.565  -4.582
  231   3HG2  ILE  29          HG23      ILE  29  -6.680   6.061  -3.650
  232   1HD1  ILE  29          HD11      ILE  29  -5.608   2.839  -4.735
  233   2HD1  ILE  29          HD12      ILE  29  -4.701   1.683  -3.772
  234   3HD1  ILE  29          HD13      ILE  29  -3.928   2.490  -5.130
  235    H    GLN  30           HN       GLN  30  -4.092   7.929  -4.622
  236    HA   GLN  30           HA       GLN  30  -6.618   8.916  -5.527
  237   1HB   GLN  30          HB2       GLN  30  -5.126  10.081  -3.870
  238   2HB   GLN  30          HB1       GLN  30  -4.032  10.462  -5.198
  239   1HG   GLN  30          HG2       GLN  30  -5.845  11.680  -6.349
  240   2HG   GLN  30          HG1       GLN  30  -6.945  11.305  -5.022
  241   1HE2  GLN  30          HE21      GLN  30  -7.215  13.532  -4.377
  242   2HE2  GLN  30          HE22      GLN  30  -5.954  14.417  -3.665
  243    H    TYR  31           HN       TYR  31  -3.452   8.772  -7.195
  244    HA   TYR  31           HA       TYR  31  -4.382  10.182  -9.467
  245   1HB   TYR  31          HB2       TYR  31  -1.975   9.842  -9.042
  246   2HB   TYR  31          HB1       TYR  31  -2.181   8.104  -9.268
  247    HD1  TYR  31           HD1      TYR  31  -2.443  11.408 -10.973
  248    HD2  TYR  31           HD2      TYR  31  -2.317   7.139 -11.445
  249    HE1  TYR  31           HE1      TYR  31  -2.217  11.685 -13.430
  250    HE2  TYR  31           HE2      TYR  31  -2.089   7.416 -13.898
  251    HH   TYR  31           HH       TYR  31  -2.626  10.400 -15.472
  252    H    ALA  32           HN       ALA  32  -4.375   6.765  -8.588
  253    HA   ALA  32           HA       ALA  32  -5.313   5.826 -11.100
  254   1HB   ALA  32          HB1       ALA  32  -5.333   4.595  -8.346
  255   2HB   ALA  32          HB2       ALA  32  -4.155   4.331  -9.630
  256   3HB   ALA  32          HB3       ALA  32  -5.804   3.736  -9.812
  257    H    PHE  33           HN       PHE  33  -6.885   6.856  -8.133
  258    HA   PHE  33           HA       PHE  33  -9.561   6.481  -9.389
  259   1HB   PHE  33          HB2       PHE  33  -8.757   6.284  -6.483
  260   2HB   PHE  33          HB1       PHE  33 -10.414   6.219  -7.083
  261    HD1  PHE  33           HD1      PHE  33  -7.182   4.467  -6.933
  262    HD2  PHE  33           HD2      PHE  33 -11.228   4.296  -8.363
  263    HE1  PHE  33           HE1      PHE  33  -6.905   2.053  -7.423
  264    HE2  PHE  33           HE2      PHE  33 -10.953   1.880  -8.847
  265    HZ   PHE  33           HZ       PHE  33  -8.790   0.758  -8.380
  266    HA   PRO  34           HA       PRO  34  -9.011  10.987  -8.576
  267   1HB   PRO  34          HB2       PRO  34 -10.590  11.533 -10.946
  268   2HB   PRO  34          HB1       PRO  34  -8.872  11.850 -10.663
  269   1HG   PRO  34          HG2       PRO  34  -9.900   9.949 -12.414
  270   2HG   PRO  34          HG1       PRO  34  -8.241   9.998 -11.799
  271   1HD   PRO  34          HD2       PRO  34 -10.496   8.229 -10.980
  272   2HD   PRO  34          HD1       PRO  34  -8.742   7.937 -10.924
  273    H    ASP  35           HN       ASP  35 -11.843   9.106  -9.354
  274    HA   ASP  35           HA       ASP  35 -13.725  11.129  -8.416
  275   1HB   ASP  35          HB2       ASP  35 -14.075   8.428  -9.702
  276   2HB   ASP  35          HB1       ASP  35 -15.421   9.431  -9.160
  277    H    ASN  36           HN       ASN  36 -12.071   8.499  -6.876
  278    HA   ASN  36           HA       ASN  36 -14.284   8.294  -4.896
  279   1HB   ASN  36          HB2       ASN  36 -12.376   6.176  -5.838
  280   2HB   ASN  36          HB1       ASN  36 -13.467   5.989  -4.470
  281   1HD2  ASN  36          HD21      ASN  36 -15.851   7.005  -5.264
  282   2HD2  ASN  36          HD22      ASN  36 -16.403   6.270  -6.691
  283    H    GLU  37           HN       GLU  37 -13.648   8.844  -2.704
  284    HA   GLU  37           HA       GLU  37 -11.081   9.735  -2.032
  285   1HB   GLU  37          HB2       GLU  37 -13.285   8.573  -0.325
  286   2HB   GLU  37          HB1       GLU  37 -11.936   9.541   0.251
  287   1HG   GLU  37          HG2       GLU  37 -12.742  11.469  -1.106
  288   2HG   GLU  37          HG1       GLU  37 -14.090  10.482  -1.682
  289    H    GLY  38           HN       GLY  38  -9.275   8.484  -1.682
  290   1HA   GLY  38          HA2       GLY  38  -9.609   5.592  -0.979
  291   2HA   GLY  38          HA1       GLY  38  -8.268   6.123  -1.747
  292    H    HIS  39           HN       HIS  39  -9.020   5.059   1.256
  293    HA   HIS  39           HA       HIS  39  -7.113   6.913   2.545
  294   1HB   HIS  39          HB2       HIS  39  -9.392   5.288   3.701
  295   2HB   HIS  39          HB1       HIS  39  -8.153   6.053   4.697
  296    HD1  HIS  39           HD1      HIS  39  -7.858   8.760   4.140
  297    HD2  HIS  39           HD2      HIS  39 -11.500   6.986   3.159
  298    HE1  HIS  39           HE1      HIS  39  -9.528  10.646   3.891
  299    H    VAL  40           HN       VAL  40  -5.160   5.924   3.003
  300    HA   VAL  40           HA       VAL  40  -5.045   2.981   2.993
  301    HB   VAL  40           HB       VAL  40  -2.870   4.987   2.389
  302   1HG1  VAL  40          HG11      VAL  40  -3.082   1.978   2.202
  303   2HG1  VAL  40          HG12      VAL  40  -1.928   2.921   3.144
  304   3HG1  VAL  40          HG13      VAL  40  -1.827   2.905   1.385
  305   1HG2  VAL  40          HG21      VAL  40  -4.754   5.017   0.731
  306   2HG2  VAL  40          HG22      VAL  40  -4.530   3.284   0.498
  307   3HG2  VAL  40          HG23      VAL  40  -3.250   4.403   0.040
  308    H    SER  41           HN       SER  41  -4.379   1.979   4.762
  309    HA   SER  41           HA       SER  41  -2.895   3.509   6.824
  310   1HB   SER  41          HB2       SER  41  -5.184   3.168   7.646
  311   2HB   SER  41          HB1       SER  41  -5.063   1.441   7.319
  312    HG   SER  41           HG       SER  41  -3.449   1.304   8.872
  313    H    VAL  42           HN       VAL  42  -1.192   2.538   7.784
  314    HA   VAL  42           HA       VAL  42  -0.601  -0.255   7.014
  315    HB   VAL  42           HB       VAL  42   1.436   1.998   7.059
  316   1HG1  VAL  42          HG11      VAL  42   1.629  -0.851   6.042
  317   2HG1  VAL  42          HG12      VAL  42   2.302  -0.272   7.568
  318   3HG1  VAL  42          HG13      VAL  42   2.921   0.350   6.038
  319   1HG2  VAL  42          HG21      VAL  42  -0.096   2.325   5.184
  320   2HG2  VAL  42          HG22      VAL  42   0.071   0.636   4.717
  321   3HG2  VAL  42          HG23      VAL  42   1.447   1.726   4.576
  322    H    ARG  43           HN       ARG  43  -0.072  -1.518   8.661
  323    HA   ARG  43           HA       ARG  43   1.132  -0.356  11.060
  324   1HB   ARG  43          HB2       ARG  43  -1.251  -0.065  11.459
  325   2HB   ARG  43          HB1       ARG  43  -1.549  -1.762  11.094
  326   1HG   ARG  43          HG2       ARG  43  -0.297  -2.473  13.030
  327   2HG   ARG  43          HG1       ARG  43   0.260  -0.827  13.339
  328   1HD   ARG  43          HD2       ARG  43  -2.638  -1.713  13.384
  329   2HD   ARG  43          HD1       ARG  43  -1.634  -1.513  14.817
  330    HE   ARG  43           HE       ARG  43  -2.738   0.618  13.150
  331   1HH1  ARG  43          HH21      ARG  43   0.124   1.322  13.713
  332   2HH1  ARG  43          HH22      ARG  43   0.009   2.178  15.214
  333   1HH2  ARG  43          HH11      ARG  43  -3.177   1.016  15.937
  334   2HH2  ARG  43          HH12      ARG  43  -1.861   2.005  16.474
  335    H    TYR  44           HN       TYR  44   1.858  -1.956  12.610
  336    HA   TYR  44           HA       TYR  44   2.832  -4.404  11.340
  337   1HB   TYR  44          HB2       TYR  44   3.205  -3.158  14.077
  338   2HB   TYR  44          HB1       TYR  44   3.783  -4.768  13.703
  339    HD1  TYR  44           HD1      TYR  44   5.159  -4.893  11.370
  340    HD2  TYR  44           HD2      TYR  44   4.754  -1.422  13.876
  341    HE1  TYR  44           HE1      TYR  44   7.251  -3.959  10.422
  342    HE2  TYR  44           HE2      TYR  44   6.849  -0.498  12.934
  343    HH   TYR  44           HH       TYR  44   8.194  -0.731  10.860
  344    H    ALA  45           HN       ALA  45   2.155  -6.422  11.652
  345    HA   ALA  45           HA       ALA  45   0.135  -6.986  13.709
  346   1HB   ALA  45          HB1       ALA  45  -1.408  -7.943  12.203
  347   2HB   ALA  45          HB2       ALA  45  -0.241  -7.970  10.882
  348   3HB   ALA  45          HB3       ALA  45  -0.934  -6.438  11.415
  349    H    ALA  46           HN       ALA  46  -0.177  -9.445  13.860
  350    HA   ALA  46           HA       ALA  46   2.354 -10.657  14.167
  351   1HB   ALA  46          HB1       ALA  46  -0.254 -12.166  13.897
  352   2HB   ALA  46          HB2       ALA  46   0.201 -11.306  15.369
  353   3HB   ALA  46          HB3       ALA  46   1.187 -12.650  14.791
  354    H    ALA  47           HN       ALA  47   0.214 -10.530  11.410
  355    HA   ALA  47           HA       ALA  47   2.232 -12.076   9.889
  356   1HB   ALA  47          HB1       ALA  47  -0.750 -12.572   9.822
  357   2HB   ALA  47          HB2       ALA  47   0.479 -13.662  10.465
  358   3HB   ALA  47          HB3       ALA  47   0.430 -13.310   8.738
  359    H    ASN  48           HN       ASN  48   2.288 -11.761   7.648
  360    HA   ASN  48           HA       ASN  48   1.650  -9.074   6.804
  361   1HB   ASN  48          HB2       ASN  48   2.721 -11.490   5.314
  362   2HB   ASN  48          HB1       ASN  48   2.536  -9.889   4.599
  363   1HD2  ASN  48          HD21      ASN  48   4.864 -11.817   5.923
  364   2HD2  ASN  48          HD22      ASN  48   5.878 -10.630   6.589
  365    H    ASN  49           HN       ASN  49  -0.267  -8.453   5.954
  366    HA   ASN  49           HA       ASN  49  -1.877 -10.296   4.357
  367   1HB   ASN  49          HB2       ASN  49  -2.811  -9.132   6.979
  368   2HB   ASN  49          HB1       ASN  49  -3.926  -9.669   5.727
  369   1HD2  ASN  49          HD21      ASN  49  -3.488 -10.863   8.442
  370   2HD2  ASN  49          HD22      ASN  49  -3.034 -12.473   8.159
  371    H    LEU  50           HN       LEU  50  -3.376  -9.216   3.023
  372    HA   LEU  50           HA       LEU  50  -3.267  -6.252   3.019
  373   1HB   LEU  50          HB2       LEU  50  -1.876  -7.235   1.184
  374   2HB   LEU  50          HB1       LEU  50  -3.292  -8.115   0.620
  375    HG   LEU  50           HG       LEU  50  -4.475  -5.951   0.262
  376   1HD1  LEU  50          HD11      LEU  50  -1.905  -4.864   1.368
  377   2HD1  LEU  50          HD12      LEU  50  -3.570  -4.390   1.711
  378   3HD1  LEU  50          HD13      LEU  50  -2.818  -3.915   0.192
  379   1HD2  LEU  50          HD21      LEU  50  -1.778  -5.949  -1.133
  380   2HD2  LEU  50          HD22      LEU  50  -3.312  -5.352  -1.764
  381   3HD2  LEU  50          HD23      LEU  50  -3.069  -7.082  -1.539
  382    H    SER  51           HN       SER  51  -5.349  -5.462   3.306
  383    HA   SER  51           HA       SER  51  -7.614  -7.189   2.447
  384   1HB   SER  51          HB2       SER  51  -8.752  -6.719   4.403
  385   2HB   SER  51          HB1       SER  51  -7.096  -6.722   5.006
  386    HG   SER  51           HG       SER  51  -7.330  -4.337   4.243
  387    H    VAL  52           HN       VAL  52  -9.009  -6.219   1.040
  388    HA   VAL  52           HA       VAL  52  -8.961  -3.278   0.800
  389    HB   VAL  52           HB       VAL  52  -9.312  -5.308  -1.429
  390   1HG1  VAL  52          HG11      VAL  52 -10.662  -3.383  -1.913
  391   2HG1  VAL  52          HG12      VAL  52  -9.180  -3.210  -2.854
  392   3HG1  VAL  52          HG13      VAL  52  -9.396  -2.283  -1.370
  393   1HG2  VAL  52          HG21      VAL  52  -7.180  -4.238  -2.262
  394   2HG2  VAL  52          HG22      VAL  52  -6.987  -5.179  -0.782
  395   3HG2  VAL  52          HG23      VAL  52  -7.056  -3.418  -0.706
  396    H    ILE  53           HN       ILE  53 -10.925  -2.375   1.217
  397    HA   ILE  53           HA       ILE  53 -13.344  -4.089   0.976
  398    HB   ILE  53           HB       ILE  53 -12.827  -1.836   2.948
  399   1HG1  ILE  53          HG12      ILE  53 -13.196  -3.942   4.560
  400   2HG1  ILE  53          HG11      ILE  53 -12.598  -4.844   3.173
  401   1HG2  ILE  53          HG21      ILE  53 -15.170  -3.704   2.501
  402   2HG2  ILE  53          HG22      ILE  53 -15.162  -1.945   2.369
  403   3HG2  ILE  53          HG23      ILE  53 -14.977  -2.711   3.945
  404   1HD1  ILE  53          HD11      ILE  53 -11.148  -2.484   4.410
  405   2HD1  ILE  53          HD12      ILE  53 -10.529  -3.570   3.168
  406   3HD1  ILE  53          HD13      ILE  53 -10.809  -4.168   4.800
  407    H    GLY  54           HN       GLY  54 -14.927  -3.361  -0.311
  408   1HA   GLY  54          HA2       GLY  54 -16.357  -1.737  -1.266
  409   2HA   GLY  54          HA1       GLY  54 -15.190  -0.491  -0.826
  410    H    ALA  55           HN       ALA  55 -13.854  -3.260  -2.408
  411    HA   ALA  55           HA       ALA  55 -13.777  -1.753  -4.970
  412   1HB   ALA  55          HB1       ALA  55 -11.629  -1.869  -3.482
  413   2HB   ALA  55          HB2       ALA  55 -11.496  -2.160  -5.216
  414   3HB   ALA  55          HB3       ALA  55 -11.509  -3.519  -4.092
  415    H    THR  56           HN       THR  56 -13.287  -3.011  -6.848
  416    HA   THR  56           HA       THR  56 -14.751  -5.581  -7.065
  417    HB   THR  56           HB       THR  56 -14.597  -5.151  -9.402
  418    HG1  THR  56           HG1      THR  56 -13.105  -2.826  -8.809
  419   1HG2  THR  56          HG21      THR  56 -15.743  -2.971  -9.559
  420   2HG2  THR  56          HG22      THR  56 -15.220  -2.581  -7.920
  421   3HG2  THR  56          HG23      THR  56 -16.344  -3.911  -8.195
  422    H    LYS  57           HN       LYS  57 -13.853  -7.312  -8.134
  423    HA   LYS  57           HA       LYS  57 -11.380  -8.155  -7.201
  424   1HB   LYS  57          HB2       LYS  57 -13.105  -9.730  -7.981
  425   2HB   LYS  57          HB1       LYS  57 -12.908  -9.160  -9.635
  426   1HG   LYS  57          HG2       LYS  57 -10.541  -9.965  -9.602
  427   2HG   LYS  57          HG1       LYS  57 -10.796 -10.603  -7.979
  428   1HD   LYS  57          HD2       LYS  57 -12.617 -11.402 -10.250
  429   2HD   LYS  57          HD1       LYS  57 -11.072 -12.211 -10.010
  430   1HE   LYS  57          HE2       LYS  57 -13.326 -12.019  -7.986
  431   2HE   LYS  57          HE1       LYS  57 -12.821 -13.461  -8.861
  432   1HZ   LYS  57          HZ1       LYS  57 -11.292 -11.956  -6.820
  433   2HZ   LYS  57          HZ2       LYS  57 -10.584 -13.131  -7.824
  434   3HZ   LYS  57          HZ3       LYS  57 -11.823 -13.566  -6.745
  435    H    GLU  58           HN       GLU  58 -12.114  -6.651 -10.398
  436    HA   GLU  58           HA       GLU  58  -9.486  -7.030 -11.429
  437   1HB   GLU  58          HB2       GLU  58 -11.456  -6.527 -12.846
  438   2HB   GLU  58          HB1       GLU  58 -11.565  -4.930 -12.108
  439   1HG   GLU  58          HG2       GLU  58  -9.297  -4.392 -12.938
  440   2HG   GLU  58          HG1       GLU  58  -9.191  -5.991 -13.671
  441    H    ASP  59           HN       ASP  59 -11.016  -4.477  -9.494
  442    HA   ASP  59           HA       ASP  59  -8.897  -2.615  -9.680
  443   1HB   ASP  59          HB2       ASP  59 -11.017  -3.045  -7.568
  444   2HB   ASP  59          HB1       ASP  59  -9.862  -1.713  -7.522
  445    H    LYS  60           HN       LYS  60  -9.697  -5.183  -7.410
  446    HA   LYS  60           HA       LYS  60  -7.506  -4.767  -5.653
  447   1HB   LYS  60          HB2       LYS  60  -9.475  -6.106  -4.986
  448   2HB   LYS  60          HB1       LYS  60  -9.057  -7.321  -6.191
  449   1HG   LYS  60          HG2       LYS  60  -6.907  -7.733  -5.034
  450   2HG   LYS  60          HG1       LYS  60  -7.327  -6.515  -3.829
  451   1HD   LYS  60          HD2       LYS  60  -9.203  -7.816  -3.061
  452   2HD   LYS  60          HD1       LYS  60  -9.035  -8.947  -4.405
  453   1HE   LYS  60          HE2       LYS  60  -8.074  -9.931  -2.382
  454   2HE   LYS  60          HE1       LYS  60  -6.791  -9.596  -3.545
  455   1HZ   LYS  60          HZ1       LYS  60  -6.864  -8.749  -0.959
  456   2HZ   LYS  60          HZ2       LYS  60  -7.336  -7.369  -1.830
  457   3HZ   LYS  60          HZ3       LYS  60  -5.858  -8.131  -2.176
  458    H    GLN  61           HN       GLN  61  -7.720  -6.767  -8.615
  459    HA   GLN  61           HA       GLN  61  -5.145  -7.925  -8.209
  460   1HB   GLN  61          HB2       GLN  61  -6.764  -7.403 -10.719
  461   2HB   GLN  61          HB1       GLN  61  -5.221  -8.263 -10.719
  462   1HG   GLN  61          HG2       GLN  61  -6.099  -9.994  -9.299
  463   2HG   GLN  61          HG1       GLN  61  -7.577  -9.081  -9.003
  464   1HE2  GLN  61          HE21      GLN  61  -7.908 -11.640 -10.005
  465   2HE2  GLN  61          HE22      GLN  61  -8.367 -11.582 -11.638
  466    H    ARG  62           HN       ARG  62  -6.305  -4.956  -9.842
  467    HA   ARG  62           HA       ARG  62  -3.797  -4.180 -10.820
  468   1HB   ARG  62          HB2       ARG  62  -5.895  -3.111 -11.569
  469   2HB   ARG  62          HB1       ARG  62  -6.127  -2.427  -9.961
  470   1HG   ARG  62          HG2       ARG  62  -4.123  -1.076 -10.179
  471   2HG   ARG  62          HG1       ARG  62  -3.706  -1.856 -11.706
  472   1HD   ARG  62          HD2       ARG  62  -4.746   0.313 -12.141
  473   2HD   ARG  62          HD1       ARG  62  -5.796  -0.983 -12.708
  474    HE   ARG  62           HE       ARG  62  -6.525  -0.352 -10.063
  475   1HH1  ARG  62          HH11      ARG  62  -7.605  -0.022 -13.177
  476   2HH1  ARG  62          HH12      ARG  62  -8.494   1.446 -12.936
  477   1HH2  ARG  62          HH21      ARG  62  -7.203   2.018  -9.768
  478   2HH2  ARG  62          HH22      ARG  62  -8.265   2.601 -11.006
  479    H    ILE  63           HN       ILE  63  -5.404  -3.511  -7.745
  480    HA   ILE  63           HA       ILE  63  -3.358  -1.868  -6.721
  481    HB   ILE  63           HB       ILE  63  -5.369  -3.577  -5.286
  482   1HG1  ILE  63          HG12      ILE  63  -5.226  -0.566  -5.489
  483   2HG1  ILE  63          HG11      ILE  63  -6.102  -1.547  -6.663
  484   1HG2  ILE  63          HG21      ILE  63  -4.766  -2.109  -3.295
  485   2HG2  ILE  63          HG22      ILE  63  -3.334  -1.624  -4.203
  486   3HG2  ILE  63          HG23      ILE  63  -3.555  -3.310  -3.738
  487   1HD1  ILE  63          HD11      ILE  63  -7.591  -2.390  -4.985
  488   2HD1  ILE  63          HD12      ILE  63  -7.500  -0.647  -4.732
  489   3HD1  ILE  63          HD13      ILE  63  -6.597  -1.739  -3.683
  490    H    SER  64           HN       SER  64  -3.757  -5.363  -6.559
  491    HA   SER  64           HA       SER  64  -1.472  -5.848  -4.942
  492   1HB   SER  64          HB2       SER  64  -3.167  -7.598  -5.528
  493   2HB   SER  64          HB1       SER  64  -2.551  -7.596  -7.177
  494    HG   SER  64           HG       SER  64  -0.447  -7.834  -5.682
  495    H    GLU  65           HN       GLU  65  -1.888  -5.489  -8.520
  496    HA   GLU  65           HA       GLU  65   0.807  -5.977  -9.148
  497   1HB   GLU  65          HB2       GLU  65  -1.303  -4.338 -10.582
  498   2HB   GLU  65          HB1       GLU  65   0.295  -4.675 -11.253
  499   1HG   GLU  65          HG2       GLU  65  -0.130  -7.097 -11.068
  500   2HG   GLU  65          HG1       GLU  65  -1.723  -6.767 -10.397
  501    H    ILE  66           HN       ILE  66  -0.895  -2.989  -8.310
  502    HA   ILE  66           HA       ILE  66   1.236  -1.206  -8.711
  503    HB   ILE  66           HB       ILE  66  -1.143  -1.148  -6.851
  504   1HG1  ILE  66          HG12      ILE  66  -0.457   0.417  -9.360
  505   2HG1  ILE  66          HG11      ILE  66  -1.492  -1.008  -9.325
  506   1HG2  ILE  66          HG21      ILE  66  -0.621   1.302  -6.586
  507   2HG2  ILE  66          HG22      ILE  66   0.960   0.987  -7.305
  508   3HG2  ILE  66          HG23      ILE  66   0.519   0.243  -5.769
  509   1HD1  ILE  66          HD11      ILE  66  -2.015   1.559  -7.791
  510   2HD1  ILE  66          HD12      ILE  66  -3.064   0.145  -7.830
  511   3HD1  ILE  66          HD13      ILE  66  -2.815   1.094  -9.292
  512    H    LEU  67           HN       LEU  67   0.250  -2.972  -5.811
  513    HA   LEU  67           HA       LEU  67   2.244  -1.958  -4.101
  514   1HB   LEU  67          HB2       LEU  67   0.395  -3.145  -3.119
  515   2HB   LEU  67          HB1       LEU  67   0.702  -4.567  -4.107
  516    HG   LEU  67           HG       LEU  67   2.893  -4.874  -2.904
  517   1HD1  LEU  67          HD11      LEU  67   1.874  -2.436  -1.438
  518   2HD1  LEU  67          HD12      LEU  67   3.503  -2.770  -2.032
  519   3HD1  LEU  67          HD13      LEU  67   2.901  -3.603  -0.604
  520   1HD2  LEU  67          HD21      LEU  67   0.313  -4.803  -1.320
  521   2HD2  LEU  67          HD22      LEU  67   1.793  -5.547  -0.714
  522   3HD2  LEU  67          HD23      LEU  67   1.020  -6.178  -2.169
  523    H    GLN  68           HN       GLN  68   2.234  -4.688  -6.339
  524    HA   GLN  68           HA       GLN  68   4.808  -5.648  -5.594
  525   1HB   GLN  68          HB2       GLN  68   3.167  -5.956  -8.107
  526   2HB   GLN  68          HB1       GLN  68   4.765  -6.682  -7.925
  527   1HG   GLN  68          HG2       GLN  68   4.037  -7.942  -5.988
  528   2HG   GLN  68          HG1       GLN  68   2.482  -7.114  -5.979
  529   1HE2  GLN  68          HE21      GLN  68   2.925  -7.409  -9.175
  530   2HE2  GLN  68          HE22      GLN  68   2.263  -8.948  -9.447
  531    H    GLU  69           HN       GLU  69   3.856  -3.485  -8.326
  532    HA   GLU  69           HA       GLU  69   6.462  -3.075  -9.238
  533   1HB   GLU  69          HB2       GLU  69   4.007  -1.324  -9.394
  534   2HB   GLU  69          HB1       GLU  69   5.512  -0.971 -10.243
  535   1HG   GLU  69          HG2       GLU  69   5.393  -3.157 -11.379
  536   2HG   GLU  69          HG1       GLU  69   3.888  -3.516 -10.534
  537    H    THR  70           HN       THR  70   4.642  -1.152  -6.836
  538    HA   THR  70           HA       THR  70   6.584   0.847  -6.486
  539    HB   THR  70           HB       THR  70   4.661  -0.272  -4.480
  540    HG1  THR  70           HG1      THR  70   4.235   1.000  -6.704
  541   1HG2  THR  70          HG21      THR  70   4.896   2.126  -3.566
  542   2HG2  THR  70          HG22      THR  70   6.374   2.200  -4.526
  543   3HG2  THR  70          HG23      THR  70   6.214   1.001  -3.242
  544    H    TRP  71           HN       TRP  71   6.021  -2.164  -4.821
  545    HA   TRP  71           HA       TRP  71   8.082  -2.071  -2.990
  546   1HB   TRP  71          HB2       TRP  71   6.121  -3.551  -2.956
  547   2HB   TRP  71          HB1       TRP  71   6.787  -4.431  -4.317
  548    HD1  TRP  71           HD1      TRP  71   7.483  -6.677  -3.424
  549    HE1  TRP  71           HE1      TRP  71   8.873  -7.554  -1.447
  550    HE3  TRP  71           HE3      TRP  71   8.291  -2.303  -0.832
  551    HZ2  TRP  71           HZ2      TRP  71  10.130  -6.573   0.908
  552    HZ3  TRP  71           HZ3      TRP  71   9.573  -2.334   1.271
  553    HH2  TRP  71           HH2      TRP  71  10.487  -4.458   2.153
  554    H    GLU  72           HN       GLU  72   8.068  -3.246  -6.298
  555    HA   GLU  72           HA       GLU  72  10.770  -4.185  -6.204
  556   1HB   GLU  72          HB2       GLU  72   8.900  -3.681  -8.525
  557   2HB   GLU  72          HB1       GLU  72  10.539  -4.300  -8.728
  558   1HG   GLU  72          HG2       GLU  72  10.006  -6.207  -7.260
  559   2HG   GLU  72          HG1       GLU  72   8.366  -5.592  -7.056
  560    H    SER  73           HN       SER  73   9.458  -1.011  -6.620
  561    HA   SER  73           HA       SER  73  12.013  -0.110  -7.836
  562   1HB   SER  73          HB2       SER  73  10.854   1.902  -8.495
  563   2HB   SER  73          HB1       SER  73   9.873   0.524  -8.986
  564    HG   SER  73           HG       SER  73   9.468   2.408  -6.962
  565    H    ALA  74           HN       ALA  74  11.384  -0.792  -4.928
  566    HA   ALA  74           HA       ALA  74  11.170   1.323  -3.282
  567   1HB   ALA  74          HB1       ALA  74  12.888  -1.121  -2.968
  568   2HB   ALA  74          HB2       ALA  74  11.190  -0.949  -2.525
  569   3HB   ALA  74          HB3       ALA  74  12.424  -0.036  -1.657
  570    H    ASP  75           HN       ASP  75  14.190   0.401  -4.917
  571    HA   ASP  75           HA       ASP  75  15.887   2.023  -3.315
  572   1HB   ASP  75          HB2       ASP  75  16.192   0.931  -6.111
  573   2HB   ASP  75          HB1       ASP  75  17.461   1.828  -5.280
  574    H    ASP  76           HN       ASP  76  13.678   2.859  -5.864
  575    HA   ASP  76           HA       ASP  76  15.053   5.398  -6.450
  576   1HB   ASP  76          HB2       ASP  76  12.613   4.047  -7.603
  577   2HB   ASP  76          HB1       ASP  76  13.147   5.659  -8.075
  578    H    TRP  77           HN       TRP  77  11.886   4.364  -5.109
  579    HA   TRP  77           HA       TRP  77  11.255   7.177  -4.555
  580   1HB   TRP  77          HB2       TRP  77   9.062   6.518  -4.159
  581   2HB   TRP  77          HB1       TRP  77   9.606   5.519  -5.487
  582    HD1  TRP  77           HD1      TRP  77   9.708   2.900  -5.113
  583    HE1  TRP  77           HE1      TRP  77   8.965   1.373  -3.197
  584    HE3  TRP  77           HE3      TRP  77   8.945   6.377  -1.331
  585    HZ2  TRP  77           HZ2      TRP  77   8.159   1.543  -0.486
  586    HZ3  TRP  77           HZ3      TRP  77   8.177   5.607   0.862
  587    HH2  TRP  77           HH2      TRP  77   7.784   3.217   1.291
  588    H    PHE  78           HN       PHE  78  12.535   4.523  -2.695
  589    HA   PHE  78           HA       PHE  78  11.658   5.774  -0.164
  590   1HB   PHE  78          HB2       PHE  78  11.558   3.382  -0.171
  591   2HB   PHE  78          HB1       PHE  78  13.223   3.262  -0.715
  592    HD1  PHE  78           HD1      PHE  78  15.110   3.681   0.788
  593    HD2  PHE  78           HD2      PHE  78  11.044   4.141   2.148
  594    HE1  PHE  78           HE1      PHE  78  15.903   3.821   3.123
  595    HE2  PHE  78           HE2      PHE  78  11.859   4.268   4.481
  596    HZ   PHE  78           HZ       PHE  78  14.278   4.107   4.973
  597    H    VAL  79           HN       VAL  79  12.807   7.147   0.943
  598    HA   VAL  79           HA       VAL  79  15.673   7.508   0.315
  599    HB   VAL  79           HB       VAL  79  15.079   9.969   1.010
  600   1HG1  VAL  79          HG11      VAL  79  15.748   9.292  -1.271
  601   2HG1  VAL  79          HG12      VAL  79  14.449  10.482  -1.328
  602   3HG1  VAL  79          HG13      VAL  79  14.093   8.777  -1.604
  603   1HG2  VAL  79          HG21      VAL  79  12.793  10.622   0.651
  604   2HG2  VAL  79          HG22      VAL  79  12.747   9.250   1.754
  605   3HG2  VAL  79          HG23      VAL  79  12.360   9.021   0.044
  606    H    SER  80           HN       SER  80  17.052   7.936   2.207
  607    HA   SER  80           HA       SER  80  15.680   7.907   4.838
  608   1HB   SER  80          HB2       SER  80  17.525   6.426   5.645
  609   2HB   SER  80          HB1       SER  80  16.524   5.641   4.425
  610    HG   SER  80           HG       SER  80  18.310   5.400   3.364
  611    H    GLU  81           HN       GLU  81  16.498   9.241   6.325
  612    HA   GLU  81           HA       GLU  81  18.129  11.409   5.563
  613   1HB   GLU  81          HB2       GLU  81  17.493  10.395   8.343
  614   2HB   GLU  81          HB1       GLU  81  18.148  11.987   7.958
  615   1HG   GLU  81          HG2       GLU  81  16.148  12.482   6.601
  616   2HG   GLU  81          HG1       GLU  81  15.492  10.893   6.989
  Start of MODEL   17
    1   1H    MET   1          HT1       MET   1 -14.261   3.817  -1.962
    2   2H    MET   1          HT2       MET   1 -12.992   4.702  -1.260
    3   3H    MET   1          HT3       MET   1 -14.261   4.118  -0.293
    4    HA   MET   1           HA       MET   1 -13.592   1.850  -0.673
    5   1HB   MET   1          HB2       MET   1 -11.406   3.108  -2.348
    6   2HB   MET   1          HB1       MET   1 -11.540   1.394  -1.964
    7   1HG   MET   1          HG2       MET   1 -13.898   1.566  -3.043
    8   2HG   MET   1          HG1       MET   1 -13.299   3.066  -3.747
    9   1HE   MET   1          HE1       MET   1 -10.025   1.887  -5.511
   10   2HE   MET   1          HE2       MET   1 -10.004   1.868  -3.750
   11   3HE   MET   1          HE3       MET   1 -10.826   3.177  -4.603
   12    H    ARG   2           HN       ARG   2 -12.241   0.964   0.875
   13    HA   ARG   2           HA       ARG   2 -10.288   2.788   2.167
   14   1HB   ARG   2          HB2       ARG   2 -12.161   0.786   3.463
   15   2HB   ARG   2          HB1       ARG   2 -10.788   1.507   4.301
   16   1HG   ARG   2          HG2       ARG   2 -11.713   3.763   3.852
   17   2HG   ARG   2          HG1       ARG   2 -13.100   3.023   3.052
   18   1HD   ARG   2          HD2       ARG   2 -13.689   1.855   5.142
   19   2HD   ARG   2          HD1       ARG   2 -12.303   2.586   5.944
   20    HE   ARG   2           HE       ARG   2 -14.009   4.577   4.793
   21   1HH1  ARG   2          HH11      ARG   2 -15.939   2.858   6.356
   22   2HH1  ARG   2          HH12      ARG   2 -15.888   3.588   7.925
   23   1HH2  ARG   2          HH21      ARG   2 -12.956   5.332   7.311
   24   2HH2  ARG   2          HH22      ARG   2 -14.200   4.988   8.466
   25    H    ILE   3           HN       ILE   3  -8.279   2.021   2.304
   26    HA   ILE   3           HA       ILE   3  -7.786  -0.830   1.589
   27    HB   ILE   3           HB       ILE   3  -6.081   1.599   1.033
   28   1HG1  ILE   3          HG12      ILE   3  -7.501  -0.234  -0.916
   29   2HG1  ILE   3          HG11      ILE   3  -8.236   1.254  -0.313
   30   1HG2  ILE   3          HG21      ILE   3  -4.876  -0.176  -0.408
   31   2HG2  ILE   3          HG22      ILE   3  -5.719  -1.369   0.580
   32   3HG2  ILE   3          HG23      ILE   3  -4.601  -0.231   1.332
   33   1HD1  ILE   3          HD11      ILE   3  -5.553   1.091  -1.712
   34   2HD1  ILE   3          HD12      ILE   3  -6.363   2.566  -1.185
   35   3HD1  ILE   3          HD13      ILE   3  -7.059   1.593  -2.482
   36    H    GLU   4           HN       GLU   4  -6.798  -1.981   3.167
   37    HA   GLU   4           HA       GLU   4  -5.132  -0.535   5.175
   38   1HB   GLU   4          HB2       GLU   4  -6.939  -2.917   5.671
   39   2HB   GLU   4          HB1       GLU   4  -5.885  -2.164   6.865
   40   1HG   GLU   4          HG2       GLU   4  -7.099  -0.033   6.590
   41   2HG   GLU   4          HG1       GLU   4  -8.155  -0.790   5.398
   42    H    VAL   5           HN       VAL   5  -3.133  -1.191   5.391
   43    HA   VAL   5           HA       VAL   5  -2.348  -3.838   4.278
   44    HB   VAL   5           HB       VAL   5  -0.776  -1.254   4.348
   45   1HG1  VAL   5          HG11      VAL   5   0.737  -2.648   2.794
   46   2HG1  VAL   5          HG12      VAL   5  -0.116  -4.054   3.430
   47   3HG1  VAL   5          HG13      VAL   5   0.803  -3.012   4.517
   48   1HG2  VAL   5          HG21      VAL   5  -2.621  -1.273   2.693
   49   2HG2  VAL   5          HG22      VAL   5  -2.000  -2.785   2.032
   50   3HG2  VAL   5          HG23      VAL   5  -1.045  -1.307   1.901
   51    H    THR   6           HN       THR   6  -1.220  -5.198   5.558
   52    HA   THR   6           HA       THR   6  -0.154  -4.147   8.125
   53    HB   THR   6           HB       THR   6  -0.691  -6.454   9.034
   54    HG1  THR   6           HG1      THR   6  -2.506  -6.551   6.885
   55   1HG2  THR   6          HG21      THR   6  -2.028  -4.500   9.626
   56   2HG2  THR   6          HG22      THR   6  -3.100  -5.877   9.361
   57   3HG2  THR   6          HG23      THR   6  -2.937  -4.634   8.120
   58    H    ILE   7           HN       ILE   7   1.832  -4.696   8.639
   59    HA   ILE   7           HA       ILE   7   3.352  -6.518   6.857
   60    HB   ILE   7           HB       ILE   7   4.022  -3.952   8.269
   61   1HG1  ILE   7          HG12      ILE   7   3.111  -4.200   5.809
   62   2HG1  ILE   7          HG11      ILE   7   4.444  -3.098   6.130
   63   1HG2  ILE   7          HG21      ILE   7   6.427  -4.500   7.297
   64   2HG2  ILE   7          HG22      ILE   7   5.884  -6.175   7.432
   65   3HG2  ILE   7          HG23      ILE   7   5.947  -5.150   8.866
   66   1HD1  ILE   7          HD11      ILE   7   4.587  -4.822   4.128
   67   2HD1  ILE   7          HD12      ILE   7   5.084  -5.940   5.396
   68   3HD1  ILE   7          HD13      ILE   7   6.012  -4.470   5.105
   69    H    ALA   8           HN       ALA   8   4.371  -8.233   7.812
   70    HA   ALA   8           HA       ALA   8   3.799  -8.934  10.482
   71   1HB   ALA   8          HB1       ALA   8   5.864  -9.962   8.528
   72   2HB   ALA   8          HB2       ALA   8   4.275 -10.652   8.861
   73   3HB   ALA   8          HB3       ALA   8   5.538 -10.716  10.090
   74    H    LYS   9           HN       LYS   9   4.722  -8.554  12.259
   75    HA   LYS   9           HA       LYS   9   6.644  -6.572  12.627
   76   1HB   LYS   9          HB2       LYS   9   4.962  -7.142  14.348
   77   2HB   LYS   9          HB1       LYS   9   5.704  -8.719  14.564
   78   1HG   LYS   9          HG2       LYS   9   7.780  -7.641  15.374
   79   2HG   LYS   9          HG1       LYS   9   7.042  -6.050  15.166
   80   1HD   LYS   9          HD2       LYS   9   5.339  -6.554  16.808
   81   2HD   LYS   9          HD1       LYS   9   5.888  -8.227  16.928
   82   1HE   LYS   9          HE2       LYS   9   8.036  -7.493  17.835
   83   2HE   LYS   9          HE1       LYS   9   7.570  -5.804  17.634
   84   1HZ   LYS   9          HZ1       LYS   9   6.397  -7.809  19.471
   85   2HZ   LYS   9          HZ2       LYS   9   5.623  -6.341  19.109
   86   3HZ   LYS   9          HZ3       LYS   9   7.143  -6.337  19.867
   87    H    THR  10           HN       THR  10   7.038  -9.982  12.153
   88    HA   THR  10           HA       THR  10   9.634 -10.314  13.246
   89    HB   THR  10           HB       THR  10   9.756 -12.217  11.594
   90    HG1  THR  10           HG1      THR  10   7.254 -12.331  10.889
   91   1HG2  THR  10          HG21      THR  10   8.061 -13.538  12.723
   92   2HG2  THR  10          HG22      THR  10   7.186 -12.084  13.197
   93   3HG2  THR  10          HG23      THR  10   8.772 -12.423  13.889
   94    H    SER  11           HN       SER  11   8.484  -8.455  10.668
   95    HA   SER  11           HA       SER  11  11.196  -8.261   9.460
   96   1HB   SER  11          HB2       SER  11   8.513  -7.863   8.116
   97   2HB   SER  11          HB1       SER  11  10.090  -7.672   7.355
   98    HG   SER  11           HG       SER  11   8.993  -9.773   7.103
   99    HA   PRO  12           HA       PRO  12  10.025  -4.076  11.146
  100   1HB   PRO  12          HB2       PRO  12  12.691  -3.838  12.226
  101   2HB   PRO  12          HB1       PRO  12  11.182  -4.036  13.136
  102   1HG   PRO  12          HG2       PRO  12  13.213  -5.922  12.992
  103   2HG   PRO  12          HG1       PRO  12  11.539  -6.257  13.459
  104   1HD   PRO  12          HD2       PRO  12  12.900  -6.758  10.836
  105   2HD   PRO  12          HD1       PRO  12  11.618  -7.681  11.642
  106    H    LEU  13           HN       LEU  13  10.101  -2.307  10.120
  107    HA   LEU  13           HA       LEU  13  12.219  -1.975   8.081
  108   1HB   LEU  13          HB2       LEU  13   9.610  -0.452   8.271
  109   2HB   LEU  13          HB1       LEU  13  10.705  -0.555   6.895
  110    HG   LEU  13           HG       LEU  13   8.973  -2.769   8.024
  111   1HD1  LEU  13          HD11      LEU  13   7.942  -2.757   5.819
  112   2HD1  LEU  13          HD12      LEU  13   9.096  -1.558   5.242
  113   3HD1  LEU  13          HD13      LEU  13   7.904  -1.118   6.466
  114   1HD2  LEU  13          HD21      LEU  13   9.995  -4.035   5.977
  115   2HD2  LEU  13          HD22      LEU  13  10.944  -3.930   7.455
  116   3HD2  LEU  13          HD23      LEU  13  11.302  -2.859   6.103
  117    HA   PRO  14           HA       PRO  14  14.120   1.105  10.537
  118   1HB   PRO  14          HB2       PRO  14  14.253   3.212   8.530
  119   2HB   PRO  14          HB1       PRO  14  15.557   2.142   9.071
  120   1HG   PRO  14          HG2       PRO  14  13.904   1.972   6.659
  121   2HG   PRO  14          HG1       PRO  14  15.439   1.169   7.023
  122   1HD   PRO  14          HD2       PRO  14  13.000  -0.136   6.900
  123   2HD   PRO  14          HD1       PRO  14  14.396  -0.731   7.823
  124    H    ALA  15           HN       ALA  15  13.710   2.824  11.762
  125    HA   ALA  15           HA       ALA  15  11.105   3.437  12.466
  126   1HB   ALA  15          HB1       ALA  15  12.954   3.695  13.978
  127   2HB   ALA  15          HB2       ALA  15  12.119   5.242  13.824
  128   3HB   ALA  15          HB3       ALA  15  13.644   4.973  12.978
  129    H    GLY  16           HN       GLY  16  10.966   3.976   9.741
  130   1HA   GLY  16          HA2       GLY  16   9.855   6.606   9.691
  131   2HA   GLY  16          HA1       GLY  16  11.398   6.600   8.890
  132    H    ALA  17           HN       ALA  17  10.815   3.661   8.268
  133    HA   ALA  17           HA       ALA  17   9.961   4.144   5.594
  134   1HB   ALA  17          HB1       ALA  17  11.524   2.432   5.710
  135   2HB   ALA  17          HB2       ALA  17  10.026   1.506   5.599
  136   3HB   ALA  17          HB3       ALA  17  10.804   1.749   7.166
  137    H    ILE  18           HN       ILE  18   8.155   2.703   8.277
  138    HA   ILE  18           HA       ILE  18   6.040   1.784   6.670
  139    HB   ILE  18           HB       ILE  18   6.108   2.746   9.533
  140   1HG1  ILE  18          HG12      ILE  18   7.297   0.573   8.651
  141   2HG1  ILE  18          HG11      ILE  18   6.336   0.493  10.120
  142   1HG2  ILE  18          HG21      ILE  18   3.812   1.687   7.892
  143   2HG2  ILE  18          HG22      ILE  18   3.842   3.059   9.000
  144   3HG2  ILE  18          HG23      ILE  18   3.874   1.413   9.633
  145   1HD1  ILE  18          HD11      ILE  18   4.633  -0.710   9.112
  146   2HD1  ILE  18          HD12      ILE  18   6.018  -1.306   8.199
  147   3HD1  ILE  18          HD13      ILE  18   4.975  -0.068   7.507
  148    H    ASP  19           HN       ASP  19   6.483   4.891   8.355
  149    HA   ASP  19           HA       ASP  19   4.081   6.068   7.376
  150   1HB   ASP  19          HB2       ASP  19   5.446   7.012   9.287
  151   2HB   ASP  19          HB1       ASP  19   6.658   7.506   8.105
  152    H    ALA  20           HN       ALA  20   7.327   5.819   5.997
  153    HA   ALA  20           HA       ALA  20   6.738   7.555   3.850
  154   1HB   ALA  20          HB1       ALA  20   8.811   6.947   2.950
  155   2HB   ALA  20          HB2       ALA  20   8.712   5.302   3.578
  156   3HB   ALA  20          HB3       ALA  20   9.043   6.641   4.672
  157    H    LEU  21           HN       LEU  21   6.436   4.045   4.234
  158    HA   LEU  21           HA       LEU  21   5.732   3.397   1.617
  159   1HB   LEU  21          HB2       LEU  21   6.404   1.689   3.164
  160   2HB   LEU  21          HB1       LEU  21   5.127   2.125   4.292
  161    HG   LEU  21           HG       LEU  21   3.446   1.395   2.647
  162   1HD1  LEU  21          HD11      LEU  21   4.329  -0.023   0.711
  163   2HD1  LEU  21          HD12      LEU  21   5.900   0.704   1.023
  164   3HD1  LEU  21          HD13      LEU  21   4.541   1.717   0.539
  165   1HD2  LEU  21          HD21      LEU  21   5.519  -0.761   3.078
  166   2HD2  LEU  21          HD22      LEU  21   3.771  -0.964   2.959
  167   3HD2  LEU  21          HD23      LEU  21   4.471  -0.157   4.361
  168    H    ALA  22           HN       ALA  22   3.714   4.205   4.419
  169    HA   ALA  22           HA       ALA  22   1.201   3.946   3.125
  170   1HB   ALA  22          HB1       ALA  22   0.283   5.084   4.997
  171   2HB   ALA  22          HB2       ALA  22   1.797   5.927   5.328
  172   3HB   ALA  22          HB3       ALA  22   1.660   4.199   5.652
  173    H    GLY  23           HN       GLY  23   3.445   6.683   3.318
  174   1HA   GLY  23          HA2       GLY  23   1.668   8.534   2.053
  175   2HA   GLY  23          HA1       GLY  23   3.431   8.677   2.258
  176    H    GLU  24           HN       GLU  24   4.316   6.486   0.733
  177    HA   GLU  24           HA       GLU  24   3.999   7.517  -1.876
  178   1HB   GLU  24          HB2       GLU  24   6.008   6.212  -1.076
  179   2HB   GLU  24          HB1       GLU  24   5.020   4.755  -1.077
  180   1HG   GLU  24          HG2       GLU  24   6.229   4.784  -3.152
  181   2HG   GLU  24          HG1       GLU  24   4.558   5.187  -3.533
  182    H    LEU  25           HN       LEU  25   2.478   4.799  -0.213
  183    HA   LEU  25           HA       LEU  25   1.137   3.792  -2.480
  184   1HB   LEU  25          HB2       LEU  25   0.535   3.526   0.454
  185   2HB   LEU  25          HB1       LEU  25  -0.424   2.723  -0.786
  186    HG   LEU  25           HG       LEU  25   2.580   2.421  -0.501
  187   1HD1  LEU  25          HD11      LEU  25   0.317   0.631   0.434
  188   2HD1  LEU  25          HD12      LEU  25   1.442   1.511   1.465
  189   3HD1  LEU  25          HD13      LEU  25   2.023   0.187   0.455
  190   1HD2  LEU  25          HD21      LEU  25   1.800   0.221  -1.854
  191   2HD2  LEU  25          HD22      LEU  25   2.186   1.723  -2.684
  192   3HD2  LEU  25          HD23      LEU  25   0.503   1.302  -2.368
  193    H    SER  26           HN       SER  26   0.047   6.153  -0.057
  194    HA   SER  26           HA       SER  26  -2.624   6.347  -0.935
  195   1HB   SER  26          HB2       SER  26  -2.701   8.445   0.262
  196   2HB   SER  26          HB1       SER  26  -1.729   7.306   1.189
  197    HG   SER  26           HG       SER  26   0.120   8.276   0.119
  198    H    ARG  27           HN       ARG  27   0.243   8.229  -1.907
  199    HA   ARG  27           HA       ARG  27  -1.107   9.971  -3.678
  200   1HB   ARG  27          HB2       ARG  27   1.223  10.324  -2.912
  201   2HB   ARG  27          HB1       ARG  27   1.728   8.901  -3.820
  202   1HG   ARG  27          HG2       ARG  27   1.128   9.937  -5.914
  203   2HG   ARG  27          HG1       ARG  27   0.377  11.300  -5.081
  204   1HD   ARG  27          HD2       ARG  27   2.577  11.995  -5.819
  205   2HD   ARG  27          HD1       ARG  27   2.610  11.828  -4.066
  206    HE   ARG  27           HE       ARG  27   4.084  10.039  -4.305
  207   1HH1  ARG  27          HH21      ARG  27   2.406   8.621  -6.458
  208   2HH1  ARG  27          HH22      ARG  27   3.525   8.581  -7.780
  209   1HH2  ARG  27          HH11      ARG  27   5.646  10.951  -6.401
  210   2HH2  ARG  27          HH12      ARG  27   5.358   9.900  -7.747
  211    H    ARG  28           HN       ARG  28   0.317   6.762  -4.177
  212    HA   ARG  28           HA       ARG  28  -0.106   6.689  -6.958
  213   1HB   ARG  28          HB2       ARG  28   1.411   5.150  -5.836
  214   2HB   ARG  28          HB1       ARG  28   0.060   4.412  -4.981
  215   1HG   ARG  28          HG2       ARG  28   0.746   3.082  -6.925
  216   2HG   ARG  28          HG1       ARG  28  -0.906   3.661  -7.109
  217   1HD   ARG  28          HD2       ARG  28  -0.255   5.292  -8.704
  218   2HD   ARG  28          HD1       ARG  28   1.447   5.168  -8.259
  219    HE   ARG  28           HE       ARG  28   0.602   2.663  -9.208
  220   1HH1  ARG  28          HH11      ARG  28  -0.642   5.051 -10.940
  221   2HH1  ARG  28          HH12      ARG  28   0.442   4.994 -12.290
  222   1HH2  ARG  28          HH21      ARG  28   2.751   2.963 -10.689
  223   2HH2  ARG  28          HH22      ARG  28   2.363   3.812 -12.148
  224    H    ILE  29           HN       ILE  29  -2.134   5.728  -4.238
  225    HA   ILE  29           HA       ILE  29  -4.199   4.494  -5.754
  226    HB   ILE  29           HB       ILE  29  -4.168   5.690  -2.981
  227   1HG1  ILE  29          HG12      ILE  29  -2.844   3.637  -3.290
  228   2HG1  ILE  29          HG11      ILE  29  -4.249   3.319  -2.286
  229   1HG2  ILE  29          HG21      ILE  29  -6.345   4.430  -2.672
  230   2HG2  ILE  29          HG22      ILE  29  -6.415   4.257  -4.424
  231   3HG2  ILE  29          HG23      ILE  29  -6.463   5.861  -3.693
  232   1HD1  ILE  29          HD11      ILE  29  -5.301   2.699  -4.709
  233   2HD1  ILE  29          HD12      ILE  29  -4.447   1.528  -3.712
  234   3HD1  ILE  29          HD13      ILE  29  -3.604   2.342  -5.024
  235    H    GLN  30           HN       GLN  30  -3.808   7.784  -4.543
  236    HA   GLN  30           HA       GLN  30  -6.341   8.763  -5.468
  237   1HB   GLN  30          HB2       GLN  30  -3.725  10.196  -4.927
  238   2HB   GLN  30          HB1       GLN  30  -5.201  11.023  -5.412
  239   1HG   GLN  30          HG2       GLN  30  -6.352  10.271  -3.408
  240   2HG   GLN  30          HG1       GLN  30  -4.985   9.264  -2.941
  241   1HE2  GLN  30          HE21      GLN  30  -5.899  11.284  -1.178
  242   2HE2  GLN  30          HE22      GLN  30  -4.734  12.516  -1.104
  243    H    TYR  31           HN       TYR  31  -3.165   8.552  -7.101
  244    HA   TYR  31           HA       TYR  31  -4.073   9.959  -9.380
  245   1HB   TYR  31          HB2       TYR  31  -1.671   9.640  -8.910
  246   2HB   TYR  31          HB1       TYR  31  -1.857   7.900  -9.136
  247    HD1  TYR  31           HD1      TYR  31  -2.163  11.193 -10.844
  248    HD2  TYR  31           HD2      TYR  31  -1.875   6.932 -11.314
  249    HE1  TYR  31           HE1      TYR  31  -1.868  11.483 -13.288
  250    HE2  TYR  31           HE2      TYR  31  -1.578   7.223 -13.759
  251    HH   TYR  31           HH       TYR  31  -1.311   8.681 -15.417
  252    H    ALA  32           HN       ALA  32  -4.082   6.531  -8.510
  253    HA   ALA  32           HA       ALA  32  -5.008   5.608 -11.038
  254   1HB   ALA  32          HB1       ALA  32  -5.370   4.260  -8.361
  255   2HB   ALA  32          HB2       ALA  32  -3.876   4.207  -9.295
  256   3HB   ALA  32          HB3       ALA  32  -5.351   3.499  -9.952
  257    H    PHE  33           HN       PHE  33  -6.603   6.621  -8.070
  258    HA   PHE  33           HA       PHE  33  -9.263   6.310  -9.370
  259   1HB   PHE  33          HB2       PHE  33  -8.501   6.097  -6.457
  260   2HB   PHE  33          HB1       PHE  33 -10.150   6.080  -7.075
  261    HD1  PHE  33           HD1      PHE  33 -10.903   4.250  -8.604
  262    HD2  PHE  33           HD2      PHE  33  -7.077   4.172  -6.654
  263    HE1  PHE  33           HE1      PHE  33 -10.704   1.826  -9.091
  264    HE2  PHE  33           HE2      PHE  33  -6.878   1.748  -7.138
  265    HZ   PHE  33           HZ       PHE  33  -8.691   0.576  -8.358
  266    HA   PRO  34           HA       PRO  34  -8.671  10.816  -8.555
  267   1HB   PRO  34          HB2       PRO  34 -10.220  11.373 -10.939
  268   2HB   PRO  34          HB1       PRO  34  -8.501  11.672 -10.641
  269   1HG   PRO  34          HG2       PRO  34  -9.529   9.783 -12.401
  270   2HG   PRO  34          HG1       PRO  34  -7.877   9.810 -11.764
  271   1HD   PRO  34          HD2       PRO  34 -10.170   8.076 -10.970
  272   2HD   PRO  34          HD1       PRO  34  -8.422   7.754 -10.901
  273    H    ASP  35           HN       ASP  35 -11.511   8.963  -9.368
  274    HA   ASP  35           HA       ASP  35 -13.383  10.999  -8.424
  275   1HB   ASP  35          HB2       ASP  35 -15.102   9.486  -9.270
  276   2HB   ASP  35          HB1       ASP  35 -13.865   9.802 -10.487
  277    H    ASN  36           HN       ASN  36 -11.758   8.360  -6.897
  278    HA   ASN  36           HA       ASN  36 -13.997   8.135  -4.947
  279   1HB   ASN  36          HB2       ASN  36 -13.684   6.107  -6.262
  280   2HB   ASN  36          HB1       ASN  36 -12.013   6.009  -5.709
  281   1HD2  ASN  36          HD21      ASN  36 -15.388   5.689  -4.669
  282   2HD2  ASN  36          HD22      ASN  36 -15.034   4.947  -3.183
  283    H    GLU  37           HN       GLU  37 -13.407   8.693  -2.755
  284    HA   GLU  37           HA       GLU  37 -10.861   9.602  -2.058
  285   1HB   GLU  37          HB2       GLU  37 -13.208   8.556  -0.502
  286   2HB   GLU  37          HB1       GLU  37 -11.782   9.274   0.242
  287   1HG   GLU  37          HG2       GLU  37 -13.434  10.672  -1.878
  288   2HG   GLU  37          HG1       GLU  37 -13.692  10.886  -0.149
  289    H    GLY  38           HN       GLY  38  -9.063   8.361  -1.683
  290   1HA   GLY  38          HA2       GLY  38  -9.387   5.466  -0.986
  291   2HA   GLY  38          HA1       GLY  38  -8.039   6.013  -1.734
  292    H    HIS  39           HN       HIS  39  -8.864   4.963   1.262
  293    HA   HIS  39           HA       HIS  39  -7.001   6.839   2.581
  294   1HB   HIS  39          HB2       HIS  39  -9.358   6.738   3.488
  295   2HB   HIS  39          HB1       HIS  39  -9.062   5.050   3.903
  296    HD1  HIS  39           HD1      HIS  39  -7.155   4.592   5.700
  297    HD2  HIS  39           HD2      HIS  39  -8.220   8.597   5.251
  298    HE1  HIS  39           HE1      HIS  39  -6.208   5.815   7.706
  299    H    VAL  40           HN       VAL  40  -5.042   5.874   3.052
  300    HA   VAL  40           HA       VAL  40  -4.903   2.939   3.048
  301    HB   VAL  40           HB       VAL  40  -2.816   5.006   2.358
  302   1HG1  VAL  40          HG11      VAL  40  -1.691   2.841   1.461
  303   2HG1  VAL  40          HG12      VAL  40  -2.775   1.996   2.564
  304   3HG1  VAL  40          HG13      VAL  40  -1.610   3.162   3.192
  305   1HG2  VAL  40          HG21      VAL  40  -4.770   4.660   0.753
  306   2HG2  VAL  40          HG22      VAL  40  -4.232   2.989   0.588
  307   3HG2  VAL  40          HG23      VAL  40  -3.179   4.305   0.076
  308    H    SER  41           HN       SER  41  -4.237   1.944   4.824
  309    HA   SER  41           HA       SER  41  -2.786   3.484   6.906
  310   1HB   SER  41          HB2       SER  41  -5.069   3.159   7.714
  311   2HB   SER  41          HB1       SER  41  -4.979   1.435   7.363
  312    HG   SER  41           HG       SER  41  -2.888   1.982   8.833
  313    H    VAL  42           HN       VAL  42  -1.098   2.516   7.901
  314    HA   VAL  42           HA       VAL  42  -0.505  -0.278   7.156
  315    HB   VAL  42           HB       VAL  42   1.561   1.940   7.248
  316   1HG1  VAL  42          HG11      VAL  42   1.699  -0.957   6.363
  317   2HG1  VAL  42          HG12      VAL  42   2.427  -0.278   7.820
  318   3HG1  VAL  42          HG13      VAL  42   3.017   0.208   6.231
  319   1HG2  VAL  42          HG21      VAL  42  -0.145   1.975   5.287
  320   2HG2  VAL  42          HG22      VAL  42   0.654   0.500   4.752
  321   3HG2  VAL  42          HG23      VAL  42   1.569   1.996   4.882
  322    H    ARG  43           HN       ARG  43  -0.055  -1.549   8.824
  323    HA   ARG  43           HA       ARG  43   1.138  -0.394  11.235
  324   1HB   ARG  43          HB2       ARG  43  -1.392  -2.050  11.435
  325   2HB   ARG  43          HB1       ARG  43  -0.559  -1.199  12.734
  326   1HG   ARG  43          HG2       ARG  43  -1.013   0.956  11.492
  327   2HG   ARG  43          HG1       ARG  43  -2.029   0.026  10.390
  328   1HD   ARG  43          HD2       ARG  43  -3.300  -0.783  12.440
  329   2HD   ARG  43          HD1       ARG  43  -2.419   0.431  13.362
  330    HE   ARG  43           HE       ARG  43  -3.754   1.474  11.011
  331   1HH1  ARG  43          HH21      ARG  43  -4.830   0.074  13.898
  332   2HH1  ARG  43          HH22      ARG  43  -5.759   1.440  14.417
  333   1HH2  ARG  43          HH11      ARG  43  -4.608   3.519  11.892
  334   2HH2  ARG  43          HH12      ARG  43  -5.634   3.390  13.281
  335    H    TYR  44           HN       TYR  44   1.876  -2.054  12.769
  336    HA   TYR  44           HA       TYR  44   2.859  -4.446  11.384
  337   1HB   TYR  44          HB2       TYR  44   3.272  -3.391  14.201
  338   2HB   TYR  44          HB1       TYR  44   3.962  -4.894  13.609
  339    HD1  TYR  44           HD1      TYR  44   5.252  -4.652  11.268
  340    HD2  TYR  44           HD2      TYR  44   4.607  -1.478  14.092
  341    HE1  TYR  44           HE1      TYR  44   7.197  -3.430  10.342
  342    HE2  TYR  44           HE2      TYR  44   6.549  -0.255  13.166
  343    HH   TYR  44           HH       TYR  44   8.016  -1.098  10.218
  344    H    ALA  45           HN       ALA  45   2.255  -6.499  11.721
  345    HA   ALA  45           HA       ALA  45   0.229  -7.082  13.764
  346   1HB   ALA  45          HB1       ALA  45  -0.138  -8.044  10.929
  347   2HB   ALA  45          HB2       ALA  45  -0.816  -6.507  11.463
  348   3HB   ALA  45          HB3       ALA  45  -1.313  -8.009  12.243
  349    H    ALA  46           HN       ALA  46  -0.100  -9.527  13.890
  350    HA   ALA  46           HA       ALA  46   2.417 -10.766  14.193
  351   1HB   ALA  46          HB1       ALA  46   1.251 -12.683  14.907
  352   2HB   ALA  46          HB2       ALA  46  -0.121 -12.357  13.848
  353   3HB   ALA  46          HB3       ALA  46   0.129 -11.380  15.294
  354    H    ALA  47           HN       ALA  47   0.271 -10.568  11.433
  355    HA   ALA  47           HA       ALA  47   2.293 -12.072   9.888
  356   1HB   ALA  47          HB1       ALA  47   0.477 -13.265   8.691
  357   2HB   ALA  47          HB2       ALA  47  -0.692 -12.561   9.807
  358   3HB   ALA  47          HB3       ALA  47   0.537 -13.675  10.405
  359    H    ASN  48           HN       ASN  48   2.391 -11.641   7.660
  360    HA   ASN  48           HA       ASN  48   1.726  -8.938   6.890
  361   1HB   ASN  48          HB2       ASN  48   3.734 -10.110   6.021
  362   2HB   ASN  48          HB1       ASN  48   2.690 -11.278   5.215
  363   1HD2  ASN  48          HD21      ASN  48   3.516  -7.790   5.276
  364   2HD2  ASN  48          HD22      ASN  48   3.018  -7.489   3.681
  365    H    ASN  49           HN       ASN  49  -0.205  -8.291   6.041
  366    HA   ASN  49           HA       ASN  49  -1.807 -10.129   4.432
  367   1HB   ASN  49          HB2       ASN  49  -2.763  -9.013   7.070
  368   2HB   ASN  49          HB1       ASN  49  -3.849  -9.618   5.824
  369   1HD2  ASN  49          HD21      ASN  49  -3.047 -10.704   8.619
  370   2HD2  ASN  49          HD22      ASN  49  -2.626 -12.318   8.308
  371    H    LEU  50           HN       LEU  50  -3.340  -9.060   3.132
  372    HA   LEU  50           HA       LEU  50  -3.280  -6.093   3.154
  373   1HB   LEU  50          HB2       LEU  50  -1.866  -6.995   1.331
  374   2HB   LEU  50          HB1       LEU  50  -3.232  -7.931   0.737
  375    HG   LEU  50           HG       LEU  50  -3.779  -5.013   1.106
  376   1HD1  LEU  50          HD11      LEU  50  -1.841  -6.004  -1.008
  377   2HD1  LEU  50          HD12      LEU  50  -1.552  -4.761   0.211
  378   3HD1  LEU  50          HD13      LEU  50  -2.692  -4.463  -1.101
  379   1HD2  LEU  50          HD21      LEU  50  -5.448  -6.478   0.081
  380   2HD2  LEU  50          HD22      LEU  50  -4.286  -6.996  -1.143
  381   3HD2  LEU  50          HD23      LEU  50  -4.859  -5.330  -1.122
  382    H    SER  51           HN       SER  51  -5.361  -5.324   3.408
  383    HA   SER  51           HA       SER  51  -7.608  -7.059   2.525
  384   1HB   SER  51          HB2       SER  51  -8.837  -5.853   4.438
  385   2HB   SER  51          HB1       SER  51  -7.689  -7.117   4.870
  386    HG   SER  51           HG       SER  51  -6.867  -5.576   6.051
  387    H    VAL  52           HN       VAL  52  -9.014  -6.069   1.131
  388    HA   VAL  52           HA       VAL  52  -8.974  -3.123   0.942
  389    HB   VAL  52           HB       VAL  52  -9.370  -5.084  -1.336
  390   1HG1  VAL  52          HG11      VAL  52 -10.785  -3.170  -1.690
  391   2HG1  VAL  52          HG12      VAL  52  -9.348  -2.921  -2.682
  392   3HG1  VAL  52          HG13      VAL  52  -9.525  -2.061  -1.152
  393   1HG2  VAL  52          HG21      VAL  52  -7.000  -4.691  -0.488
  394   2HG2  VAL  52          HG22      VAL  52  -7.205  -3.003  -0.960
  395   3HG2  VAL  52          HG23      VAL  52  -7.279  -4.276  -2.182
  396    H    ILE  53           HN       ILE  53 -10.888  -2.203   1.404
  397    HA   ILE  53           HA       ILE  53 -13.312  -3.906   1.303
  398    HB   ILE  53           HB       ILE  53 -12.756  -1.397   2.919
  399   1HG1  ILE  53          HG12      ILE  53 -12.897  -3.000   4.871
  400   2HG1  ILE  53          HG11      ILE  53 -12.838  -4.329   3.721
  401   1HG2  ILE  53          HG21      ILE  53 -14.888  -2.143   4.077
  402   2HG2  ILE  53          HG22      ILE  53 -15.117  -3.276   2.744
  403   3HG2  ILE  53          HG23      ILE  53 -15.092  -1.540   2.433
  404   1HD1  ILE  53          HD11      ILE  53 -10.631  -3.258   4.892
  405   2HD1  ILE  53          HD12      ILE  53 -10.684  -2.289   3.423
  406   3HD1  ILE  53          HD13      ILE  53 -10.601  -4.047   3.320
  407    H    GLY  54           HN       GLY  54 -14.815  -3.362  -0.158
  408   1HA   GLY  54          HA2       GLY  54 -16.181  -1.930  -1.419
  409   2HA   GLY  54          HA1       GLY  54 -15.109  -0.586  -1.016
  410    H    ALA  55           HN       ALA  55 -15.098  -3.590  -3.048
  411    HA   ALA  55           HA       ALA  55 -14.198  -2.098  -5.241
  412   1HB   ALA  55          HB1       ALA  55 -11.855  -3.248  -5.370
  413   2HB   ALA  55          HB2       ALA  55 -12.051  -3.477  -3.633
  414   3HB   ALA  55          HB3       ALA  55 -12.046  -1.850  -4.313
  415    H    THR  56           HN       THR  56 -13.607  -3.325  -7.098
  416    HA   THR  56           HA       THR  56 -15.053  -5.896  -7.373
  417    HB   THR  56           HB       THR  56 -14.887  -5.381  -9.716
  418    HG1  THR  56           HG1      THR  56 -12.983  -3.650  -8.774
  419   1HG2  THR  56          HG21      THR  56 -16.632  -4.254  -8.213
  420   2HG2  THR  56          HG22      THR  56 -16.341  -3.496  -9.779
  421   3HG2  THR  56          HG23      THR  56 -15.630  -2.806  -8.321
  422    H    LYS  57           HN       LYS  57 -14.100  -7.586  -8.489
  423    HA   LYS  57           HA       LYS  57 -11.610  -8.383  -7.547
  424   1HB   LYS  57          HB2       LYS  57 -13.317  -9.971  -8.406
  425   2HB   LYS  57          HB1       LYS  57 -13.032  -9.388 -10.044
  426   1HG   LYS  57          HG2       LYS  57 -10.617 -10.137  -9.796
  427   2HG   LYS  57          HG1       LYS  57 -11.077 -10.891  -8.267
  428   1HD   LYS  57          HD2       LYS  57 -12.295 -11.499 -10.973
  429   2HD   LYS  57          HD1       LYS  57 -11.150 -12.519 -10.105
  430   1HE   LYS  57          HE2       LYS  57 -12.920 -12.383  -8.159
  431   2HE   LYS  57          HE1       LYS  57 -14.028 -11.938  -9.459
  432   1HZ   LYS  57          HZ1       LYS  57 -13.804 -14.385  -8.918
  433   2HZ   LYS  57          HZ2       LYS  57 -12.273 -14.307  -9.650
  434   3HZ   LYS  57          HZ3       LYS  57 -13.668 -13.950 -10.552
  435    H    GLU  58           HN       GLU  58 -12.330  -6.805 -10.705
  436    HA   GLU  58           HA       GLU  58  -9.674  -7.151 -11.694
  437   1HB   GLU  58          HB2       GLU  58 -11.934  -5.299 -12.440
  438   2HB   GLU  58          HB1       GLU  58 -10.360  -5.239 -13.233
  439   1HG   GLU  58          HG2       GLU  58 -10.576  -7.619 -13.857
  440   2HG   GLU  58          HG1       GLU  58 -12.148  -7.696 -13.073
  441    H    ASP  59           HN       ASP  59 -11.261  -4.678  -9.741
  442    HA   ASP  59           HA       ASP  59  -9.184  -2.753  -9.864
  443   1HB   ASP  59          HB2       ASP  59 -11.340  -3.295  -7.807
  444   2HB   ASP  59          HB1       ASP  59 -10.234  -1.926  -7.704
  445    H    LYS  60           HN       LYS  60  -9.980  -5.365  -7.619
  446    HA   LYS  60           HA       LYS  60  -7.805  -4.942  -5.833
  447   1HB   LYS  60          HB2       LYS  60  -9.407  -7.446  -6.429
  448   2HB   LYS  60          HB1       LYS  60  -8.175  -7.352  -5.170
  449   1HG   LYS  60          HG2       LYS  60  -9.405  -5.511  -4.094
  450   2HG   LYS  60          HG1       LYS  60 -10.642  -5.602  -5.350
  451   1HD   LYS  60          HD2       LYS  60 -11.088  -7.960  -4.712
  452   2HD   LYS  60          HD1       LYS  60  -9.904  -7.815  -3.412
  453   1HE   LYS  60          HE2       LYS  60 -11.994  -7.401  -2.369
  454   2HE   LYS  60          HE1       LYS  60 -11.294  -5.800  -2.611
  455   1HZ   LYS  60          HZ1       LYS  60 -12.537  -5.856  -4.822
  456   2HZ   LYS  60          HZ2       LYS  60 -13.444  -5.597  -3.408
  457   3HZ   LYS  60          HZ3       LYS  60 -13.433  -7.127  -4.146
  458    H    GLN  61           HN       GLN  61  -7.955  -6.893  -8.824
  459    HA   GLN  61           HA       GLN  61  -5.372  -8.030  -8.423
  460   1HB   GLN  61          HB2       GLN  61  -6.964  -8.912 -10.107
  461   2HB   GLN  61          HB1       GLN  61  -6.820  -7.408 -11.017
  462   1HG   GLN  61          HG2       GLN  61  -4.461  -7.799 -11.404
  463   2HG   GLN  61          HG1       GLN  61  -4.479  -9.207 -10.345
  464   1HE2  GLN  61          HE21      GLN  61  -3.611  -9.603 -12.960
  465   2HE2  GLN  61          HE22      GLN  61  -4.787 -10.455 -13.838
  466    H    ARG  62           HN       ARG  62  -6.533  -5.039 -10.025
  467    HA   ARG  62           HA       ARG  62  -4.022  -4.244 -10.982
  468   1HB   ARG  62          HB2       ARG  62  -6.115  -3.173 -11.738
  469   2HB   ARG  62          HB1       ARG  62  -6.359  -2.500 -10.128
  470   1HG   ARG  62          HG2       ARG  62  -4.262  -1.215 -10.333
  471   2HG   ARG  62          HG1       ARG  62  -3.992  -1.900 -11.936
  472   1HD   ARG  62          HD2       ARG  62  -6.102  -0.895 -12.717
  473   2HD   ARG  62          HD1       ARG  62  -6.364  -0.205 -11.118
  474    HE   ARG  62           HE       ARG  62  -3.833   0.620 -12.024
  475   1HH1  ARG  62          HH11      ARG  62  -7.212   1.217 -12.285
  476   2HH1  ARG  62          HH12      ARG  62  -7.031   2.695 -13.170
  477   1HH2  ARG  62          HH21      ARG  62  -3.578   2.449 -13.388
  478   2HH2  ARG  62          HH22      ARG  62  -4.973   3.392 -13.795
  479    H    ILE  63           HN       ILE  63  -5.644  -3.565  -7.906
  480    HA   ILE  63           HA       ILE  63  -3.599  -1.921  -6.876
  481    HB   ILE  63           HB       ILE  63  -5.662  -3.616  -5.504
  482   1HG1  ILE  63          HG12      ILE  63  -5.382  -0.613  -5.572
  483   2HG1  ILE  63          HG11      ILE  63  -6.276  -1.506  -6.802
  484   1HG2  ILE  63          HG21      ILE  63  -3.541  -1.848  -4.286
  485   2HG2  ILE  63          HG22      ILE  63  -3.913  -3.526  -3.891
  486   3HG2  ILE  63          HG23      ILE  63  -5.036  -2.244  -3.436
  487   1HD1  ILE  63          HD11      ILE  63  -6.842  -1.460  -3.824
  488   2HD1  ILE  63          HD12      ILE  63  -7.664  -2.520  -4.969
  489   3HD1  ILE  63          HD13      ILE  63  -7.844  -0.770  -5.100
  490    H    SER  64           HN       SER  64  -3.972  -5.425  -6.754
  491    HA   SER  64           HA       SER  64  -1.702  -5.922  -5.125
  492   1HB   SER  64          HB2       SER  64  -3.414  -7.648  -5.836
  493   2HB   SER  64          HB1       SER  64  -2.670  -7.634  -7.431
  494    HG   SER  64           HG       SER  64  -1.106  -8.807  -6.669
  495    H    GLU  65           HN       GLU  65  -2.067  -5.528  -8.710
  496    HA   GLU  65           HA       GLU  65   0.639  -5.984  -9.306
  497   1HB   GLU  65          HB2       GLU  65  -1.453  -4.334 -10.750
  498   2HB   GLU  65          HB1       GLU  65   0.156  -4.652 -11.401
  499   1HG   GLU  65          HG2       GLU  65  -0.276  -7.090 -11.233
  500   2HG   GLU  65          HG1       GLU  65  -1.900  -6.745 -10.640
  501    H    ILE  66           HN       ILE  66  -1.082  -3.005  -8.460
  502    HA   ILE  66           HA       ILE  66   1.051  -1.215  -8.828
  503    HB   ILE  66           HB       ILE  66  -1.335  -1.150  -6.976
  504   1HG1  ILE  66          HG12      ILE  66  -0.657   0.382  -9.510
  505   2HG1  ILE  66          HG11      ILE  66  -1.685  -1.048  -9.457
  506   1HG2  ILE  66          HG21      ILE  66   0.856   0.878  -7.423
  507   2HG2  ILE  66          HG22      ILE  66   0.246   0.260  -5.889
  508   3HG2  ILE  66          HG23      ILE  66  -0.744   1.350  -6.850
  509   1HD1  ILE  66          HD11      ILE  66  -2.204   1.599  -8.070
  510   2HD1  ILE  66          HD12      ILE  66  -3.196   0.156  -7.862
  511   3HD1  ILE  66          HD13      ILE  66  -3.096   0.936  -9.440
  512    H    LEU  67           HN       LEU  67   0.041  -2.979  -5.926
  513    HA   LEU  67           HA       LEU  67   2.013  -1.941  -4.199
  514   1HB   LEU  67          HB2       LEU  67   0.241  -3.162  -3.159
  515   2HB   LEU  67          HB1       LEU  67   0.471  -4.548  -4.217
  516    HG   LEU  67           HG       LEU  67   2.698  -4.967  -3.128
  517   1HD1  LEU  67          HD11      LEU  67   3.422  -2.903  -2.248
  518   2HD1  LEU  67          HD12      LEU  67   2.893  -3.767  -0.808
  519   3HD1  LEU  67          HD13      LEU  67   1.848  -2.546  -1.533
  520   1HD2  LEU  67          HD21      LEU  67   0.404  -4.794  -1.154
  521   2HD2  LEU  67          HD22      LEU  67   1.773  -5.904  -1.095
  522   3HD2  LEU  67          HD23      LEU  67   0.571  -6.056  -2.375
  523    H    GLN  68           HN       GLN  68   2.035  -4.693  -6.400
  524    HA   GLN  68           HA       GLN  68   4.619  -5.637  -5.707
  525   1HB   GLN  68          HB2       GLN  68   3.049  -6.958  -7.070
  526   2HB   GLN  68          HB1       GLN  68   3.166  -5.765  -8.364
  527   1HG   GLN  68          HG2       GLN  68   5.505  -6.238  -8.690
  528   2HG   GLN  68          HG1       GLN  68   5.558  -7.245  -7.244
  529   1HE2  GLN  68          HE21      GLN  68   6.377  -8.418  -9.636
  530   2HE2  GLN  68          HE22      GLN  68   5.209  -9.529 -10.165
  531    H    GLU  69           HN       GLU  69   3.624  -3.400  -8.371
  532    HA   GLU  69           HA       GLU  69   6.219  -2.932  -9.258
  533   1HB   GLU  69          HB2       GLU  69   3.724  -1.249  -9.435
  534   2HB   GLU  69          HB1       GLU  69   5.235  -0.804 -10.226
  535   1HG   GLU  69          HG2       GLU  69   3.874  -3.479 -10.629
  536   2HG   GLU  69          HG1       GLU  69   3.622  -2.091 -11.687
  537    H    THR  70           HN       THR  70   4.355  -1.013  -6.868
  538    HA   THR  70           HA       THR  70   6.275   1.009  -6.520
  539    HB   THR  70           HB       THR  70   4.395  -0.112  -4.471
  540    HG1  THR  70           HG1      THR  70   2.939   0.782  -5.661
  541   1HG2  THR  70          HG21      THR  70   5.869   2.516  -4.672
  542   2HG2  THR  70          HG22      THR  70   6.076   1.281  -3.429
  543   3HG2  THR  70          HG23      THR  70   4.573   2.199  -3.519
  544    H    TRP  71           HN       TRP  71   5.743  -1.991  -4.832
  545    HA   TRP  71           HA       TRP  71   7.796  -1.830  -2.988
  546   1HB   TRP  71          HB2       TRP  71   5.989  -3.369  -2.735
  547   2HB   TRP  71          HB1       TRP  71   6.392  -4.159  -4.248
  548    HD1  TRP  71           HD1      TRP  71   7.347  -6.441  -3.743
  549    HE1  TRP  71           HE1      TRP  71   9.006  -7.438  -2.045
  550    HE3  TRP  71           HE3      TRP  71   8.289  -2.308  -0.848
  551    HZ2  TRP  71           HZ2      TRP  71  10.513  -6.614   0.230
  552    HZ3  TRP  71           HZ3      TRP  71   9.829  -2.464   1.078
  553    HH2  TRP  71           HH2      TRP  71  10.938  -4.609   1.624
  554    H    GLU  72           HN       GLU  72   7.816  -3.054  -6.280
  555    HA   GLU  72           HA       GLU  72  10.526  -3.945  -6.152
  556   1HB   GLU  72          HB2       GLU  72   8.635  -3.543  -8.469
  557   2HB   GLU  72          HB1       GLU  72  10.293  -4.107  -8.686
  558   1HG   GLU  72          HG2       GLU  72   9.852  -5.994  -7.156
  559   2HG   GLU  72          HG1       GLU  72   8.196  -5.436  -6.941
  560    H    SER  73           HN       SER  73   9.158  -0.793  -6.642
  561    HA   SER  73           HA       SER  73  11.695   0.133  -7.875
  562   1HB   SER  73          HB2       SER  73  10.500   2.097  -8.585
  563   2HB   SER  73          HB1       SER  73   9.520   0.699  -9.015
  564    HG   SER  73           HG       SER  73   8.100   1.946  -7.982
  565    H    ALA  74           HN       ALA  74  11.076  -0.516  -4.973
  566    HA   ALA  74           HA       ALA  74  10.831   1.615  -3.345
  567   1HB   ALA  74          HB1       ALA  74  10.954  -0.776  -2.724
  568   2HB   ALA  74          HB2       ALA  74  11.892   0.286  -1.673
  569   3HB   ALA  74          HB3       ALA  74  12.708  -0.686  -2.899
  570    H    ASP  75           HN       ASP  75  13.882   0.633  -4.878
  571    HA   ASP  75           HA       ASP  75  15.574   2.272  -3.339
  572   1HB   ASP  75          HB2       ASP  75  16.304   0.407  -4.834
  573   2HB   ASP  75          HB1       ASP  75  15.995   1.455  -6.217
  574    H    ASP  76           HN       ASP  76  13.407   3.132  -5.918
  575    HA   ASP  76           HA       ASP  76  14.804   5.658  -6.486
  576   1HB   ASP  76          HB2       ASP  76  13.809   4.325  -8.327
  577   2HB   ASP  76          HB1       ASP  76  12.218   4.565  -7.608
  578    H    TRP  77           HN       TRP  77  11.627   4.678  -5.155
  579    HA   TRP  77           HA       TRP  77  11.068   7.500  -4.530
  580   1HB   TRP  77          HB2       TRP  77   8.866   6.896  -4.082
  581   2HB   TRP  77          HB1       TRP  77   9.337   5.930  -5.463
  582    HD1  TRP  77           HD1      TRP  77   9.258   3.310  -5.200
  583    HE1  TRP  77           HE1      TRP  77   8.613   1.734  -3.288
  584    HE3  TRP  77           HE3      TRP  77   8.964   6.646  -1.231
  585    HZ2  TRP  77           HZ2      TRP  77   8.068   1.819  -0.511
  586    HZ3  TRP  77           HZ3      TRP  77   8.384   5.812   0.989
  587    HH2  TRP  77           HH2      TRP  77   7.945   3.427   1.359
  588    H    PHE  78           HN       PHE  78  12.331   4.768  -2.771
  589    HA   PHE  78           HA       PHE  78  11.522   5.959  -0.203
  590   1HB   PHE  78          HB2       PHE  78  11.466   3.536  -0.277
  591   2HB   PHE  78          HB1       PHE  78  13.143   3.482  -0.800
  592    HD1  PHE  78           HD1      PHE  78  11.172   5.162   1.942
  593    HD2  PHE  78           HD2      PHE  78  14.718   2.950   0.882
  594    HE1  PHE  78           HE1      PHE  78  11.936   5.235   4.292
  595    HE2  PHE  78           HE2      PHE  78  15.459   3.025   3.237
  596    HZ   PHE  78           HZ       PHE  78  14.072   4.165   4.944
  597    H    VAL  79           HN       VAL  79  12.674   7.319   0.904
  598    HA   VAL  79           HA       VAL  79  15.556   7.642   0.302
  599    HB   VAL  79           HB       VAL  79  13.900   9.902   1.410
  600   1HG1  VAL  79          HG11      VAL  79  15.512  11.264   0.331
  601   2HG1  VAL  79          HG12      VAL  79  16.031   9.956  -0.732
  602   3HG1  VAL  79          HG13      VAL  79  16.443   9.914   0.983
  603   1HG2  VAL  79          HG21      VAL  79  12.486   9.110  -0.419
  604   2HG2  VAL  79          HG22      VAL  79  13.886   8.999  -1.491
  605   3HG2  VAL  79          HG23      VAL  79  13.325  10.576  -0.938
  606    H    SER  80           HN       SER  80  16.945   7.753   2.187
  607    HA   SER  80           HA       SER  80  15.562   7.525   4.810
  608   1HB   SER  80          HB2       SER  80  18.180   6.169   4.122
  609   2HB   SER  80          HB1       SER  80  17.139   5.889   5.514
  610    HG   SER  80           HG       SER  80  15.641   5.519   3.398
  611    H    GLU  81           HN       GLU  81  16.357   8.714   6.436
  612    HA   GLU  81           HA       GLU  81  17.669  11.080   6.062
  613   1HB   GLU  81          HB2       GLU  81  16.547  10.306   8.179
  614   2HB   GLU  81          HB1       GLU  81  18.004   9.382   8.544
  615   1HG   GLU  81          HG2       GLU  81  18.198  11.489   9.687
  616   2HG   GLU  81          HG1       GLU  81  19.313  11.538   8.325
  Start of MODEL   18
    1   1H    MET   1          HT1       MET   1 -14.079   4.048  -1.669
    2   2H    MET   1          HT2       MET   1 -13.336   4.600  -0.245
    3   3H    MET   1          HT3       MET   1 -14.777   3.705  -0.162
    4    HA   MET   1           HA       MET   1 -13.758   1.749  -0.351
    5   1HB   MET   1          HB2       MET   1 -11.894   1.366  -1.912
    6   2HB   MET   1          HB1       MET   1 -13.226   2.200  -2.709
    7   1HG   MET   1          HG2       MET   1 -12.035   4.380  -2.203
    8   2HG   MET   1          HG1       MET   1 -10.650   3.420  -1.684
    9   1HE   MET   1          HE1       MET   1  -8.955   2.414  -3.114
   10   2HE   MET   1          HE2       MET   1  -9.222   1.807  -4.746
   11   3HE   MET   1          HE3       MET   1 -10.135   1.128  -3.404
   12    H    ARG   2           HN       ARG   2 -12.234   0.812   1.041
   13    HA   ARG   2           HA       ARG   2 -10.184   2.626   2.209
   14   1HB   ARG   2          HB2       ARG   2 -11.939   0.611   3.632
   15   2HB   ARG   2          HB1       ARG   2 -10.512   1.349   4.357
   16   1HG   ARG   2          HG2       ARG   2 -11.493   3.592   3.989
   17   2HG   ARG   2          HG1       ARG   2 -12.932   2.839   3.298
   18   1HD   ARG   2          HD2       ARG   2 -13.319   1.642   5.429
   19   2HD   ARG   2          HD1       ARG   2 -11.900   2.422   6.119
   20    HE   ARG   2           HE       ARG   2 -13.149   4.370   6.366
   21   1HH1  ARG   2          HH21      ARG   2 -14.690   2.178   4.174
   22   2HH1  ARG   2          HH22      ARG   2 -16.192   3.041   4.150
   23   1HH2  ARG   2          HH11      ARG   2 -15.138   5.473   6.386
   24   2HH2  ARG   2          HH12      ARG   2 -16.445   4.905   5.402
   25    H    ILE   3           HN       ILE   3  -8.175   1.851   2.274
   26    HA   ILE   3           HA       ILE   3  -7.710  -1.003   1.539
   27    HB   ILE   3           HB       ILE   3  -5.919   1.400   1.073
   28   1HG1  ILE   3          HG12      ILE   3  -7.876   1.623  -0.337
   29   2HG1  ILE   3          HG11      ILE   3  -6.540   1.062  -1.337
   30   1HG2  ILE   3          HG21      ILE   3  -4.850  -0.305  -0.535
   31   2HG2  ILE   3          HG22      ILE   3  -5.755  -1.527   0.359
   32   3HG2  ILE   3          HG23      ILE   3  -4.561  -0.528   1.190
   33   1HD1  ILE   3          HD11      ILE   3  -8.943  -0.455  -0.370
   34   2HD1  ILE   3          HD12      ILE   3  -7.467  -1.323  -0.789
   35   3HD1  ILE   3          HD13      ILE   3  -8.287  -0.343  -2.001
   36    H    GLU   4           HN       GLU   4  -6.737  -2.158   3.140
   37    HA   GLU   4           HA       GLU   4  -5.060  -0.699   5.131
   38   1HB   GLU   4          HB2       GLU   4  -7.233  -1.402   6.099
   39   2HB   GLU   4          HB1       GLU   4  -6.864  -3.075   5.685
   40   1HG   GLU   4          HG2       GLU   4  -4.858  -3.000   7.112
   41   2HG   GLU   4          HG1       GLU   4  -5.197  -1.315   7.507
   42    H    VAL   5           HN       VAL   5  -3.069  -1.387   5.382
   43    HA   VAL   5           HA       VAL   5  -2.315  -4.071   4.329
   44    HB   VAL   5           HB       VAL   5  -0.650  -1.546   4.404
   45   1HG1  VAL   5          HG11      VAL   5   0.838  -3.373   4.590
   46   2HG1  VAL   5          HG12      VAL   5   0.815  -3.017   2.864
   47   3HG1  VAL   5          HG13      VAL   5  -0.115  -4.375   3.495
   48   1HG2  VAL   5          HG21      VAL   5  -1.181  -1.153   2.186
   49   2HG2  VAL   5          HG22      VAL   5  -2.678  -1.961   2.644
   50   3HG2  VAL   5          HG23      VAL   5  -1.406  -2.859   1.821
   51    H    THR   6           HN       THR   6  -1.264  -5.434   5.676
   52    HA   THR   6           HA       THR   6  -0.196  -4.342   8.224
   53    HB   THR   6           HB       THR   6  -0.768  -6.593   9.206
   54    HG1  THR   6           HG1      THR   6  -2.733  -7.217   7.588
   55   1HG2  THR   6          HG21      THR   6  -3.243  -5.220   8.162
   56   2HG2  THR   6          HG22      THR   6  -2.196