*HEADER    STRUCTURAL GENOMICS, UNKNOWN FUNCTION   14-FEB-07   2JNY              
*TITLE     SOLUTION NMR STRUCTURE OF PROTEIN UNCHARACTERIZED BCR,                
*TITLE    2 NORTHEAST STRUCTURAL GENOMICS CONSORTIUM TARGET CGR1                 
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: UNCHARACTERIZED BCR;                                       
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: HYPOTHETICAL PROTEIN;                                       
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: CORYNEBACTERIUM GLUTAMICUM;                     
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR: PET21                                      
*KEYWDS    NMR, STRUCTURE, CGR1, NESG, STRUCTURAL GENOMICS, PSI-2,               
*KEYWDS   2 PROTEIN STRUCTURE INITIATIVE, NORTHEAST STRUCTURAL GENOMICS          
*KEYWDS   3 CONSORTIUM                                                           
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    Y.WU, G.LIU, Q.ZHANG, C.CHEN, C.NWOSU, K.CUNNINGHAM, L.MA,            
*AUTHOR   2 R.XIAO, J.LIU, M.BARAN, G.SWAPNA, T.ACTON, B.ROST,                   
*AUTHOR   3 G.MONTELIONE, T.SZYPERSKI, NORTHEAST STRUCTURAL GENOMICS             
*AUTHOR   4 CONSORTIUM (NESG)                                                    
*REVDAT   1   24-APR-07 2JNY    0                                                


assign ( resid    2 and name HA   )   ( resid    3 and name HN   )   2.39  0.59  0.59
assign ( resid    2 and name HB1  )   ( resid    3 and name HN   )   2.91  1.11  1.11
assign ( resid    3 and name HA   )   ( resid    4 and name HN   )   2.19  0.39  0.39
assign ( resid    7 and name HN   )   ( resid    8 and name HN   )   2.28  0.48  0.48
assign ( resid    8 and name HA   )   ( resid    9 and name HN   )   2.67  0.88  0.88
assign ( resid    8 and name HB2  )   ( resid    9 and name HN   )   3.02  1.22  1.22
assign ( resid    8 and name HB1  )   ( resid    9 and name HN   )   3.02  1.22  1.22
assign ( resid    9 and name HA   )   ( resid   10 and name HN   )   2.48  0.68  0.68
assign ( resid   10 and name HA   )   ( resid   11 and name HN   )   2.48  0.68  0.68
assign ( resid   11 and name HA   )   ( resid   12 and name HN   )   2.15  0.36  0.36
assign ( resid   11 and name HB1  )   ( resid   12 and name HN   )   2.71  0.91  0.91
assign ( resid   12 and name HA   )   ( resid   13 and name HN   )   2.21  0.41  0.41
assign ( resid   15 and name HB2  )   ( resid   16 and name HN   )   2.64  0.84  0.84
assign ( resid   15 and name HB1  )   ( resid   16 and name HN   )   2.64  0.84  0.84
assign ( resid   16 and name HN   )   ( resid   17 and name HN   )   2.26  0.46  0.46
assign ( resid   17 and name HA   )   ( resid   18 and name HN   )   2.64  0.84  0.84
assign ( resid   19 and name HB1  )   ( resid   20 and name HN   )   2.94  1.15  1.15
assign ( resid   20 and name HA   )   ( resid   21 and name HN   )   2.22  0.43  0.43
assign ( resid   20 and name HB1  )   ( resid   21 and name HN   )   2.55  0.75  0.75
assign ( resid   20 and name HB2  )   ( resid   21 and name HN   )   3.12  1.33  1.33
assign ( resid   21 and name HA   )   ( resid   22 and name HN   )   2.17  0.37  0.37
assign ( resid   22 and name HA   )   ( resid   23 and name HN   )   2.15  0.36  0.36
assign ( resid   23 and name HA   )   ( resid   24 and name HN   )   2.12  0.32  0.32
assign ( resid   24 and name HN   )   ( resid   25 and name HN   )   2.87  1.08  1.08
assign ( resid   24 and name HB2  )   ( resid   25 and name HN   )   2.49  0.70  0.70
assign ( resid   24 and name HB1  )   ( resid   25 and name HN   )   3.00  1.20  1.20
assign ( resid   25 and name HB2  )   ( resid   26 and name HN   )   3.41  1.62  1.62
assign ( resid   25 and name HB1  )   ( resid   26 and name HN   )   3.41  1.62  1.62
assign ( resid   26 and name HB2  )   ( resid   27 and name HN   )   3.39  1.60  1.60
assign ( resid   26 and name HB1  )   ( resid   27 and name HN   )   3.39  1.60  1.60
assign ( resid   27 and name HA   )   ( resid   28 and name HN   )   2.33  0.54  0.54
assign ( resid   28 and name HB1  )   ( resid   29 and name HN   )   2.37  0.57  0.57
assign ( resid   29 and name HA   )   ( resid   30 and name HN   )   2.17  0.37  0.37
assign ( resid   30 and name HA   )   ( resid   31 and name HN   )   2.19  0.39  0.39
assign ( resid   30 and name HB   )   ( resid   31 and name HN   )   3.07  1.27  1.27
assign ( resid   31 and name HA   )   ( resid   32 and name HN   )   2.19  0.39  0.39
assign ( resid   32 and name HB2  )   ( resid   33 and name HN   )   3.14  1.35  1.35
assign ( resid   33 and name HB1  )   ( resid   34 and name HN   )   3.12  1.33  1.33
assign ( resid   35 and name HA   )   ( resid   36 and name HN   )   2.39  0.59  0.59
assign ( resid   36 and name HA   )   ( resid   37 and name HN   )   2.21  0.41  0.41
assign ( resid   37 and name HA   )   ( resid   38 and name HN   )   2.21  0.41  0.41
assign ( resid   39 and name HA   )   ( resid   40 and name HN   )   2.22  0.43  0.43
assign ( resid   41 and name HA   )   ( resid   42 and name HN   )   2.24  0.45  0.45
assign ( resid   43 and name HN   )   ( resid   44 and name HN   )   2.44  0.64  0.64
assign ( resid   47 and name HN   )   ( resid   48 and name HN   )   2.94  1.15  1.15
assign ( resid   47 and name HA   )   ( resid   48 and name HN   )   2.26  0.46  0.46
assign ( resid   48 and name HA   )   ( resid   49 and name HN   )   2.19  0.39  0.39
assign ( resid   48 and name HB2  )   ( resid   49 and name HN   )   3.29  1.49  1.49
assign ( resid   48 and name HB1  )   ( resid   49 and name HN   )   3.29  1.49  1.49
assign ( resid   49 and name HN   )   ( resid   50 and name HN   )   2.49  0.70  0.70
assign ( resid   50 and name HN   )   ( resid   51 and name HN   )   2.42  0.63  0.63
assign ( resid   51 and name HN   )   ( resid   52 and name HN   )   2.46  0.66  0.66
assign ( resid   52 and name HA   )   ( resid   53 and name HN   )   2.19  0.39  0.39
assign ( resid   53 and name HA   )   ( resid   54 and name HN   )   2.21  0.41  0.41
assign ( resid   53 and name HB   )   ( resid   54 and name HN   )   2.71  0.91  0.91
assign ( resid   54 and name HA   )   ( resid   55 and name HN   )   2.15  0.36  0.36
assign ( resid   55 and name HA   )   ( resid   56 and name HN   )   2.19  0.39  0.39
assign ( resid   55 and name HB2  )   ( resid   56 and name HN   )   3.32  1.53  1.53
assign ( resid   57 and name HA   )   ( resid   58 and name HN   )   2.33  0.54  0.54
assign ( resid   57 and name HB2  )   ( resid   58 and name HN   )   3.11  1.31  1.31
assign ( resid   58 and name HB2  )   ( resid   59 and name HN   )   3.12  1.33  1.33
assign ( resid   58 and name HB1  )   ( resid   59 and name HN   )   3.12  1.33  1.33
assign ( resid   59 and name HN   )   ( resid   60 and name HN   )   3.65  1.85  1.85
assign ( resid   60 and name HA   )   ( resid   61 and name HN   )   2.39  0.59  0.59
assign ( resid   60 and name HB2  )   ( resid   61 and name HN   )   3.25  1.45  1.45
assign ( resid   60 and name HB1  )   ( resid   61 and name HN   )   3.25  1.45  1.45
assign ( resid    2 and name HN   )   ( resid    2 and name HB1  )   2.91  1.11  1.11
assign ( resid    4 and name HN   )   ( resid    4 and name HB2  )   2.37  0.57  0.57
assign ( resid    8 and name HN   )   ( resid    8 and name HB2  )   2.76  0.97  0.97
assign ( resid    8 and name HN   )   ( resid    8 and name HB1  )   2.76  0.97  0.97
assign ( resid    9 and name HN   )   ( resid    9 and name HA   )   2.37  0.57  0.57
assign ( resid   10 and name HN   )   ( resid   10 and name HB   )   2.44  0.64  0.64
assign ( resid   11 and name HN   )   ( resid   11 and name HB2  )   2.35  0.55  0.55
assign ( resid   15 and name HN   )   ( resid   15 and name HB2  )   2.98  1.18  1.18
assign ( resid   16 and name HN   )   ( resid   16 and name HB1  )   2.94  1.15  1.15
assign ( resid   17 and name HN   )   ( resid   17 and name HB2  )   2.98  1.18  1.18
assign ( resid   17 and name HN   )   ( resid   17 and name HB1  )   2.98  1.18  1.18
assign ( resid   22 and name HN   )   ( resid   22 and name HB1  )   2.33  0.54  0.54
assign ( resid   22 and name HN   )   ( resid   22 and name HB2  )   2.44  0.64  0.64
assign ( resid   23 and name HN   )   ( resid   23 and name HB2  )   2.67  0.88  0.88
assign ( resid   23 and name HN   )   ( resid   23 and name HB1  )   2.67  0.88  0.88
assign ( resid   24 and name HN   )   ( resid   24 and name HB2  )   2.30  0.50  0.50
assign ( resid   27 and name HN   )   ( resid   27 and name HA   )   2.19  0.39  0.39
assign ( resid   27 and name HN   )   ( resid   27 and name HB2  )   2.75  0.95  0.95
assign ( resid   28 and name HN   )   ( resid   28 and name HB1  )   2.84  1.04  1.04
assign ( resid   28 and name HN   )   ( resid   28 and name HB2  )   2.49  0.70  0.70
assign ( resid   29 and name HN   )   ( resid   29 and name HB2  )   2.33  0.54  0.54
assign ( resid   31 and name HN   )   ( resid   31 and name HB2  )   2.55  0.75  0.75
assign ( resid   31 and name HN   )   ( resid   31 and name HB1  )   2.55  0.75  0.75
assign ( resid   32 and name HN   )   ( resid   32 and name HB2  )   2.42  0.63  0.63
assign ( resid   32 and name HN   )   ( resid   32 and name HB1  )   2.42  0.63  0.63
assign ( resid   33 and name HN   )   ( resid   33 and name HB2  )   2.40  0.61  0.61
assign ( resid   34 and name HN   )   ( resid   34 and name HB2  )   2.35  0.55  0.55
assign ( resid   35 and name HN   )   ( resid   35 and name HA   )   2.24  0.45  0.45
assign ( resid   36 and name HN   )   ( resid   36 and name HB2  )   2.40  0.61  0.61
assign ( resid   38 and name HN   )   ( resid   38 and name HB1  )   2.73  0.93  0.93
assign ( resid   40 and name HN   )   ( resid   40 and name HB   )   2.42  0.63  0.63
assign ( resid   41 and name HN   )   ( resid   41 and name HB1  )   2.57  0.77  0.77
assign ( resid   42 and name HN   )   ( resid   42 and name HB2  )   2.87  1.08  1.08
assign ( resid   48 and name HN   )   ( resid   48 and name HB2  )   2.76  0.97  0.97
assign ( resid   48 and name HN   )   ( resid   48 and name HB1  )   2.76  0.97  0.97
assign ( resid   50 and name HN   )   ( resid   50 and name HB1  )   2.62  0.82  0.82
assign ( resid   51 and name HN   )   ( resid   51 and name HB2  )   2.96  1.17  1.17
assign ( resid   54 and name HN   )   ( resid   54 and name HB*  )   2.79  0.99  0.99
assign ( resid   56 and name HN   )   ( resid   56 and name HB   )   2.66  0.86  0.86
assign ( resid   58 and name HN   )   ( resid   58 and name HB2  )   2.64  0.84  0.84
assign ( resid   58 and name HN   )   ( resid   58 and name HB1  )   2.64  0.84  0.84
assign ( resid   59 and name HN   )   ( resid   59 and name HB2  )   3.00  1.20  1.20
assign ( resid   59 and name HN   )   ( resid   59 and name HB1  )   3.00  1.20  1.20
assign ( resid   60 and name HN   )   ( resid   60 and name HB2  )   2.89  1.09  1.09
assign ( resid    6 and name HN   )   ( resid    7 and name HN   )   2.40  0.61  0.61
assign ( resid   15 and name HN   )   ( resid   16 and name HN   )   2.39  0.59  0.59
assign ( resid   17 and name HN   )   ( resid   18 and name HN   )   2.46  0.66  0.66
assign ( resid   25 and name HN   )   ( resid   26 and name HN   )   2.57  0.77  0.77
assign ( resid   26 and name HN   )   ( resid   27 and name HN   )   2.30  0.50  0.50
assign ( resid   27 and name HN   )   ( resid   28 and name HN   )   2.60  0.81  0.81
assign ( resid   32 and name HN   )   ( resid   33 and name HN   )   2.55  0.75  0.75
assign ( resid   33 and name HN   )   ( resid   34 and name HN   )   2.57  0.77  0.77
assign ( resid   34 and name HN   )   ( resid   35 and name HN   )   2.19  0.39  0.39
assign ( resid   42 and name HN   )   ( resid   43 and name HN   )   2.48  0.68  0.68
assign ( resid   48 and name HN   )   ( resid   49 and name HN   )   3.47  1.67  1.67
assign ( resid   60 and name HN   )   ( resid   61 and name HN   )   3.39  1.60  1.60
assign ( resid   13 and name HA   )   ( resid   15 and name HN   )   3.05  1.26  1.26
assign ( resid   26 and name HB2  )   ( resid   28 and name HN   )   3.54  1.74  1.74
assign ( resid   31 and name HN   )   ( resid   37 and name HA   )   2.82  1.02  1.02
assign ( resid   33 and name HN   )   ( resid   35 and name HN   )   3.29  1.49  1.49
assign ( resid   32 and name HA   )   ( resid   35 and name HN   )   2.89  1.09  1.09
assign ( resid   31 and name HN   )   ( resid   36 and name HN   )   2.73  0.93  0.93
assign ( resid   48 and name HA   )   ( resid   50 and name HN   )   3.12  1.33  1.33
assign ( resid   48 and name HB2  )   ( resid   50 and name HN   )   3.02  1.22  1.22
assign ( resid   48 and name HB2  )   ( resid   51 and name HN   )   2.69  0.90  0.90
assign ( resid    4 and name HN   )   ( resid    7 and name HB*  )   4.27  2.47  2.47
assign ( resid   41 and name HN   )   ( resid   46 and name HN   )   3.02  1.22  1.22
assign ( resid   15 and name HN   )   ( resid   17 and name HN   )   2.73  0.93  0.93
assign ( resid   13 and name HB1  )   ( resid   17 and name HN   )   3.16  1.36  1.36
assign ( resid   21 and name HN   )   ( resid   30 and name HN   )   2.44  0.64  0.64
assign ( resid   24 and name HA   )   ( resid   27 and name HN   )   2.78  0.99  0.99
assign ( resid   31 and name HA   )   ( resid   33 and name HN   )   3.27  1.47  1.47
assign ( resid   30 and name HA   )   ( resid   38 and name HN   )   2.75  0.95  0.95
assign ( resid   41 and name HN   )   ( resid   44 and name HB   )   2.96  1.17  1.17
assign ( resid   41 and name HN   )   ( resid   45 and name HA   )   3.07  1.27  1.27
assign ( resid   37 and name HN   )   ( resid   53 and name HN   )   2.40  0.61  0.61
assign ( resid   36 and name HA   )   ( resid   55 and name HN   )   2.75  0.95  0.95
assign ( resid   48 and name HB1  )   ( resid   50 and name HN   )   3.02  1.22  1.22
assign ( resid   48 and name HB1  )   ( resid   51 and name HN   )   2.69  0.90  0.90
assign ( resid   57 and name HB1  )   ( resid   58 and name HN   )   3.11  1.31  1.31
assign ( resid   23 and name HN   )   ( resid   28 and name HN   )   2.67  0.88  0.88
assign ( resid    6 and name HN   )   ( resid    8 and name HN   )   3.25  1.45  1.45
assign ( resid   29 and name HN   )   ( resid   38 and name HN   )   2.60  0.81  0.81
assign ( resid   13 and name HB2  )   ( resid   17 and name HN   )   3.16  1.36  1.36
assign ( resid   38 and name HA   )   ( resid   39 and name HN   )   2.37  0.57  0.57
assign ( resid   55 and name HN   )   ( resid   56 and name HN   )   3.34  1.54  1.54
assign ( resid   12 and name HA   )   ( resid   20 and name HN   )   3.18  1.38  1.38
assign ( resid   21 and name HN   )   ( resid   31 and name HA   )   3.09  1.29  1.29
assign ( resid   22 and name HA   )   ( resid   30 and name HN   )   2.96  1.17  1.17
assign ( resid   23 and name HN   )   ( resid   29 and name HA   )   2.71  0.91  0.91
assign ( resid   28 and name HA   )   ( resid   40 and name HN   )   2.93  1.13  1.13
assign ( resid   38 and name HA   )   ( resid   53 and name HN   )   3.36  1.56  1.56
assign ( resid   13 and name HN   )   ( resid   17 and name HN   )   3.07  1.27  1.27
assign ( resid   41 and name HN   )   ( resid   44 and name HN   )   2.58  0.79  0.79
assign ( resid   26 and name HB1  )   ( resid   28 and name HN   )   3.54  1.74  1.74
assign ( resid   32 and name HB1  )   ( resid   33 and name HN   )   3.14  1.35  1.35
assign ( resid   13 and name HN   )   ( resid   17 and name HA   )   3.27  1.47  1.47
assign ( resid    5 and name HG2  )   ( resid    6 and name HN   )   3.50  1.71  1.71
assign ( resid    5 and name HG1  )   ( resid    6 and name HN   )   3.50  1.71  1.71
assign ( resid    5 and name HD2  )   ( resid    6 and name HN   )   3.59  1.80  1.80
assign ( resid    5 and name HD1  )   ( resid    6 and name HN   )   3.59  1.80  1.80
assign ( resid   21 and name HG2  )   ( resid   22 and name HN   )   3.05  1.26  1.26
assign ( resid   22 and name HD*  )   ( resid   23 and name HN   )   4.10  2.30  2.30
assign ( resid   34 and name HG   )   ( resid   35 and name HN   )   3.61  1.81  1.81
assign ( resid   38 and name HD*  )   ( resid   39 and name HN   )   4.48  2.68  2.68
assign ( resid   48 and name HG   )   ( resid   49 and name HN   )   3.90  2.10  2.10
assign ( resid   54 and name HG2  )   ( resid   55 and name HN   )   3.61  1.81  1.81
assign ( resid   60 and name HG   )   ( resid   61 and name HN   )   3.90  2.10  2.10
assign ( resid    3 and name HN   )   ( resid    3 and name HG   )   3.32  1.53  1.53
assign ( resid    6 and name HN   )   ( resid    6 and name HG1  )   3.20  1.40  1.40
assign ( resid    7 and name HN   )   ( resid    7 and name HG   )   2.82  1.02  1.02
assign ( resid    8 and name HN   )   ( resid    8 and name HG   )   2.80  1.00  1.00
assign ( resid    9 and name HN   )   ( resid    9 and name HG2  )   3.36  1.56  1.56
assign ( resid    9 and name HN   )   ( resid    9 and name HG1  )   3.36  1.56  1.56
assign ( resid   11 and name HN   )   ( resid   11 and name HG   )   2.46  0.66  0.66
assign ( resid   17 and name HN   )   ( resid   17 and name HG2  )   3.54  1.74  1.74
assign ( resid   17 and name HN   )   ( resid   17 and name HG1  )   3.54  1.74  1.74
assign ( resid   20 and name HN   )   ( resid   20 and name HG   )   2.62  0.82  0.82
assign ( resid   21 and name HN   )   ( resid   30 and name HB   )   3.09  1.29  1.29
assign ( resid   26 and name HN   )   ( resid   26 and name HG2  )   3.20  1.40  1.40
assign ( resid   26 and name HN   )   ( resid   26 and name HG1  )   3.20  1.40  1.40
assign ( resid   27 and name HN   )   ( resid   27 and name HG2  )   3.25  1.45  1.45
assign ( resid   28 and name HN   )   ( resid   28 and name HG   )   2.71  0.91  0.91
assign ( resid   29 and name HN   )   ( resid   29 and name HG   )   2.91  1.11  1.11
assign ( resid   32 and name HN   )   ( resid   32 and name HG2  )   3.43  1.63  1.63
assign ( resid   32 and name HN   )   ( resid   32 and name HG1  )   3.43  1.63  1.63
assign ( resid   33 and name HN   )   ( resid   33 and name HG2  )   2.93  1.13  1.13
assign ( resid   33 and name HN   )   ( resid   33 and name HG1  )   2.93  1.13  1.13
assign ( resid   39 and name HN   )   ( resid   39 and name HG2  )   2.89  1.09  1.09
assign ( resid   39 and name HN   )   ( resid   39 and name HG1  )   2.89  1.09  1.09
assign ( resid   44 and name HN   )   ( resid   44 and name HG12 )   3.09  1.29  1.29
assign ( resid   47 and name HN   )   ( resid   47 and name HG   )   2.60  0.81  0.81
assign ( resid   49 and name HN   )   ( resid   49 and name HG12 )   3.16  1.36  1.36
assign ( resid   51 and name HN   )   ( resid   51 and name HG2  )   3.27  1.47  1.47
assign ( resid   51 and name HN   )   ( resid   51 and name HG1  )   3.27  1.47  1.47
assign ( resid   54 and name HN   )   ( resid   54 and name HG2  )   3.25  1.45  1.45
assign ( resid   54 and name HN   )   ( resid   54 and name HG1  )   3.25  1.45  1.45
assign ( resid   60 and name HN   )   ( resid   60 and name HG   )   3.23  1.44  1.44
assign ( resid   61 and name HN   )   ( resid   61 and name HG2  )   3.90  2.10  2.10
assign ( resid   61 and name HN   )   ( resid   61 and name HG1  )   3.90  2.10  2.10
assign ( resid   59 and name HN   )   ( resid   59 and name HD21 )   3.90  2.10  2.10
assign ( resid   59 and name HN   )   ( resid   59 and name HD22 )   3.90  2.10  2.10
assign ( resid   13 and name HN   )   ( resid   20 and name HG   )   2.87  1.08  1.08
assign ( resid   13 and name HB1  )   ( resid   18 and name HN   )   3.23  1.44  1.44
assign ( resid   13 and name HB2  )   ( resid   18 and name HN   )   3.23  1.44  1.44
assign ( resid   29 and name HN   )   ( resid   38 and name HB2  )   3.36  1.56  1.56
assign ( resid   31 and name HB2  )   ( resid   36 and name HN   )   3.50  1.71  1.71
assign ( resid   20 and name HB1  )   ( resid   30 and name HN   )   3.09  1.29  1.29
assign ( resid   34 and name HN   )   ( resid   34 and name HG   )   2.53  0.73  0.73
assign ( resid   31 and name HB1  )   ( resid   36 and name HN   )   3.50  1.71  1.71
assign ( resid   30 and name HB   )   ( resid   55 and name HE1  )   3.90  2.10  2.10
assign ( resid   21 and name HB*  )   ( resid   30 and name HN   )   3.76  1.97  1.97
assign ( resid   31 and name HN   )   ( resid   36 and name HB2  )   3.88  2.08  2.08
assign ( resid   24 and name HA   )   ( resid   27 and name HE21 )   3.32  1.53  1.53
assign ( resid   15 and name HB2  )   ( resid   31 and name HD21 )   4.56  2.77  2.77
assign ( resid   15 and name HB2  )   ( resid   31 and name HD22 )   4.56  2.77  2.77
assign ( resid   31 and name HD22 )   ( resid   34 and name HB2  )   3.56  1.76  1.76
assign ( resid   36 and name HN   )   ( resid   36 and name HG   )   2.80  1.00  1.00
assign ( resid   14 and name HG1  )   ( resid   49 and name HN   )   3.45  1.65  1.65
assign ( resid   14 and name HG2  )   ( resid   49 and name HN   )   3.45  1.65  1.65
assign ( resid   13 and name HB2  )   ( resid   31 and name HD22 )   4.45  2.66  2.66
assign ( resid   13 and name HB2  )   ( resid   31 and name HD21 )   4.45  2.66  2.66
assign ( resid    3 and name HD1* )   ( resid    4 and name HN   )   3.36  1.57  1.57
assign ( resid    3 and name HD2* )   ( resid    4 and name HN   )   4.37  2.58  2.58
assign ( resid    7 and name HD2* )   ( resid    8 and name HN   )   4.30  2.50  2.50
assign ( resid   10 and name HG1* )   ( resid   11 and name HN   )   2.88  1.08  1.08
assign ( resid   11 and name HD2* )   ( resid   12 and name HN   )   3.40  1.60  1.60
assign ( resid   12 and name HB*  )   ( resid   13 and name HN   )   2.70  0.90  0.90
assign ( resid   20 and name HD2* )   ( resid   21 and name HN   )   3.38  1.59  1.59
assign ( resid   29 and name HD2* )   ( resid   30 and name HN   )   3.13  1.33  1.33
assign ( resid   30 and name HG2* )   ( resid   31 and name HN   )   3.92  2.13  2.13
assign ( resid   30 and name HG1* )   ( resid   31 and name HN   )   2.93  1.14  1.14
assign ( resid   37 and name HB*  )   ( resid   38 and name HN   )   2.98  1.19  1.19
assign ( resid   40 and name HG2* )   ( resid   41 and name HN   )   3.22  1.42  1.42
assign ( resid   46 and name HG2* )   ( resid   47 and name HN   )   3.83  2.04  2.04
assign ( resid   46 and name HG1* )   ( resid   48 and name HN   )   3.33  1.53  1.53
assign ( resid   49 and name HG2* )   ( resid   50 and name HN   )   3.20  1.41  1.41
assign ( resid   52 and name HB*  )   ( resid   53 and name HN   )   2.89  1.10  1.10
assign ( resid   53 and name HG2* )   ( resid   54 and name HN   )   3.13  1.33  1.33
assign ( resid   60 and name HD1* )   ( resid   61 and name HN   )   4.41  2.61  2.61
assign ( resid   60 and name HD2* )   ( resid   61 and name HN   )   4.41  2.61  2.61
assign ( resid    3 and name HN   )   ( resid    3 and name HD1* )   3.80  2.00  2.00
assign ( resid    3 and name HN   )   ( resid    3 and name HD2* )   4.01  2.22  2.22
assign ( resid    7 and name HN   )   ( resid    7 and name HD2* )   4.14  2.34  2.34
assign ( resid    8 and name HN   )   ( resid    8 and name HD1* )   3.65  1.86  1.86
assign ( resid   11 and name HN   )   ( resid   11 and name HD1* )   3.54  1.75  1.75
assign ( resid   11 and name HN   )   ( resid   11 and name HD2* )   3.24  1.44  1.44
assign ( resid   12 and name HN   )   ( resid   12 and name HB*  )   2.70  0.90  0.90
assign ( resid   20 and name HN   )   ( resid   20 and name HD2* )   3.78  1.98  1.98
assign ( resid   23 and name HN   )   ( resid   23 and name HD1* )   3.97  2.18  2.18
assign ( resid   23 and name HN   )   ( resid   23 and name HD2* )   3.97  2.18  2.18
assign ( resid   28 and name HN   )   ( resid   40 and name HD1* )   3.33  1.53  1.53
assign ( resid   34 and name HN   )   ( resid   34 and name HD1* )   3.69  1.89  1.89
assign ( resid   34 and name HN   )   ( resid   34 and name HD2* )   3.63  1.84  1.84
assign ( resid   37 and name HN   )   ( resid   37 and name HB*  )   2.71  0.92  0.92
assign ( resid   44 and name HN   )   ( resid   44 and name HD1* )   3.80  2.00  2.00
assign ( resid   47 and name HN   )   ( resid   47 and name HD2* )   3.54  1.75  1.75
assign ( resid   49 and name HN   )   ( resid   49 and name HG2* )   3.27  1.48  1.48
assign ( resid   49 and name HN   )   ( resid   49 and name HD1* )   3.38  1.59  1.59
assign ( resid   52 and name HN   )   ( resid   52 and name HB*  )   2.62  0.83  0.83
assign ( resid   53 and name HN   )   ( resid   53 and name HG2* )   3.31  1.51  1.51
assign ( resid   56 and name HN   )   ( resid   56 and name HG2* )   3.16  1.37  1.37
assign ( resid   60 and name HN   )   ( resid   60 and name HD1* )   4.41  2.61  2.61
assign ( resid   12 and name HN   )   ( resid   20 and name HD1* )   3.45  1.66  1.66
assign ( resid   13 and name HN   )   ( resid   20 and name HD2* )   3.16  1.37  1.37
assign ( resid   13 and name HN   )   ( resid   20 and name HD1* )   3.51  1.71  1.71
assign ( resid    4 and name HN   )   ( resid    7 and name HD1* )   3.56  1.77  1.77
assign ( resid   12 and name HB*  )   ( resid   17 and name HN   )   3.81  2.02  2.02
assign ( resid   21 and name HN   )   ( resid   30 and name HG2* )   3.99  2.20  2.20
assign ( resid   22 and name HN   )   ( resid   29 and name HD2* )   3.60  1.80  1.80
assign ( resid   20 and name HD2* )   ( resid   31 and name HN   )   3.36  1.57  1.57
assign ( resid   30 and name HG1* )   ( resid   32 and name HN   )   3.56  1.77  1.77
assign ( resid   30 and name HG1* )   ( resid   36 and name HN   )   4.37  2.58  2.58
assign ( resid   28 and name HD2* )   ( resid   40 and name HN   )   3.47  1.68  1.68
assign ( resid   40 and name HG2* )   ( resid   43 and name HN   )   2.89  1.10  1.10
assign ( resid   40 and name HG2* )   ( resid   44 and name HN   )   2.86  1.06  1.06
assign ( resid   51 and name HN   )   ( resid   52 and name HB*  )   3.58  1.78  1.78
assign ( resid   28 and name HD1* )   ( resid   55 and name HE1  )   3.11  1.32  1.32
assign ( resid   28 and name HD1* )   ( resid   38 and name HN   )   4.41  2.61  2.61
assign ( resid   28 and name HD2* )   ( resid   38 and name HN   )   3.65  1.86  1.86
assign ( resid   39 and name HN   )   ( resid   46 and name HG2* )   3.92  2.13  2.13
assign ( resid   30 and name HG1* )   ( resid   55 and name HE1  )   3.43  1.64  1.64
assign ( resid   31 and name HN   )   ( resid   37 and name HB*  )   4.28  2.49  2.49
assign ( resid   16 and name HN   )   ( resid   34 and name HD1* )   3.17  1.37  1.37
assign ( resid   30 and name HG2* )   ( resid   55 and name HE1  )   3.38  1.59  1.59
assign ( resid   31 and name HD21 )   ( resid   34 and name HD1* )   3.09  1.30  1.30
assign ( resid   31 and name HD22 )   ( resid   34 and name HD1* )   3.09  1.30  1.30
assign ( resid   28 and name HN   )   ( resid   28 and name HD1* )   3.56  1.77  1.77
assign ( resid   29 and name HN   )   ( resid   29 and name HD2* )   3.33  1.53  1.53
assign ( resid   28 and name HD1* )   ( resid   29 and name HN   )   3.90  2.11  2.11
assign ( resid   29 and name HN   )   ( resid   40 and name HD1* )   3.67  1.87  1.87
assign ( resid   37 and name HB*  )   ( resid   53 and name HN   )   3.40  1.60  1.60
assign ( resid   12 and name HB*  )   ( resid   18 and name HN   )   3.81  2.02  2.02
assign ( resid   36 and name HN   )   ( resid   36 and name HD2* )   3.74  1.95  1.95
assign ( resid   16 and name HN   )   ( resid   34 and name HD2* )   3.87  2.07  2.07
assign ( resid   36 and name HD2* )   ( resid   37 and name HN   )   3.56  1.77  1.77
assign ( resid   12 and name HN   )   ( resid   47 and name HD1* )   3.02  1.23  1.23
assign ( resid    2 and name HN   )   ( resid    2 and name HB2  )   2.91  1.11  1.11
assign ( resid    4 and name HN   )   ( resid    4 and name HB1  )   2.37  0.57  0.57
assign ( resid    6 and name HN   )   ( resid    6 and name HB*  )   2.81  1.01  1.01
assign ( resid   10 and name HA   )   ( resid   10 and name HB   )   2.40  0.61  0.61
assign ( resid   11 and name HA   )   ( resid   11 and name HB1  )   2.31  0.52  0.52
assign ( resid   11 and name HN   )   ( resid   11 and name HB1  )   2.91  1.11  1.11
assign ( resid   13 and name HN   )   ( resid   13 and name HB2  )   2.57  0.77  0.77
assign ( resid   13 and name HN   )   ( resid   13 and name HB1  )   2.57  0.77  0.77
assign ( resid   15 and name HN   )   ( resid   15 and name HB1  )   2.98  1.18  1.18
assign ( resid   16 and name HN   )   ( resid   16 and name HB2  )   2.94  1.15  1.15
assign ( resid   16 and name HA   )   ( resid   16 and name HB2  )   2.33  0.54  0.54
assign ( resid   16 and name HA   )   ( resid   16 and name HB1  )   2.33  0.54  0.54
assign ( resid   17 and name HN   )   ( resid   17 and name HA   )   2.13  0.34  0.34
assign ( resid   20 and name HN   )   ( resid   20 and name HB2  )   2.46  0.66  0.66
assign ( resid   22 and name HA   )   ( resid   22 and name HB2  )   2.37  0.57  0.57
assign ( resid   24 and name HA   )   ( resid   24 and name HB1  )   2.33  0.54  0.54
assign ( resid   24 and name HN   )   ( resid   24 and name HB1  )   2.80  1.00  1.00
assign ( resid   25 and name HA   )   ( resid   25 and name HB2  )   2.35  0.55  0.55
assign ( resid   25 and name HA   )   ( resid   25 and name HB1  )   2.35  0.55  0.55
assign ( resid   27 and name HA   )   ( resid   27 and name HB1  )   2.40  0.61  0.61
assign ( resid   28 and name HA   )   ( resid   28 and name HB1  )   2.31  0.52  0.52
assign ( resid   29 and name HA   )   ( resid   29 and name HB1  )   2.37  0.57  0.57
assign ( resid   29 and name HN   )   ( resid   29 and name HB1  )   2.76  0.97  0.97
assign ( resid   30 and name HN   )   ( resid   30 and name HB   )   2.30  0.50  0.50
assign ( resid   33 and name HN   )   ( resid   33 and name HB1  )   2.93  1.13  1.13
assign ( resid   34 and name HA   )   ( resid   34 and name HB1  )   2.35  0.55  0.55
assign ( resid   36 and name HA   )   ( resid   36 and name HB1  )   2.39  0.59  0.59
assign ( resid   39 and name HN   )   ( resid   39 and name HB2  )   2.71  0.91  0.91
assign ( resid   39 and name HN   )   ( resid   39 and name HB1  )   2.71  0.91  0.91
assign ( resid   41 and name HN   )   ( resid   41 and name HB2  )   2.57  0.77  0.77
assign ( resid   42 and name HN   )   ( resid   42 and name HA   )   2.22  0.43  0.43
assign ( resid   42 and name HA   )   ( resid   42 and name HB2  )   2.40  0.61  0.61
assign ( resid   42 and name HN   )   ( resid   42 and name HB1  )   2.87  1.08  1.08
assign ( resid   42 and name HA   )   ( resid   42 and name HB1  )   2.40  0.61  0.61
assign ( resid   44 and name HN   )   ( resid   44 and name HB   )   2.37  0.57  0.57
assign ( resid   46 and name HN   )   ( resid   46 and name HB   )   2.37  0.57  0.57
assign ( resid   47 and name HA   )   ( resid   47 and name HB1  )   2.31  0.52  0.52
assign ( resid   47 and name HN   )   ( resid   47 and name HB1  )   2.87  1.08  1.08
assign ( resid   47 and name HN   )   ( resid   47 and name HB2  )   2.35  0.55  0.55
assign ( resid   49 and name HN   )   ( resid   49 and name HB   )   2.26  0.46  0.46
assign ( resid   50 and name HN   )   ( resid   50 and name HB2  )   2.62  0.82  0.82
assign ( resid   51 and name HN   )   ( resid   51 and name HB1  )   2.96  1.17  1.17
assign ( resid   53 and name HN   )   ( resid   53 and name HB   )   2.73  0.93  0.93
assign ( resid   53 and name HA   )   ( resid   53 and name HB   )   2.40  0.61  0.61
assign ( resid   55 and name HN   )   ( resid   55 and name HB2  )   2.57  0.77  0.77
assign ( resid   55 and name HN   )   ( resid   55 and name HB1  )   2.57  0.77  0.77
assign ( resid   56 and name HA   )   ( resid   56 and name HB   )   2.37  0.57  0.57
assign ( resid   60 and name HN   )   ( resid   60 and name HB1  )   2.89  1.09  1.09
assign ( resid    2 and name HB2  )   ( resid    3 and name HN   )   2.91  1.11  1.11
assign ( resid    5 and name HA   )   ( resid    6 and name HN   )   2.64  0.84  0.84
assign ( resid    7 and name HB*  )   ( resid    8 and name HN   )   3.06  1.27  1.27
assign ( resid   11 and name HB2  )   ( resid   12 and name HN   )   3.02  1.22  1.22
assign ( resid   19 and name HA   )   ( resid   20 and name HN   )   2.21  0.41  0.41
assign ( resid   19 and name HB2  )   ( resid   20 and name HN   )   2.94  1.15  1.15
assign ( resid   28 and name HA   )   ( resid   29 and name HN   )   2.26  0.46  0.46
assign ( resid   28 and name HB2  )   ( resid   29 and name HN   )   2.89  1.09  1.09
assign ( resid   29 and name HB1  )   ( resid   30 and name HN   )   2.93  1.13  1.13
assign ( resid   33 and name HB2  )   ( resid   34 and name HN   )   2.69  0.90  0.90
assign ( resid   34 and name HB2  )   ( resid   35 and name HN   )   2.89  1.09  1.09
assign ( resid   36 and name HB2  )   ( resid   37 and name HN   )   3.02  1.22  1.22
assign ( resid   38 and name HN   )   ( resid   38 and name HB2  )   2.73  0.93  0.93
assign ( resid   39 and name HB2  )   ( resid   40 and name HN   )   2.71  0.91  0.91
assign ( resid   39 and name HB1  )   ( resid   40 and name HN   )   2.71  0.91  0.91
assign ( resid   40 and name HA   )   ( resid   41 and name HN   )   2.13  0.34  0.34
assign ( resid   42 and name HA   )   ( resid   43 and name HN   )   2.48  0.68  0.68
assign ( resid   45 and name HA   )   ( resid   46 and name HN   )   2.17  0.37  0.37
assign ( resid   46 and name HA   )   ( resid   47 and name HN   )   2.17  0.37  0.37
assign ( resid   49 and name HB   )   ( resid   50 and name HN   )   2.49  0.70  0.70
assign ( resid   55 and name HB1  )   ( resid   56 and name HN   )   3.32  1.53  1.53
assign ( resid   58 and name HA   )   ( resid   59 and name HN   )   2.46  0.66  0.66
assign ( resid   59 and name HA   )   ( resid   60 and name HN   )   2.40  0.61  0.61
assign ( resid   59 and name HB2  )   ( resid   60 and name HN   )   2.98  1.18  1.18
assign ( resid   59 and name HB1  )   ( resid   60 and name HN   )   2.98  1.18  1.18
assign ( resid    5 and name HA   )   ( resid    8 and name HB1  )   2.67  0.88  0.88
assign ( resid    5 and name HA   )   ( resid    8 and name HB2  )   2.67  0.88  0.88
assign ( resid   40 and name HA   )   ( resid   46 and name HN   )   2.60  0.81  0.81
assign ( resid   40 and name HA   )   ( resid   45 and name HA   )   2.17  0.37  0.37
assign ( resid   36 and name HA   )   ( resid   54 and name HA   )   2.48  0.68  0.68
assign ( resid    5 and name HA   )   ( resid    8 and name HN   )   2.84  1.04  1.04
assign ( resid   30 and name HA   )   ( resid   37 and name HA   )   2.48  0.68  0.68
assign ( resid   24 and name HA   )   ( resid   27 and name HA   )   2.85  1.06  1.06
assign ( resid   32 and name HA   )   ( resid   35 and name HA   )   2.98  1.18  1.18
assign ( resid    6 and name HN   )   ( resid    6 and name HG2  )   3.20  1.40  1.40
assign ( resid    7 and name HA   )   ( resid    7 and name HG   )   2.71  0.91  0.91
assign ( resid    8 and name HA   )   ( resid    8 and name HG   )   2.76  0.97  0.97
assign ( resid   11 and name HB2  )   ( resid   11 and name HG   )   2.28  0.48  0.48
assign ( resid   11 and name HA   )   ( resid   11 and name HG   )   2.82  1.02  1.02
assign ( resid   13 and name HA   )   ( resid   14 and name HD1  )   2.39  0.59  0.59
assign ( resid   15 and name HA   )   ( resid   15 and name HD*  )   4.34  2.54  2.54
assign ( resid   17 and name HA   )   ( resid   17 and name HD2  )   3.21  1.42  1.42
assign ( resid   17 and name HA   )   ( resid   17 and name HD1  )   3.21  1.42  1.42
assign ( resid   21 and name HA   )   ( resid   21 and name HG2  )   2.67  0.88  0.88
assign ( resid   21 and name HG1  )   ( resid   22 and name HN   )   3.05  1.26  1.26
assign ( resid   21 and name HA   )   ( resid   21 and name HG1  )   2.67  0.88  0.88
assign ( resid   23 and name HA   )   ( resid   23 and name HG   )   2.82  1.02  1.02
assign ( resid   23 and name HN   )   ( resid   23 and name HG   )   3.18  1.38  1.38
assign ( resid   24 and name HN   )   ( resid   24 and name HG2  )   3.74  1.94  1.94
assign ( resid   24 and name HN   )   ( resid   24 and name HG1  )   3.74  1.94  1.94
assign ( resid   26 and name HA   )   ( resid   26 and name HG2  )   2.76  0.97  0.97
assign ( resid   26 and name HA   )   ( resid   26 and name HG1  )   2.76  0.97  0.97
assign ( resid   27 and name HN   )   ( resid   27 and name HG1  )   3.25  1.45  1.45
assign ( resid   28 and name HA   )   ( resid   28 and name HG   )   2.69  0.90  0.90
assign ( resid   28 and name HB2  )   ( resid   28 and name HG   )   2.39  0.59  0.59
assign ( resid   29 and name HA   )   ( resid   29 and name HG   )   2.84  1.04  1.04
assign ( resid   32 and name HA   )   ( resid   32 and name HG2  )   2.80  1.00  1.00
assign ( resid   32 and name HA   )   ( resid   32 and name HG1  )   2.80  1.00  1.00
assign ( resid   33 and name HA   )   ( resid   33 and name HG2  )   2.69  0.90  0.90
assign ( resid   33 and name HA   )   ( resid   33 and name HG1  )   2.69  0.90  0.90
assign ( resid   34 and name HA   )   ( resid   34 and name HG   )   2.71  0.91  0.91
assign ( resid   31 and name HB2  )   ( resid   38 and name HE*  )   4.89  3.10  3.10
assign ( resid   31 and name HB1  )   ( resid   38 and name HE*  )   4.89  3.10  3.10
assign ( resid   39 and name HA   )   ( resid   39 and name HG2  )   2.93  1.13  1.13
assign ( resid   39 and name HA   )   ( resid   39 and name HG1  )   2.93  1.13  1.13
assign ( resid   40 and name HA   )   ( resid   40 and name HG12 )   2.73  0.93  0.93
assign ( resid   40 and name HA   )   ( resid   40 and name HG11 )   2.73  0.93  0.93
assign ( resid   44 and name HN   )   ( resid   44 and name HG11 )   3.09  1.29  1.29
assign ( resid   47 and name HA   )   ( resid   47 and name HG   )   2.94  1.15  1.15
assign ( resid   48 and name HB2  )   ( resid   48 and name HG   )   2.39  0.59  0.59
assign ( resid   48 and name HB1  )   ( resid   48 and name HG   )   2.39  0.59  0.59
assign ( resid   48 and name HN   )   ( resid   48 and name HG   )   2.94  1.15  1.15
assign ( resid   48 and name HA   )   ( resid   48 and name HG   )   3.03  1.24  1.24
assign ( resid   49 and name HA   )   ( resid   49 and name HG12 )   2.89  1.09  1.09
assign ( resid   49 and name HA   )   ( resid   49 and name HG11 )   2.89  1.09  1.09
assign ( resid   49 and name HN   )   ( resid   49 and name HG11 )   3.16  1.36  1.36
assign ( resid   55 and name HA   )   ( resid   55 and name HD1  )   3.30  1.51  1.51
assign ( resid    3 and name HG   )   ( resid    4 and name HN   )   3.86  2.07  2.07
assign ( resid   29 and name HB2  )   ( resid   38 and name HN   )   3.90  2.10  2.10
assign ( resid   29 and name HG   )   ( resid   30 and name HN   )   3.90  2.10  2.10
assign ( resid   54 and name HG1  )   ( resid   55 and name HN   )   3.61  1.81  1.81
assign ( resid   55 and name HD1  )   ( resid   56 and name HN   )   3.20  1.40  1.40
assign ( resid    4 and name HB2  )   ( resid    7 and name HB*  )   4.34  2.54  2.54
assign ( resid   29 and name HB2  )   ( resid   38 and name HB2  )   3.00  1.20  1.20
assign ( resid   45 and name HB*  )   ( resid   47 and name HG   )   3.15  1.36  1.36
assign ( resid   48 and name HB2  )   ( resid   51 and name HB2  )   4.18  2.39  2.39
assign ( resid   48 and name HB2  )   ( resid   51 and name HB1  )   4.18  2.39  2.39
assign ( resid   48 and name HB2  )   ( resid   51 and name HG2  )   3.82  2.03  2.03
assign ( resid   48 and name HB2  )   ( resid   51 and name HG1  )   3.82  2.03  2.03
assign ( resid   13 and name HA   )   ( resid   14 and name HD2  )   2.39  0.59  0.59
assign ( resid   18 and name HA2  )   ( resid   19 and name HD1  )   2.87  1.08  1.08
assign ( resid   20 and name HB1  )   ( resid   29 and name HB1  )   2.64  0.84  0.84
assign ( resid   22 and name HD*  )   ( resid   29 and name HG   )   4.57  2.77  2.77
assign ( resid   22 and name HE*  )   ( resid   27 and name HA   )   4.35  2.56  2.56
assign ( resid   22 and name HE*  )   ( resid   24 and name HB1  )   4.51  2.72  2.72
assign ( resid   23 and name HB2  )   ( resid   28 and name HB2  )   3.27  1.47  1.47
assign ( resid   23 and name HB1  )   ( resid   28 and name HN   )   3.48  1.69  1.69
assign ( resid   23 and name HB2  )   ( resid   28 and name HN   )   3.48  1.69  1.69
assign ( resid   24 and name HA   )   ( resid   27 and name HE22 )   3.32  1.53  1.53
assign ( resid   21 and name HB*  )   ( resid   30 and name HB   )   3.38  1.59  1.59
assign ( resid   33 and name HB2  )   ( resid   33 and name HE   )   3.45  1.65  1.65
assign ( resid   33 and name HB1  )   ( resid   33 and name HE   )   3.45  1.65  1.65
assign ( resid   15 and name HE*  )   ( resid   34 and name HB1  )   3.74  1.95  1.95
assign ( resid   29 and name HB2  )   ( resid   38 and name HB1  )   3.00  1.20  1.20
assign ( resid   38 and name HE*  )   ( resid   49 and name HA   )   4.26  2.47  2.47
assign ( resid   14 and name HG2  )   ( resid   38 and name HE*  )   4.80  3.01  3.01
assign ( resid   14 and name HG1  )   ( resid   38 and name HE*  )   4.80  3.01  3.01
assign ( resid   40 and name HA   )   ( resid   45 and name HB*  )   3.94  2.15  2.15
assign ( resid    4 and name HB1  )   ( resid    7 and name HB*  )   4.34  2.54  2.54
assign ( resid   39 and name HN   )   ( resid   46 and name HB   )   3.48  1.69  1.69
assign ( resid   48 and name HB1  )   ( resid   51 and name HG2  )   3.82  2.03  2.03
assign ( resid   56 and name HA   )   ( resid   57 and name HD1  )   2.49  0.70  0.70
assign ( resid   56 and name HA   )   ( resid   57 and name HD2  )   2.49  0.70  0.70
assign ( resid    8 and name HA   )   ( resid   11 and name HG   )   3.45  1.65  1.65
assign ( resid   27 and name HB1  )   ( resid   40 and name HB   )   2.85  1.06  1.06
assign ( resid   27 and name HB2  )   ( resid   40 and name HB   )   3.20  1.40  1.40
assign ( resid   31 and name HD21 )   ( resid   34 and name HB2  )   3.56  1.76  1.76
assign ( resid   29 and name HN   )   ( resid   38 and name HB1  )   3.36  1.56  1.56
assign ( resid    4 and name HA   )   ( resid    5 and name HD2  )   2.31  0.52  0.52
assign ( resid    4 and name HA   )   ( resid    5 and name HD1  )   2.31  0.52  0.52
assign ( resid   22 and name HE*  )   ( resid   24 and name HA   )   4.44  2.65  2.65
assign ( resid   38 and name HD*  )   ( resid   47 and name HA   )   4.75  2.95  2.95
assign ( resid   44 and name HA   )   ( resid   45 and name HD1  )   2.46  0.66  0.66
assign ( resid   44 and name HA   )   ( resid   45 and name HD2  )   2.46  0.66  0.66
assign ( resid   40 and name HG12 )   ( resid   45 and name HA   )   2.91  1.11  1.11
assign ( resid   40 and name HG11 )   ( resid   45 and name HA   )   2.91  1.11  1.11
assign ( resid   18 and name HA1  )   ( resid   19 and name HD1  )   2.87  1.08  1.08
assign ( resid   12 and name HA   )   ( resid   20 and name HG   )   2.49  0.70  0.70
assign ( resid   23 and name HB1  )   ( resid   28 and name HB2  )   3.27  1.47  1.47
assign ( resid   18 and name HA2  )   ( resid   19 and name HD2  )   2.87  1.08  1.08
assign ( resid   18 and name HA1  )   ( resid   19 and name HD2  )   2.87  1.08  1.08
assign ( resid   14 and name HG1  )   ( resid   49 and name HA   )   3.90  2.10  2.10
assign ( resid   14 and name HG2  )   ( resid   49 and name HA   )   3.90  2.10  2.10
assign ( resid    3 and name HA   )   ( resid    3 and name HD1* )   3.11  1.32  1.32
assign ( resid    3 and name HA   )   ( resid    3 and name HD2* )   3.13  1.33  1.33
assign ( resid    7 and name HA   )   ( resid    7 and name HD1* )   3.09  1.30  1.30
assign ( resid    7 and name HA   )   ( resid    7 and name HD2* )   3.11  1.32  1.32
assign ( resid    8 and name HA   )   ( resid    8 and name HD1* )   3.00  1.21  1.21
assign ( resid    8 and name HA   )   ( resid    8 and name HD2* )   2.91  1.12  1.12
assign ( resid    8 and name HN   )   ( resid    8 and name HD2* )   3.65  1.86  1.86
assign ( resid   10 and name HN   )   ( resid   10 and name HG2* )   2.61  0.81  0.81
assign ( resid   11 and name HA   )   ( resid   11 and name HD1* )   3.42  1.62  1.62
assign ( resid   11 and name HA   )   ( resid   11 and name HD2* )   2.61  0.81  0.81
assign ( resid   11 and name HB1  )   ( resid   11 and name HD1* )   2.61  0.81  0.81
assign ( resid   11 and name HB1  )   ( resid   11 and name HD2* )   2.75  0.96  0.96
assign ( resid   20 and name HB1  )   ( resid   20 and name HD2* )   2.64  0.85  0.85
assign ( resid   20 and name HN   )   ( resid   20 and name HD1* )   3.54  1.75  1.75
assign ( resid   20 and name HA   )   ( resid   20 and name HD1* )   3.56  1.77  1.77
assign ( resid   20 and name HB1  )   ( resid   20 and name HD1* )   2.70  0.90  0.90
assign ( resid   20 and name HB2  )   ( resid   20 and name HD1* )   2.61  0.81  0.81
assign ( resid   20 and name HA   )   ( resid   20 and name HD2* )   2.68  0.88  0.88
assign ( resid   23 and name HA   )   ( resid   23 and name HD1* )   3.49  1.69  1.69
assign ( resid   28 and name HN   )   ( resid   28 and name HD2* )   3.65  1.86  1.86
assign ( resid   28 and name HA   )   ( resid   28 and name HD2* )   2.70  0.90  0.90
assign ( resid   28 and name HA   )   ( resid   28 and name HD1* )   3.79  2.00  2.00
assign ( resid   29 and name HA   )   ( resid   29 and name HD1* )   4.10  2.31  2.31
assign ( resid   29 and name HA   )   ( resid   29 and name HD2* )   2.61  0.81  0.81
assign ( resid   29 and name HB1  )   ( resid   29 and name HD2* )   2.77  0.97  0.97
assign ( resid   29 and name HN   )   ( resid   29 and name HD1* )   3.56  1.77  1.77
assign ( resid   30 and name HN   )   ( resid   30 and name HG2* )   2.81  1.01  1.01
assign ( resid   34 and name HA   )   ( resid   34 and name HD1* )   3.49  1.69  1.69
assign ( resid   34 and name HB2  )   ( resid   34 and name HD1* )   2.61  0.81  0.81
assign ( resid   34 and name HB1  )   ( resid   34 and name HD2* )   2.61  0.81  0.81
assign ( resid   34 and name HA   )   ( resid   34 and name HD2* )   2.62  0.83  0.83
assign ( resid   40 and name HB   )   ( resid   40 and name HD1* )   2.73  0.94  0.94
assign ( resid   40 and name HA   )   ( resid   40 and name HG2* )   2.66  0.87  0.87
assign ( resid   40 and name HN   )   ( resid   40 and name HD1* )   3.87  2.07  2.07
assign ( resid   44 and name HA   )   ( resid   44 and name HG2* )   2.64  0.85  0.85
assign ( resid   44 and name HG2* )   ( resid   44 and name HD1* )   3.12  1.32  1.32
assign ( resid   46 and name HA   )   ( resid   46 and name HG1* )   2.61  0.81  0.81
assign ( resid   46 and name HN   )   ( resid   46 and name HG2* )   2.70  0.90  0.90
assign ( resid   46 and name HA   )   ( resid   46 and name HG2* )   2.62  0.83  0.83
assign ( resid   47 and name HA   )   ( resid   47 and name HD2* )   2.72  0.92  0.92
assign ( resid   47 and name HN   )   ( resid   47 and name HD1* )   3.67  1.87  1.87
assign ( resid   47 and name HA   )   ( resid   47 and name HD1* )   3.47  1.68  1.68
assign ( resid   47 and name HB2  )   ( resid   47 and name HD1* )   2.77  0.97  0.97
assign ( resid   48 and name HN   )   ( resid   48 and name HD1* )   4.41  2.61  2.61
assign ( resid   48 and name HA   )   ( resid   48 and name HD1* )   3.35  1.55  1.55
assign ( resid   48 and name HN   )   ( resid   48 and name HD2* )   4.41  2.61  2.61
assign ( resid   49 and name HA   )   ( resid   49 and name HG2* )   2.77  0.97  0.97
assign ( resid   49 and name HB   )   ( resid   49 and name HD1* )   2.70  0.90  0.90
assign ( resid   28 and name HD1* )   ( resid   55 and name HH2  )   3.38  1.59  1.59
assign ( resid   60 and name HN   )   ( resid   60 and name HD2* )   4.41  2.61  2.61
assign ( resid   60 and name HA   )   ( resid   60 and name HD2* )   3.44  1.64  1.64
assign ( resid   10 and name HG2* )   ( resid   11 and name HN   )   3.40  1.60  1.60
assign ( resid   28 and name HD2* )   ( resid   29 and name HN   )   3.38  1.59  1.59
assign ( resid   46 and name HG1* )   ( resid   47 and name HN   )   3.72  1.93  1.93
assign ( resid   47 and name HD2* )   ( resid   48 and name HN   )   3.87  2.07  2.07
assign ( resid   48 and name HD1* )   ( resid   49 and name HN   )   4.24  2.45  2.45
assign ( resid   48 and name HD2* )   ( resid   49 and name HN   )   4.24  2.45  2.45
assign ( resid    5 and name HA   )   ( resid    8 and name HD1* )   3.13  1.33  1.33
assign ( resid   12 and name HB*  )   ( resid   17 and name HA   )   2.70  0.90  0.90
assign ( resid   13 and name HA   )   ( resid   20 and name HD2* )   2.86  1.06  1.06
assign ( resid   13 and name HA   )   ( resid   20 and name HD1* )   3.11  1.32  1.32
assign ( resid   15 and name HB2  )   ( resid   34 and name HD1* )   3.08  1.28  1.28
assign ( resid   26 and name HB2  )   ( resid   28 and name HD1* )   2.97  1.17  1.17
assign ( resid   26 and name HB1  )   ( resid   28 and name HD1* )   2.97  1.17  1.17
assign ( resid   28 and name HD2* )   ( resid   39 and name HA   )   2.73  0.94  0.94
assign ( resid   20 and name HD1* )   ( resid   29 and name HB2  )   3.20  1.41  1.41
assign ( resid   30 and name HG2* )   ( resid   37 and name HA   )   3.13  1.33  1.33
assign ( resid   28 and name HD1* )   ( resid   30 and name HG2* )   3.82  2.02  2.02
assign ( resid   21 and name HB*  )   ( resid   30 and name HG1* )   4.52  2.73  2.73
assign ( resid   30 and name HA   )   ( resid   37 and name HB*  )   3.18  1.39  1.39
assign ( resid   30 and name HG2* )   ( resid   37 and name HB*  )   3.93  2.13  2.13
assign ( resid   30 and name HG1* )   ( resid   37 and name HB*  )   4.05  2.26  2.26
assign ( resid   37 and name HB*  )   ( resid   38 and name HD*  )   4.80  3.01  3.01
assign ( resid   38 and name HB2  )   ( resid   47 and name HD2* )   3.45  1.66  1.66
assign ( resid   38 and name HB1  )   ( resid   47 and name HD2* )   3.45  1.66  1.66
assign ( resid   28 and name HA   )   ( resid   40 and name HD1* )   3.60  1.80  1.80
assign ( resid   40 and name HD1* )   ( resid   45 and name HB*  )   3.84  2.05  2.05
assign ( resid   11 and name HD1* )   ( resid   45 and name HG2  )   3.85  2.05  2.05
assign ( resid   41 and name HN   )   ( resid   46 and name HG2* )   2.88  1.08  1.08
assign ( resid   45 and name HB*  )   ( resid   47 and name HD2* )   3.82  2.03  2.03
assign ( resid   15 and name HA   )   ( resid   49 and name HD1* )   3.27  1.48  1.48
assign ( resid    9 and name HA   )   ( resid   10 and name HG2* )   3.18  1.39  1.39
assign ( resid   11 and name HB1  )   ( resid   20 and name HD1* )   3.00  1.21  1.21
assign ( resid   13 and name HA   )   ( resid   47 and name HD2* )   3.72  1.93  1.93
assign ( resid   20 and name HD1* )   ( resid   29 and name HB1  )   3.02  1.23  1.23
assign ( resid   12 and name HA   )   ( resid   20 and name HD1* )   3.08  1.28  1.28
assign ( resid   28 and name HB1  )   ( resid   30 and name HG2* )   3.58  1.78  1.78
assign ( resid   41 and name HB2  )   ( resid   46 and name HG2* )   3.13  1.33  1.33
assign ( resid   20 and name HD1* )   ( resid   47 and name HD2* )   3.64  1.84  1.84
assign ( resid    9 and name HB*  )   ( resid   10 and name HG2* )   4.07  2.28  2.28
assign ( resid   11 and name HA   )   ( resid   12 and name HB*  )   3.56  1.77  1.77
assign ( resid   14 and name HG2  )   ( resid   49 and name HD1* )   3.87  2.07  2.07
assign ( resid   14 and name HG1  )   ( resid   49 and name HD1* )   3.87  2.07  2.07
assign ( resid   20 and name HD2* )   ( resid   38 and name HE*  )   4.36  2.56  2.56
assign ( resid   20 and name HD2* )   ( resid   38 and name HD*  )   4.50  2.70  2.70
assign ( resid   13 and name HB1  )   ( resid   20 and name HD2* )   3.31  1.51  1.51
assign ( resid   11 and name HB2  )   ( resid   20 and name HD1* )   3.56  1.77  1.77
assign ( resid   22 and name HB1  )   ( resid   29 and name HD2* )   3.45  1.66  1.66
assign ( resid   22 and name HB2  )   ( resid   29 and name HD2* )   3.08  1.28  1.28
assign ( resid   22 and name HD*  )   ( resid   29 and name HD2* )   4.00  2.20  2.20
assign ( resid   22 and name HE*  )   ( resid   40 and name HD1* )   3.94  2.15  2.15
assign ( resid   29 and name HG   )   ( resid   40 and name HD1* )   2.66  0.87  0.87
assign ( resid   30 and name HG2* )   ( resid   55 and name HD1  )   4.41  2.61  2.61
assign ( resid   30 and name HG1* )   ( resid   37 and name HA   )   3.54  1.75  1.75
assign ( resid   23 and name HG   )   ( resid   30 and name HG2* )   4.01  2.22  2.22
assign ( resid   21 and name HB*  )   ( resid   30 and name HG2* )   3.62  1.83  1.83
assign ( resid   20 and name HD2* )   ( resid   31 and name HB2  )   3.34  1.55  1.55
assign ( resid   20 and name HD2* )   ( resid   31 and name HB1  )   3.34  1.55  1.55
assign ( resid   30 and name HG1* )   ( resid   32 and name HA   )   3.34  1.55  1.55
assign ( resid   23 and name HA   )   ( resid   23 and name HD2* )   3.49  1.69  1.69
assign ( resid   37 and name HB*  )   ( resid   55 and name HB1  )   3.02  1.23  1.23
assign ( resid   37 and name HB*  )   ( resid   55 and name HE3  )   3.74  1.95  1.95
assign ( resid   22 and name HD*  )   ( resid   40 and name HD1* )   4.36  2.56  2.56
assign ( resid   40 and name HG2* )   ( resid   45 and name HA   )   3.27  1.48  1.48
assign ( resid   40 and name HG2* )   ( resid   44 and name HA   )   3.38  1.59  1.59
assign ( resid   27 and name HB1  )   ( resid   40 and name HG2* )   3.38  1.59  1.59
assign ( resid   27 and name HA   )   ( resid   40 and name HD1* )   3.06  1.26  1.26
assign ( resid   27 and name HB1  )   ( resid   40 and name HD1* )   3.24  1.44  1.44
assign ( resid   40 and name HA   )   ( resid   46 and name HG2* )   3.36  1.57  1.57
assign ( resid   41 and name HB1  )   ( resid   46 and name HG2* )   3.13  1.33  1.33
assign ( resid   40 and name HG2* )   ( resid   43 and name HA2  )   3.42  1.62  1.62
assign ( resid   40 and name HG2* )   ( resid   43 and name HA1  )   3.42  1.62  1.62
assign ( resid   44 and name HG2* )   ( resid   45 and name HD2  )   3.54  1.75  1.75
assign ( resid   44 and name HG2* )   ( resid   45 and name HD1  )   3.54  1.75  1.75
assign ( resid   40 and name HD1* )   ( resid   45 and name HA   )   3.71  1.91  1.91
assign ( resid   49 and name HG2* )   ( resid   50 and name HA   )   3.36  1.57  1.57
assign ( resid   46 and name HG1* )   ( resid   51 and name HB2  )   3.04  1.24  1.24
assign ( resid   46 and name HG1* )   ( resid   51 and name HB1  )   3.04  1.24  1.24
assign ( resid   36 and name HD2* )   ( resid   52 and name HB*  )   3.49  1.70  1.70
assign ( resid   49 and name HA   )   ( resid   52 and name HB*  )   3.31  1.51  1.51
assign ( resid   38 and name HE*  )   ( resid   52 and name HB*  )   4.27  2.47  2.47
assign ( resid   37 and name HN   )   ( resid   52 and name HB*  )   3.78  1.98  1.98
assign ( resid   37 and name HB*  )   ( resid   55 and name HB2  )   3.02  1.23  1.23
assign ( resid   37 and name HB*  )   ( resid   55 and name HD1  )   3.34  1.55  1.55
assign ( resid   36 and name HA   )   ( resid   52 and name HB*  )   4.05  2.25  2.25
assign ( resid   30 and name HG1* )   ( resid   55 and name HD1  )   3.42  1.62  1.62
assign ( resid   28 and name HD1* )   ( resid   55 and name HD1  )   3.81  2.02  2.02
assign ( resid   28 and name HD1* )   ( resid   55 and name HZ3  )   3.81  2.02  2.02
assign ( resid   28 and name HD1* )   ( resid   55 and name HZ2  )   2.98  1.19  1.19
assign ( resid   13 and name HB2  )   ( resid   20 and name HD2* )   3.31  1.51  1.51
assign ( resid   38 and name HD*  )   ( resid   47 and name HD2* )   5.13  3.33  3.33
assign ( resid   20 and name HD2* )   ( resid   47 and name HD2* )   4.11  2.31  2.31
assign ( resid   42 and name HB2  )   ( resid   44 and name HD1* )   4.41  2.61  2.61
assign ( resid   42 and name HB1  )   ( resid   44 and name HD1* )   4.41  2.61  2.61
assign ( resid   15 and name HE*  )   ( resid   34 and name HD1* )   4.85  3.05  3.05
assign ( resid   22 and name HA   )   ( resid   29 and name HD2* )   2.66  0.87  0.87
assign ( resid   15 and name HD*  )   ( resid   34 and name HD1* )   3.82  2.03  2.03
assign ( resid   15 and name HB1  )   ( resid   34 and name HD1* )   3.08  1.28  1.28
assign ( resid    8 and name HA   )   ( resid   11 and name HD1* )   3.38  1.59  1.59
assign ( resid    8 and name HD2* )   ( resid   22 and name HD*  )   5.13  3.33  3.33
assign ( resid    8 and name HD2* )   ( resid   22 and name HB1  )   4.19  2.40  2.40
assign ( resid    8 and name HD2* )   ( resid   22 and name HB2  )   3.47  1.68  1.68
assign ( resid    8 and name HD1* )   ( resid   22 and name HD*  )   5.06  3.26  3.26
assign ( resid   11 and name HD1* )   ( resid   45 and name HG1  )   3.85  2.05  2.05
assign ( resid   36 and name HN   )   ( resid   36 and name HD1* )   3.99  2.20  2.20
assign ( resid   29 and name HD1* )   ( resid   47 and name HD2* )   4.05  2.26  2.26
assign ( resid   40 and name HG2* )   ( resid   45 and name HG2  )   3.90  2.11  2.11
assign ( resid   40 and name HG2* )   ( resid   45 and name HG1  )   3.90  2.11  2.11
assign ( resid   40 and name HD1* )   ( resid   45 and name HG2  )   4.16  2.36  2.36
assign ( resid   40 and name HD1* )   ( resid   45 and name HG1  )   4.16  2.36  2.36
assign ( resid   20 and name HD2* )   ( resid   31 and name HA   )   2.79  0.99  0.99
assign ( resid   60 and name HA   )   ( resid   60 and name HD1* )   3.44  1.64  1.64
assign ( resid   48 and name HA   )   ( resid   48 and name HD2* )   3.35  1.55  1.55
assign ( resid   29 and name HD1* )   ( resid   45 and name HB*  )   3.19  1.40  1.40
assign ( resid   36 and name HA   )   ( resid   36 and name HD1* )   3.70  1.91  1.91
assign ( resid   34 and name HB1  )   ( resid   34 and name HD1* )   2.61  0.81  0.81
assign ( resid    7 and name HN   )   ( resid    7 and name HD1* )   4.03  2.23  2.23
assign ( resid   36 and name HA   )   ( resid   36 and name HD2* )   2.61  0.81  0.81
assign ( resid   36 and name HB1  )   ( resid   36 and name HD1* )   2.64  0.85  0.85
assign ( resid   28 and name HD1* )   ( resid   37 and name HB*  )   4.16  2.37  2.37
assign ( resid   15 and name HG*  )   ( resid   49 and name HD1* )   4.42  2.62  2.62
assign ( resid   15 and name HE*  )   ( resid   49 and name HG2* )   3.84  2.04  2.04
assign ( resid   23 and name HD1* )   ( resid   55 and name HE1  )   3.98  2.18  2.18
assign ( resid   23 and name HD2* )   ( resid   55 and name HE1  )   3.98  2.18  2.18
assign ( resid    2 and name HN   )   ( resid    2 and name HB*  )   2.77  0.97  0.97
assign ( resid    4 and name HA   )   ( resid    5 and name HD*  )   2.20  0.41  0.41
assign ( resid    4 and name HB*  )   ( resid    7 and name HN   )   3.13  1.34  1.34
assign ( resid    4 and name HB*  )   ( resid    7 and name HD1* )   3.41  1.61  1.61
assign ( resid    5 and name HA   )   ( resid    8 and name HB*  )   2.56  0.77  0.77
assign ( resid    5 and name HB*  )   ( resid    6 and name HN   )   3.05  1.25  1.25
assign ( resid    5 and name HG*  )   ( resid    6 and name HN   )   3.38  1.59  1.59
assign ( resid    5 and name HD*  )   ( resid    6 and name HN   )   3.26  1.46  1.46
assign ( resid    6 and name HN   )   ( resid    6 and name HG*  )   3.13  1.33  1.33
assign ( resid    6 and name HA   )   ( resid    6 and name HE2* )   3.55  1.76  1.76
assign ( resid    8 and name HN   )   ( resid    8 and name HB*  )   2.58  0.78  0.78
assign ( resid    8 and name HB*  )   ( resid    9 and name HN   )   2.82  1.02  1.02
assign ( resid    9 and name HN   )   ( resid    9 and name HG*  )   3.29  1.49  1.49
assign ( resid   11 and name HD1* )   ( resid   45 and name HG*  )   3.49  1.70  1.70
assign ( resid   11 and name HD2* )   ( resid   45 and name HD*  )   3.97  2.17  2.17
assign ( resid   12 and name HB*  )   ( resid   17 and name HG*  )   3.96  2.17  2.17
assign ( resid   13 and name HA   )   ( resid   14 and name HD*  )   2.27  0.48  0.48
assign ( resid   13 and name HB*  )   ( resid   15 and name HN   )   3.42  1.62  1.62
assign ( resid   13 and name HB*  )   ( resid   16 and name HN   )   2.93  1.14  1.14
assign ( resid   13 and name HB*  )   ( resid   17 and name HN   )   2.79  0.99  0.99
assign ( resid   13 and name HB*  )   ( resid   18 and name HN   )   2.89  1.09  1.09
assign ( resid   13 and name HB*  )   ( resid   20 and name HG   )   4.10  2.31  2.31
assign ( resid   13 and name HB*  )   ( resid   20 and name HD1* )   4.85  3.05  3.05
assign ( resid   13 and name HB*  )   ( resid   20 and name HD2* )   2.94  1.15  1.15
assign ( resid   13 and name HB*  )   ( resid   31 and name HD2* )   3.72  1.92  1.92
assign ( resid   13 and name HB1  )   ( resid   31 and name HD21 )   4.45  2.66  2.66
assign ( resid   13 and name HB1  )   ( resid   31 and name HD22 )   4.45  2.66  2.66
assign ( resid   14 and name HA   )   ( resid   49 and name HG1* )   4.00  2.20  2.20
assign ( resid   14 and name HB*  )   ( resid   47 and name HB1  )   3.31  1.52  1.52
assign ( resid   14 and name HB*  )   ( resid   49 and name HN   )   4.34  2.54  2.54
assign ( resid   14 and name HB*  )   ( resid   49 and name HG1* )   4.40  2.60  2.60
assign ( resid   14 and name HB*  )   ( resid   49 and name HD1* )   4.13  2.33  2.33
assign ( resid   14 and name HG*  )   ( resid   15 and name HN   )   3.54  1.74  1.74
assign ( resid   14 and name HG*  )   ( resid   38 and name HE*  )   4.62  2.82  2.82
assign ( resid   14 and name HG*  )   ( resid   48 and name HN   )   3.60  1.81  1.81
assign ( resid   14 and name HG*  )   ( resid   49 and name HN   )   3.11  1.32  1.32
assign ( resid   14 and name HG*  )   ( resid   49 and name HD1* )   3.65  1.85  1.85
assign ( resid   14 and name HG*  )   ( resid   52 and name HB*  )   3.97  2.17  2.17
assign ( resid   14 and name HD*  )   ( resid   15 and name HN   )   3.43  1.64  1.64
assign ( resid   14 and name HD*  )   ( resid   47 and name HA   )   3.55  1.76  1.76
assign ( resid   14 and name HD*  )   ( resid   47 and name HB2  )   3.96  2.17  2.17
assign ( resid   14 and name HD*  )   ( resid   47 and name HB1  )   3.41  1.61  1.61
assign ( resid   14 and name HD*  )   ( resid   47 and name HD1* )   4.85  3.06  3.06
assign ( resid   14 and name HD*  )   ( resid   47 and name HD2* )   3.45  1.65  1.65
assign ( resid   15 and name HN   )   ( resid   15 and name HB*  )   2.65  0.86  0.86
assign ( resid   15 and name HB*  )   ( resid   16 and name HN   )   2.46  0.67  0.67
assign ( resid   15 and name HB*  )   ( resid   31 and name HD2* )   3.80  2.00  2.00
assign ( resid   15 and name HB1  )   ( resid   31 and name HD21 )   4.56  2.77  2.77
assign ( resid   15 and name HB1  )   ( resid   31 and name HD22 )   4.56  2.77  2.77
assign ( resid   15 and name HB*  )   ( resid   34 and name HD1* )   2.99  1.19  1.19
assign ( resid   15 and name HB*  )   ( resid   49 and name HG1* )   4.74  2.95  2.95
assign ( resid   15 and name HE*  )   ( resid   49 and name HG1* )   3.82  2.03  2.03
assign ( resid   16 and name HN   )   ( resid   16 and name HB*  )   2.73  0.93  0.93
assign ( resid   16 and name HA   )   ( resid   16 and name HB*  )   2.23  0.44  0.44
assign ( resid   16 and name HB*  )   ( resid   31 and name HD2* )   4.35  2.56  2.56
assign ( resid   16 and name HB*  )   ( resid   34 and name HD1* )   3.30  1.50  1.50
assign ( resid   16 and name HB*  )   ( resid   34 and name HD2* )   3.71  1.92  1.92
assign ( resid   17 and name HN   )   ( resid   17 and name HG*  )   3.35  1.56  1.56
assign ( resid   17 and name HN   )   ( resid   17 and name HD*  )   3.60  1.80  1.80
assign ( resid   17 and name HA   )   ( resid   17 and name HD*  )   3.09  1.29  1.29
assign ( resid   18 and name HA*  )   ( resid   19 and name HD*  )   2.39  0.60  0.60
assign ( resid   19 and name HB*  )   ( resid   20 and name HN   )   2.81  1.02  1.02
assign ( resid   20 and name HD2* )   ( resid   31 and name HB*  )   3.01  1.22  1.22
assign ( resid   21 and name HA   )   ( resid   21 and name HG*  )   2.55  0.76  0.76
assign ( resid   21 and name HG*  )   ( resid   22 and name HN   )   2.89  1.10  1.10
assign ( resid   22 and name HE*  )   ( resid   24 and name HG*  )   5.40  3.61  3.61
assign ( resid   23 and name HN   )   ( resid   23 and name HB*  )   2.47  0.67  0.67
assign ( resid   23 and name HA   )   ( resid   23 and name HD*  )   3.00  1.20  1.20
assign ( resid   23 and name HB*  )   ( resid   28 and name HN   )   3.24  1.45  1.45
assign ( resid   23 and name HB*  )   ( resid   28 and name HB2  )   3.01  1.21  1.21
assign ( resid   23 and name HB*  )   ( resid   28 and name HD1* )   4.27  2.48  2.48
assign ( resid   23 and name HD*  )   ( resid   24 and name HN   )   4.32  2.52  2.52
assign ( resid   23 and name HD*  )   ( resid   28 and name HN   )   5.06  3.26  3.26
assign ( resid   23 and name HD*  )   ( resid   30 and name HG2* )   5.42  3.63  3.63
assign ( resid   23 and name HD*  )   ( resid   55 and name HE1  )   3.85  2.06  2.06
assign ( resid   24 and name HN   )   ( resid   24 and name HG*  )   3.43  1.64  1.64
assign ( resid   24 and name HA   )   ( resid   24 and name HG*  )   2.86  1.06  1.06
assign ( resid   24 and name HA   )   ( resid   27 and name HE2* )   3.26  1.46  1.46
assign ( resid   25 and name HN   )   ( resid   25 and name HB*  )   2.67  0.87  0.87
assign ( resid   26 and name HN   )   ( resid   26 and name HB*  )   2.70  0.90  0.90
assign ( resid   26 and name HN   )   ( resid   26 and name HG*  )   3.12  1.32  1.32
assign ( resid   26 and name HA   )   ( resid   26 and name HG*  )   2.59  0.79  0.79
assign ( resid   26 and name HB*  )   ( resid   28 and name HN   )   3.27  1.48  1.48
assign ( resid   26 and name HB*  )   ( resid   28 and name HB2  )   3.24  1.44  1.44
assign ( resid   26 and name HB*  )   ( resid   28 and name HB1  )   4.14  2.34  2.34
assign ( resid   26 and name HB*  )   ( resid   28 and name HG   )   3.26  1.46  1.46
assign ( resid   26 and name HB*  )   ( resid   28 and name HD1* )   2.83  1.04  1.04
assign ( resid   26 and name HG*  )   ( resid   28 and name HD1* )   4.18  2.39  2.39
assign ( resid   27 and name HN   )   ( resid   27 and name HG*  )   3.05  1.25  1.25
assign ( resid   27 and name HA   )   ( resid   27 and name HE2* )   4.33  2.53  2.53
assign ( resid   28 and name HA   )   ( resid   40 and name HG1* )   4.07  2.27  2.27
assign ( resid   29 and name HN   )   ( resid   38 and name HB*  )   3.26  1.47  1.47
assign ( resid   29 and name HN   )   ( resid   40 and name HG1* )   4.16  2.36  2.36
assign ( resid   29 and name HB2  )   ( resid   38 and name HB*  )   2.84  1.05  1.05
assign ( resid   29 and name HB1  )   ( resid   38 and name HB*  )   3.60  1.80  1.80
assign ( resid   29 and name HD1* )   ( resid   45 and name HG*  )   3.47  1.67  1.67
assign ( resid   29 and name HD2* )   ( resid   38 and name HB*  )   4.67  2.87  2.87
assign ( resid   30 and name HG1* )   ( resid   31 and name HB*  )   4.50  2.71  2.71
assign ( resid   31 and name HN   )   ( resid   31 and name HB*  )   2.40  0.60  0.60
assign ( resid   31 and name HB*  )   ( resid   34 and name HB1  )   3.85  2.06  2.06
assign ( resid   31 and name HB*  )   ( resid   34 and name HD1* )   4.65  2.85  2.85
assign ( resid   31 and name HB*  )   ( resid   35 and name HN   )   3.60  1.80  1.80
assign ( resid   31 and name HB*  )   ( resid   36 and name HN   )   3.07  1.27  1.27
assign ( resid   31 and name HB*  )   ( resid   36 and name HB2  )   3.04  1.25  1.25
assign ( resid   31 and name HB*  )   ( resid   36 and name HB1  )   3.98  2.18  2.18
assign ( resid   31 and name HB*  )   ( resid   38 and name HE*  )   4.81  3.01  3.01
assign ( resid   31 and name HD2* )   ( resid   34 and name HB2  )   3.48  1.68  1.68
assign ( resid   31 and name HD2* )   ( resid   34 and name HG   )   3.63  1.83  1.83
assign ( resid   31 and name HD2* )   ( resid   34 and name HD1* )   2.93  1.13  1.13
assign ( resid   32 and name HN   )   ( resid   32 and name HG*  )   3.33  1.53  1.53
assign ( resid   32 and name HB*  )   ( resid   33 and name HN   )   2.91  1.12  1.12
assign ( resid   33 and name HN   )   ( resid   33 and name HG*  )   2.69  0.90  0.90
assign ( resid   33 and name HA   )   ( resid   33 and name HG*  )   2.59  0.80  0.80
assign ( resid   35 and name HN   )   ( resid   35 and name HD2* )   4.33  2.53  2.53
assign ( resid   35 and name HB*  )   ( resid   55 and name HN   )   3.92  2.13  2.13
assign ( resid   35 and name HD2* )   ( resid   55 and name HN   )   4.09  2.30  2.30
assign ( resid   37 and name HN   )   ( resid   55 and name HB*  )   4.34  2.54  2.54
assign ( resid   37 and name HB*  )   ( resid   55 and name HB*  )   2.89  1.09  1.09
assign ( resid   38 and name HN   )   ( resid   38 and name HB*  )   2.52  0.73  0.73
assign ( resid   39 and name HN   )   ( resid   39 and name HB*  )   2.61  0.81  0.81
assign ( resid   39 and name HN   )   ( resid   39 and name HG*  )   2.77  0.98  0.98
assign ( resid   39 and name HA   )   ( resid   39 and name HG*  )   2.85  1.06  1.06
assign ( resid   39 and name HB*  )   ( resid   46 and name HG2* )   3.95  2.15  2.15
assign ( resid   40 and name HN   )   ( resid   40 and name HG1* )   3.04  1.25  1.25
assign ( resid   40 and name HG2* )   ( resid   43 and name HA*  )   3.11  1.32  1.32
assign ( resid   40 and name HG2* )   ( resid   45 and name HG*  )   3.50  1.70  1.70
assign ( resid   40 and name HG2* )   ( resid   45 and name HD*  )   3.81  2.01  2.01
assign ( resid   40 and name HG1* )   ( resid   45 and name HA   )   2.70  0.90  0.90
assign ( resid   40 and name HG1* )   ( resid   45 and name HB*  )   3.66  1.87  1.87
assign ( resid   40 and name HG1* )   ( resid   45 and name HD*  )   4.75  2.95  2.95
assign ( resid   40 and name HG1* )   ( resid   46 and name HN   )   4.00  2.20  2.20
assign ( resid   40 and name HD1* )   ( resid   45 and name HG*  )   3.75  1.96  1.96
assign ( resid   40 and name HD1* )   ( resid   45 and name HD*  )   4.85  3.06  3.06
assign ( resid   41 and name HN   )   ( resid   41 and name HB*  )   2.41  0.61  0.61
assign ( resid   41 and name HB*  )   ( resid   44 and name HB   )   4.34  2.54  2.54
assign ( resid   41 and name HB*  )   ( resid   46 and name HG2* )   2.97  1.17  1.17
assign ( resid   42 and name HN   )   ( resid   42 and name HB*  )   2.73  0.94  0.94
assign ( resid   42 and name HB*  )   ( resid   44 and name HD1* )   4.10  2.31  2.31
assign ( resid   44 and name HN   )   ( resid   44 and name HG1* )   2.94  1.15  1.15
assign ( resid   44 and name HA   )   ( resid   44 and name HG1* )   2.89  1.09  1.09
assign ( resid   44 and name HA   )   ( resid   45 and name HD*  )   2.23  0.43  0.43
assign ( resid   44 and name HG2* )   ( resid   45 and name HD*  )   3.28  1.48  1.48
assign ( resid   46 and name HG1* )   ( resid   48 and name HB*  )   3.21  1.41  1.41
assign ( resid   46 and name HG1* )   ( resid   51 and name HB*  )   2.95  1.15  1.15
assign ( resid   46 and name HG1* )   ( resid   51 and name HG*  )   3.44  1.65  1.65
assign ( resid   48 and name HN   )   ( resid   48 and name HB*  )   2.54  0.75  0.75
assign ( resid   48 and name HA   )   ( resid   48 and name HD*  )   2.93  1.13  1.13
assign ( resid   48 and name HA   )   ( resid   49 and name HG1* )   4.05  2.25  2.25
assign ( resid   48 and name HB*  )   ( resid   49 and name HN   )   2.97  1.18  1.18
assign ( resid   48 and name HB*  )   ( resid   50 and name HN   )   2.76  0.97  0.97
assign ( resid   48 and name HB*  )   ( resid   51 and name HN   )   2.61  0.81  0.81
assign ( resid   48 and name HB*  )   ( resid   51 and name HB*  )   3.39  1.59  1.59
assign ( resid   48 and name HB1  )   ( resid   51 and name HB2  )   4.18  2.39  2.39
assign ( resid   48 and name HB1  )   ( resid   51 and name HB1  )   4.18  2.39  2.39
assign ( resid   48 and name HB*  )   ( resid   51 and name HG*  )   3.34  1.55  1.55
assign ( resid   48 and name HB1  )   ( resid   51 and name HG1  )   3.82  2.03  2.03
assign ( resid   48 and name HD*  )   ( resid   49 and name HN   )   4.00  2.20  2.20
assign ( resid   48 and name HD*  )   ( resid   51 and name HN   )   4.25  2.45  2.45
assign ( resid   48 and name HD*  )   ( resid   51 and name HG*  )   3.97  2.17  2.17
assign ( resid   49 and name HN   )   ( resid   49 and name HG1* )   2.89  1.10  1.10
assign ( resid   49 and name HA   )   ( resid   49 and name HG1* )   2.70  0.90  0.90
assign ( resid   50 and name HN   )   ( resid   50 and name HB*  )   2.42  0.62  0.62
assign ( resid   50 and name HB*  )   ( resid   51 and name HG*  )   4.78  2.98  2.98
assign ( resid   51 and name HN   )   ( resid   51 and name HB*  )   2.64  0.84  0.84
assign ( resid   51 and name HN   )   ( resid   51 and name HG*  )   3.03  1.24  1.24
assign ( resid   54 and name HN   )   ( resid   54 and name HG*  )   3.16  1.37  1.37
assign ( resid   54 and name HG*  )   ( resid   55 and name HN   )   3.35  1.55  1.55
assign ( resid   55 and name HN   )   ( resid   55 and name HB*  )   2.47  0.67  0.67
assign ( resid   56 and name HN   )   ( resid   57 and name HD*  )   4.20  2.40  2.40
assign ( resid   56 and name HA   )   ( resid   57 and name HD*  )   2.34  0.54  0.54
assign ( resid   56 and name HB   )   ( resid   57 and name HD*  )   3.60  1.81  1.81
assign ( resid   56 and name HG2* )   ( resid   57 and name HD*  )   3.61  1.81  1.81
assign ( resid   57 and name HB*  )   ( resid   58 and name HN   )   2.87  1.07  1.07
assign ( resid   58 and name HN   )   ( resid   58 and name HB*  )   2.55  0.76  0.76
assign ( resid   58 and name HB*  )   ( resid   59 and name HN   )   2.92  1.12  1.12
assign ( resid   59 and name HN   )   ( resid   59 and name HD2* )   3.83  2.04  2.04
assign ( resid   60 and name HN   )   ( resid   60 and name HB*  )   2.74  0.95  0.95
assign ( resid   60 and name HN   )   ( resid   60 and name HD*  )   4.10  2.30  2.30
assign ( resid   60 and name HA   )   ( resid   60 and name HD*  )   3.10  1.30  1.30
assign ( resid   60 and name HD*  )   ( resid   61 and name HN   )   4.14  2.35  2.35
assign ( resid   61 and name HN   )   ( resid   61 and name HG*  )   3.77  1.97  1.97
assign ( resid   20 and name C    )   ( resid   21 and name N    ) 
        (resid   21 and name CA   )   ( resid   21 and name C    )  1 -105.00   20.00 2
assign ( resid   21 and name N    )   ( resid   21 and name CA   ) 
        (resid   21 and name C    )   ( resid   22 and name N    )  1  125.00   14.00 2
assign ( resid   21 and name C    )   ( resid   22 and name N    ) 
        (resid   22 and name CA   )   ( resid   22 and name C    )  1  -98.00   11.00 2
assign ( resid   22 and name N    )   ( resid   22 and name CA   ) 
        (resid   22 and name C    )   ( resid   23 and name N    )  1  117.00   16.00 2
assign ( resid   22 and name C    )   ( resid   23 and name N    ) 
        (resid   23 and name CA   )   ( resid   23 and name C    )  1  -97.00   14.00 2
assign ( resid   23 and name N    )   ( resid   23 and name CA   ) 
        (resid   23 and name C    )   ( resid   24 and name N    )  1  101.00   34.00 2
assign ( resid   27 and name C    )   ( resid   28 and name N    ) 
        (resid   28 and name CA   )   ( resid   28 and name C    )  1 -133.00   14.00 2
assign ( resid   28 and name N    )   ( resid   28 and name CA   ) 
        (resid   28 and name C    )   ( resid   29 and name N    )  1  151.00   16.00 2
assign ( resid   28 and name C    )   ( resid   29 and name N    ) 
        (resid   29 and name CA   )   ( resid   29 and name C    )  1 -126.00   15.00 2
assign ( resid   29 and name N    )   ( resid   29 and name CA   ) 
        (resid   29 and name C    )   ( resid   30 and name N    )  1  130.00   19.00 2
assign ( resid   29 and name C    )   ( resid   30 and name N    ) 
        (resid   30 and name CA   )   ( resid   30 and name C    )  1 -123.00   12.00 2
assign ( resid   30 and name N    )   ( resid   30 and name CA   ) 
        (resid   30 and name C    )   ( resid   31 and name N    )  1  134.00   15.00 2
assign ( resid   30 and name C    )   ( resid   31 and name N    ) 
        (resid   31 and name CA   )   ( resid   31 and name C    )  1  -95.00   32.00 2
assign ( resid   31 and name N    )   ( resid   31 and name CA   ) 
        (resid   31 and name C    )   ( resid   32 and name N    )  1  135.00   18.00 2
assign ( resid   35 and name C    )   ( resid   36 and name N    ) 
        (resid   36 and name CA   )   ( resid   36 and name C    )  1 -132.00   13.00 2
assign ( resid   36 and name N    )   ( resid   36 and name CA   ) 
        (resid   36 and name C    )   ( resid   37 and name N    )  1  147.00   18.00 2
assign ( resid   36 and name C    )   ( resid   37 and name N    ) 
        (resid   37 and name CA   )   ( resid   37 and name C    )  1 -137.00   14.00 2
assign ( resid   37 and name N    )   ( resid   37 and name CA   ) 
        (resid   37 and name C    )   ( resid   38 and name N    )  1  135.00    6.00 2
assign ( resid   37 and name C    )   ( resid   38 and name N    ) 
        (resid   38 and name CA   )   ( resid   38 and name C    )  1 -117.00   20.00 2
assign ( resid   38 and name N    )   ( resid   38 and name CA   ) 
        (resid   38 and name C    )   ( resid   39 and name N    )  1  140.00   15.00 2
assign ( resid   38 and name C    )   ( resid   39 and name N    ) 
        (resid   39 and name CA   )   ( resid   39 and name C    )  1  -84.00   17.00 2
assign ( resid   39 and name N    )   ( resid   39 and name CA   ) 
        (resid   39 and name C    )   ( resid   40 and name N    )  1  155.00   14.00 2
assign ( resid   39 and name C    )   ( resid   40 and name N    ) 
        (resid   40 and name CA   )   ( resid   40 and name C    )  1 -103.00   18.00 2
assign ( resid   40 and name N    )   ( resid   40 and name CA   ) 
        (resid   40 and name C    )   ( resid   41 and name N    )  1  129.00   16.00 2
assign ( resid   40 and name C    )   ( resid   41 and name N    ) 
        (resid   41 and name CA   )   ( resid   41 and name C    )  1 -101.00   26.00 2
assign ( resid   41 and name N    )   ( resid   41 and name CA   ) 
        (resid   41 and name C    )   ( resid   42 and name N    )  1  118.00   23.00 2
assign ( resid   43 and name C    )   ( resid   44 and name N    ) 
        (resid   44 and name CA   )   ( resid   44 and name C    )  1 -115.80    7.00 2
assign ( resid   44 and name N    )   ( resid   44 and name CA   ) 
        (resid   44 and name C    )   ( resid   45 and name N    )  1  115.10   15.00 2
assign ( resid   52 and name C    )   ( resid   53 and name N    ) 
        (resid   53 and name CA   )   ( resid   53 and name C    )  1 -111.00   20.00 2
assign ( resid   53 and name N    )   ( resid   53 and name CA   ) 
        (resid   53 and name C    )   ( resid   54 and name N    )  1  140.00   21.00 2
assign ( resid   53 and name C    )   ( resid   54 and name N    ) 
        (resid   54 and name CA   )   ( resid   54 and name C    )  1  -77.00   16.00 2
assign ( resid   54 and name N    )   ( resid   54 and name CA   ) 
        (resid   54 and name C    )   ( resid   55 and name N    )  1  144.00   19.00 2
assign ( resid    1 and name C    )   ( resid    2 and name N    ) 
        (resid    2 and name CA   )   ( resid    2 and name C    )  1 -180.00  135.00 2
assign ( resid    1 and name C    )   ( resid    2 and name N    ) 
        (resid    2 and name CA   )   ( resid    2 and name C    )  1  -55.00  130.00 2
assign ( resid    2 and name N    )   ( resid    2 and name CA   ) 
        (resid    2 and name C    )   ( resid    3 and name N    )  1  105.00  100.00 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  145.00 2
assign ( resid    2 and name C    )   ( resid    3 and name N    ) 
        (resid    3 and name CA   )   ( resid    3 and name C    )  1 -180.00  135.00 2
assign ( resid    2 and name C    )   ( resid    3 and name N    ) 
        (resid    3 and name CA   )   ( resid    3 and name C    )  1  -55.00  130.00 2
assign ( resid    3 and name N    )   ( resid    3 and name CA   ) 
        (resid    3 and name C    )   ( resid    4 and name N    )  1  120.00   75.00 2
assign ( resid    3 and name C    )   ( resid    4 and name N    ) 
        (resid    4 and name CA   )   ( resid    4 and name C    )  1 -125.00   20.00 2
assign ( resid    4 and name N    )   ( resid    4 and name CA   ) 
        (resid    4 and name C    )   ( resid    5 and name N    )  1   75.00   10.00 2
assign ( resid    5 and name C    )   ( resid    6 and name N    ) 
        (resid    6 and name CA   )   ( resid    6 and name C    )  1 -180.00  135.00 2
assign ( resid    5 and name C    )   ( resid    6 and name N    ) 
        (resid    6 and name CA   )   ( resid    6 and name C    )  1  -55.00  130.00 2
assign ( resid    6 and name N    )   ( resid    6 and name CA   ) 
        (resid    6 and name C    )   ( resid    7 and name N    )  1    0.00   85.00 2
assign ( resid    6 and name C    )   ( resid    7 and name N    ) 
        (resid    7 and name CA   )   ( resid    7 and name C    )  1 -180.00  135.00 2
assign ( resid    6 and name C    )   ( resid    7 and name N    ) 
        (resid    7 and name CA   )   ( resid    7 and name C    )  1  -45.00  120.00 2
assign ( resid    7 and name N    )   ( resid    7 and name CA   ) 
        (resid    7 and name C    )   ( resid    8 and name N    )  1  -10.00   75.00 2
assign ( resid    7 and name C    )   ( resid    8 and name N    ) 
        (resid    8 and name CA   )   ( resid    8 and name C    )  1 -100.00   55.00 2
assign ( resid    8 and name N    )   ( resid    8 and name CA   ) 
        (resid    8 and name C    )   ( resid    9 and name N    )  1 -125.00  130.00 2
assign ( resid    8 and name N    )   ( resid    8 and name CA   ) 
        (resid    8 and name C    )   ( resid    9 and name N    )  1   55.00  140.00 2
assign ( resid    8 and name C    )   ( resid    9 and name N    ) 
        (resid    9 and name CA   )   ( resid    9 and name C    )  1 -180.00  135.00 2
assign ( resid    8 and name C    )   ( resid    9 and name N    ) 
        (resid    9 and name CA   )   ( resid    9 and name C    )  1  -55.00  130.00 2
assign ( resid    9 and name N    )   ( resid    9 and name CA   ) 
        (resid    9 and name C    )   ( resid   10 and name N    )  1   90.00  105.00 2
assign ( resid    9 and name C    )   ( resid   10 and name N    ) 
        (resid   10 and name CA   )   ( resid   10 and name C    )  1  -95.00   50.00 2
assign ( resid   10 and name N    )   ( resid   10 and name CA   ) 
        (resid   10 and name C    )   ( resid   11 and name N    )  1  130.00   35.00 2
assign ( resid   10 and name C    )   ( resid   11 and name N    ) 
        (resid   11 and name CA   )   ( resid   11 and name C    )  1  -95.00   50.00 2
assign ( resid   11 and name N    )   ( resid   11 and name CA   ) 
        (resid   11 and name C    )   ( resid   12 and name N    )  1  150.00   45.00 2
assign ( resid   11 and name C    )   ( resid   12 and name N    ) 
        (resid   12 and name CA   )   ( resid   12 and name C    )  1 -180.00  135.00 2
assign ( resid   11 and name C    )   ( resid   12 and name N    ) 
        (resid   12 and name CA   )   ( resid   12 and name C    )  1  -55.00  130.00 2
assign ( resid   12 and name N    )   ( resid   12 and name CA   ) 
        (resid   12 and name C    )   ( resid   13 and name N    )  1  160.00   35.00 2
assign ( resid   14 and name C    )   ( resid   15 and name N    ) 
        (resid   15 and name CA   )   ( resid   15 and name C    )  1 -115.00   70.00 2
assign ( resid   15 and name N    )   ( resid   15 and name CA   ) 
        (resid   15 and name C    )   ( resid   16 and name N    )  1  -55.00   30.00 2
assign ( resid   15 and name C    )   ( resid   16 and name N    ) 
        (resid   16 and name CA   )   ( resid   16 and name C    )  1 -180.00  135.00 2
assign ( resid   15 and name C    )   ( resid   16 and name N    ) 
        (resid   16 and name CA   )   ( resid   16 and name C    )  1  -55.00  130.00 2
assign ( resid   16 and name N    )   ( resid   16 and name CA   ) 
        (resid   16 and name C    )   ( resid   17 and name N    )  1   -5.00   80.00 2
assign ( resid   16 and name C    )   ( resid   17 and name N    ) 
        (resid   17 and name CA   )   ( resid   17 and name C    )  1   60.00   15.00 2
assign ( resid   17 and name N    )   ( resid   17 and name CA   ) 
        (resid   17 and name C    )   ( resid   18 and name N    )  1   50.00   45.00 2
assign ( resid   19 and name C    )   ( resid   20 and name N    ) 
        (resid   20 and name CA   )   ( resid   20 and name C    )  1 -180.00  135.00 2
assign ( resid   19 and name C    )   ( resid   20 and name N    ) 
        (resid   20 and name CA   )   ( resid   20 and name C    )  1  -45.00  110.00 2
assign ( resid   20 and name N    )   ( resid   20 and name CA   ) 
        (resid   20 and name C    )   ( resid   21 and name N    )  1  155.00   40.00 2
assign ( resid   23 and name C    )   ( resid   24 and name N    ) 
        (resid   24 and name CA   )   ( resid   24 and name C    )  1 -110.00   65.00 2
assign ( resid   24 and name N    )   ( resid   24 and name CA   ) 
        (resid   24 and name C    )   ( resid   25 and name N    )  1  -45.00   40.00 2
assign ( resid   24 and name C    )   ( resid   25 and name N    ) 
        (resid   25 and name CA   )   ( resid   25 and name C    )  1 -180.00  135.00 2
assign ( resid   24 and name C    )   ( resid   25 and name N    ) 
        (resid   25 and name CA   )   ( resid   25 and name C    )  1  -60.00  125.00 2
assign ( resid   25 and name N    )   ( resid   25 and name CA   ) 
        (resid   25 and name C    )   ( resid   26 and name N    )  1   10.00   95.00 2
assign ( resid   25 and name C    )   ( resid   26 and name N    ) 
        (resid   26 and name CA   )   ( resid   26 and name C    )  1 -180.00  135.00 2
assign ( resid   25 and name C    )   ( resid   26 and name N    ) 
        (resid   26 and name CA   )   ( resid   26 and name C    )  1  -55.00  130.00 2
assign ( resid   26 and name N    )   ( resid   26 and name CA   ) 
        (resid   26 and name C    )   ( resid   27 and name N    )  1  -10.00   75.00 2
assign ( resid   26 and name C    )   ( resid   27 and name N    ) 
        (resid   27 and name CA   )   ( resid   27 and name C    )  1   60.00   15.00 2
assign ( resid   27 and name N    )   ( resid   27 and name CA   ) 
        (resid   27 and name C    )   ( resid   28 and name N    )  1   60.00   45.00 2
assign ( resid   31 and name C    )   ( resid   32 and name N    ) 
        (resid   32 and name CA   )   ( resid   32 and name C    )  1 -100.00   55.00 2
assign ( resid   32 and name N    )   ( resid   32 and name CA   ) 
        (resid   32 and name C    )   ( resid   33 and name N    )  1  -30.00   55.00 2
assign ( resid   32 and name C    )   ( resid   33 and name N    ) 
        (resid   33 and name CA   )   ( resid   33 and name C    )  1 -100.00   55.00 2
assign ( resid   33 and name N    )   ( resid   33 and name CA   ) 
        (resid   33 and name C    )   ( resid   34 and name N    )  1  -35.00   50.00 2
assign ( resid   33 and name C    )   ( resid   34 and name N    ) 
        (resid   34 and name CA   )   ( resid   34 and name C    )  1 -100.00   55.00 2
assign ( resid   34 and name N    )   ( resid   34 and name CA   ) 
        (resid   34 and name C    )   ( resid   35 and name N    )  1  -20.00   65.00 2
assign ( resid   34 and name C    )   ( resid   35 and name N    ) 
        (resid   35 and name CA   )   ( resid   35 and name C    )  1 -180.00  135.00 2
assign ( resid   34 and name C    )   ( resid   35 and name N    ) 
        (resid   35 and name CA   )   ( resid   35 and name C    )  1  -55.00  130.00 2
assign ( resid   34 and name C    )   ( resid   35 and name N    ) 
        (resid   35 and name CA   )   ( resid   35 and name C    )  1   60.00  155.00 2
assign ( resid   35 and name N    )   ( resid   35 and name CA   ) 
        (resid   35 and name C    )   ( resid   36 and name N    )  1  110.00   95.00 2
assign ( resid   41 and name C    )   ( resid   42 and name N    ) 
        (resid   42 and name CA   )   ( resid   42 and name C    )  1  120.00   75.00 2
assign ( resid   41 and name C    )   ( resid   42 and name N    ) 
        (resid   42 and name CA   )   ( resid   42 and name C    )  1  -55.00  130.00 2
assign ( resid   42 and name N    )   ( resid   42 and name CA   ) 
        (resid   42 and name C    )   ( resid   43 and name N    )  1   50.00   45.00 2
assign ( resid   42 and name C    )   ( resid   43 and name N    ) 
        (resid   43 and name CA   )   ( resid   43 and name C    )  1 -180.00  135.00 2
assign ( resid   43 and name N    )   ( resid   43 and name CA   ) 
        (resid   43 and name C    )   ( resid   44 and name N    )  1    0.00  105.00 2
assign ( resid   45 and name C    )   ( resid   46 and name N    ) 
        (resid   46 and name CA   )   ( resid   46 and name C    )  1 -100.00   55.00 2
assign ( resid   46 and name N    )   ( resid   46 and name CA   ) 
        (resid   46 and name C    )   ( resid   47 and name N    )  1  105.00   60.00 2
assign ( resid   46 and name C    )   ( resid   47 and name N    ) 
        (resid   47 and name CA   )   ( resid   47 and name C    )  1  175.00  130.00 2
assign ( resid   46 and name C    )   ( resid   47 and name N    ) 
        (resid   47 and name CA   )   ( resid   47 and name C    )  1  -50.00  105.00 2
assign ( resid   47 and name N    )   ( resid   47 and name CA   ) 
        (resid   47 and name C    )   ( resid   48 and name N    )  1   85.00   60.00 2
assign ( resid   47 and name C    )   ( resid   48 and name N    ) 
        (resid   48 and name CA   )   ( resid   48 and name C    )  1 -175.00  130.00 2
assign ( resid   47 and name C    )   ( resid   48 and name N    ) 
        (resid   48 and name CA   )   ( resid   48 and name C    )  1  -55.00  120.00 2
assign ( resid   48 and name N    )   ( resid   48 and name CA   ) 
        (resid   48 and name C    )   ( resid   49 and name N    )  1  150.00   45.00 2
assign ( resid   48 and name C    )   ( resid   49 and name N    ) 
        (resid   49 and name CA   )   ( resid   49 and name C    )  1  -95.00   50.00 2
assign ( resid   49 and name N    )   ( resid   49 and name CA   ) 
        (resid   49 and name C    )   ( resid   50 and name N    )  1  -50.00   35.00 2
assign ( resid   49 and name C    )   ( resid   50 and name N    ) 
        (resid   50 and name CA   )   ( resid   50 and name C    )  1 -105.00   60.00 2
assign ( resid   50 and name N    )   ( resid   50 and name CA   ) 
        (resid   50 and name C    )   ( resid   51 and name N    )  1  -25.00   60.00 2
assign ( resid   50 and name C    )   ( resid   51 and name N    ) 
        (resid   51 and name CA   )   ( resid   51 and name C    )  1 -180.00  135.00 2
assign ( resid   50 and name C    )   ( resid   51 and name N    ) 
        (resid   51 and name CA   )   ( resid   51 and name C    )  1  -50.00  115.00 2
assign ( resid   51 and name N    )   ( resid   51 and name CA   ) 
        (resid   51 and name C    )   ( resid   52 and name N    )  1  -10.00   75.00 2
assign ( resid   51 and name C    )   ( resid   52 and name N    ) 
        (resid   52 and name CA   )   ( resid   52 and name C    )  1 -180.00  135.00 2
assign ( resid   51 and name C    )   ( resid   52 and name N    ) 
        (resid   52 and name CA   )   ( resid   52 and name C    )  1  -55.00  130.00 2
assign ( resid   52 and name N    )   ( resid   52 and name CA   ) 
        (resid   52 and name C    )   ( resid   53 and name N    )  1  145.00   50.00 2
assign ( resid   54 and name C    )   ( resid   55 and name N    ) 
        (resid   55 and name CA   )   ( resid   55 and name C    )  1 -180.00  135.00 2
assign ( resid   54 and name C    )   ( resid   55 and name N    ) 
        (resid   55 and name CA   )   ( resid   55 and name C    )  1  -60.00  125.00 2
assign ( resid   55 and name N    )   ( resid   55 and name CA   ) 
        (resid   55 and name C    )   ( resid   56 and name N    )  1  115.00   80.00 2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          1HT       MET   1 -12.003  16.506  14.050
    2   2H    MET   1          2HT       MET   1 -11.663  16.368  12.395
    3   3H    MET   1          3HT       MET   1 -11.308  17.805  13.215
    4    HA   MET   1           HA       MET   1  -9.637  16.729  14.531
    5   1HB   MET   1          2HB       MET   1  -9.042  14.397  14.137
    6   2HB   MET   1          1HB       MET   1 -10.718  14.520  14.645
    7   1HG   MET   1          2HG       MET   1 -11.467  14.219  12.364
    8   2HG   MET   1          1HG       MET   1  -9.797  14.197  11.793
    9   1HE   MET   1          1HE       MET   1  -8.112  12.216  12.205
   10   2HE   MET   1          2HE       MET   1  -8.433  10.869  13.297
   11   3HE   MET   1          3HE       MET   1  -8.284  12.508  13.936
   12    H    SER   2           H        SER   2 -10.313  17.766  11.605
   13    HA   SER   2           HA       SER   2  -9.177  18.361   9.742
   14   1HB   SER   2          2HB       SER   2  -6.742  17.620  11.381
   15   2HB   SER   2          1HB       SER   2  -6.712  18.522   9.865
   16    HG   SER   2           HG       SER   2  -7.837  20.186  10.850
   17    H    LEU   3           H        LEU   3  -7.048  17.365   8.356
   18    HA   LEU   3           HA       LEU   3  -6.387  15.707   6.951
   19   1HB   LEU   3          2HB       LEU   3  -7.242  14.031   9.295
   20   2HB   LEU   3          1HB       LEU   3  -6.662  13.297   7.817
   21    HG   LEU   3           HG       LEU   3  -4.845  13.359   9.366
   22   1HD1  LEU   3          1HD1      LEU   3  -4.493  15.567   7.350
   23   2HD1  LEU   3          2HD1      LEU   3  -4.274  13.841   7.050
   24   3HD1  LEU   3          3HD1      LEU   3  -3.197  14.688   8.163
   25   1HD2  LEU   3          1HD2      LEU   3  -5.346  16.317   9.645
   26   2HD2  LEU   3          2HD2      LEU   3  -4.010  15.424  10.367
   27   3HD2  LEU   3          3HD2      LEU   3  -5.666  15.090  10.869
   28    H    ASP   4           H        ASP   4  -7.335  13.420   6.042
   29    HA   ASP   4           HA       ASP   4 -10.217  13.790   5.587
   30   1HB   ASP   4          2HB       ASP   4  -8.749  14.714   3.685
   31   2HB   ASP   4          1HB       ASP   4  -8.345  13.035   3.339
   32    HA   PRO   5           HA       PRO   5  -9.333   9.444   6.841
   33   1HB   PRO   5          2HB       PRO   5 -11.749   9.084   8.052
   34   2HB   PRO   5          1HB       PRO   5 -10.349   9.795   8.862
   35   1HG   PRO   5          2HG       PRO   5 -12.705  11.152   7.611
   36   2HG   PRO   5          1HG       PRO   5 -11.885  11.514   9.141
   37   1HD   PRO   5          2HD       PRO   5 -11.447  12.952   6.896
   38   2HD   PRO   5          1HD       PRO   5 -10.172  12.660   8.099
   39    H    GLN   6           H        GLN   6 -11.852  10.925   4.997
   40    HA   GLN   6           HA       GLN   6 -13.325   8.665   4.193
   41   1HB   GLN   6          2HB       GLN   6 -13.882  11.140   3.918
   42   2HB   GLN   6          1HB       GLN   6 -12.809  11.138   2.535
   43   1HG   GLN   6          2HG       GLN   6 -15.155   9.282   2.714
   44   2HG   GLN   6          1HG       GLN   6 -15.313  10.934   2.123
   45   1HE2  GLN   6          1HE2      GLN   6 -14.332   7.742   1.421
   46   2HE2  GLN   6          2HE2      GLN   6 -13.850   8.007  -0.218
   47    H    LEU   7           H        LEU   7 -10.486  10.267   2.799
   48    HA   LEU   7           HA       LEU   7 -10.358   8.473   0.553
   49   1HB   LEU   7          2HB       LEU   7  -8.332  10.471   1.561
   50   2HB   LEU   7          1HB       LEU   7  -8.287   9.665   0.005
   51    HG   LEU   7           HG       LEU   7 -10.408  11.614   0.910
   52   1HD1  LEU   7          1HD1      LEU   7  -9.440  13.106  -0.752
   53   2HD1  LEU   7          2HD1      LEU   7  -8.183  11.920  -1.098
   54   3HD1  LEU   7          3HD1      LEU   7  -8.261  12.686   0.489
   55   1HD2  LEU   7          1HD2      LEU   7 -10.001  10.249  -1.747
   56   2HD2  LEU   7          2HD2      LEU   7 -11.192  11.504  -1.402
   57   3HD2  LEU   7          3HD2      LEU   7 -11.309   9.936  -0.604
   58    H    LEU   8           H        LEU   8  -9.822   7.742   3.613
   59    HA   LEU   8           HA       LEU   8  -7.452   6.086   3.038
   60   1HB   LEU   8          2HB       LEU   8  -8.316   7.276   5.674
   61   2HB   LEU   8          1HB       LEU   8  -6.973   6.170   5.472
   62    HG   LEU   8           HG       LEU   8  -7.145   8.919   4.232
   63   1HD1  LEU   8          1HD1      LEU   8  -6.947   9.034   6.662
   64   2HD1  LEU   8          2HD1      LEU   8  -5.455   9.551   5.874
   65   3HD1  LEU   8          3HD1      LEU   8  -5.558   7.948   6.604
   66   1HD2  LEU   8          1HD2      LEU   8  -4.790   8.572   3.705
   67   2HD2  LEU   8          2HD2      LEU   8  -5.803   7.350   2.932
   68   3HD2  LEU   8          3HD2      LEU   8  -4.876   6.942   4.378
   69    H    GLU   9           H        GLU   9 -10.107   6.228   5.407
   70    HA   GLU   9           HA       GLU   9 -11.464   4.655   6.305
   71   1HB   GLU   9          2HB       GLU   9 -10.897   3.188   3.728
   72   2HB   GLU   9          1HB       GLU   9 -12.098   2.691   4.909
   73   1HG   GLU   9          2HG       GLU   9 -13.176   4.947   4.589
   74   2HG   GLU   9          1HG       GLU   9 -12.090   5.169   3.216
   75    H    VAL  10           H        VAL  10 -11.431   1.905   6.363
   76    HA   VAL  10           HA       VAL  10  -8.855   1.397   7.693
   77    HB   VAL  10           HB       VAL  10 -11.519   0.037   8.142
   78   1HG1  VAL  10          1HG1      VAL  10  -9.626  -1.464   8.533
   79   2HG1  VAL  10          2HG1      VAL  10 -10.435  -1.049  10.046
   80   3HG1  VAL  10          3HG1      VAL  10  -8.908  -0.277   9.622
   81   1HG2  VAL  10          1HG2      VAL  10 -10.021   2.031   9.838
   82   2HG2  VAL  10          2HG2      VAL  10 -11.474   1.164  10.336
   83   3HG2  VAL  10          3HG2      VAL  10 -11.546   2.306   8.992
   84    H    LEU  11           H        LEU  11  -7.524   0.185   6.536
   85    HA   LEU  11           HA       LEU  11  -8.637  -1.836   4.717
   86   1HB   LEU  11          2HB       LEU  11  -5.895  -0.564   4.736
   87   2HB   LEU  11          1HB       LEU  11  -6.468  -1.737   3.563
   88    HG   LEU  11           HG       LEU  11  -7.616   1.034   3.953
   89   1HD1  LEU  11          1HD1      LEU  11  -5.846  -0.077   1.776
   90   2HD1  LEU  11          2HD1      LEU  11  -5.385   1.124   2.986
   91   3HD1  LEU  11          3HD1      LEU  11  -6.605   1.515   1.770
   92   1HD2  LEU  11          1HD2      LEU  11  -8.849   0.562   1.892
   93   2HD2  LEU  11          2HD2      LEU  11  -9.284  -0.570   3.174
   94   3HD2  LEU  11          3HD2      LEU  11  -8.200  -1.077   1.877
   95    H    ALA  12           H        ALA  12  -8.635  -3.824   5.544
   96    HA   ALA  12           HA       ALA  12  -6.470  -4.548   7.410
   97   1HB   ALA  12          1HB       ALA  12  -8.690  -4.455   8.459
   98   2HB   ALA  12          2HB       ALA  12  -8.019  -6.087   8.475
   99   3HB   ALA  12          3HB       ALA  12  -9.273  -5.661   7.309
  100    H    CYS  13           H        CYS  13  -5.688  -6.700   7.364
  101    HA   CYS  13           HA       CYS  13  -5.261  -7.751   4.767
  102   1HB   CYS  13          2HB       CYS  13  -3.567  -8.011   6.475
  103   2HB   CYS  13          1HB       CYS  13  -4.687  -8.880   7.517
  104    HG   CYS  13           HG       CYS  13  -3.314 -10.017   4.586
  105    HA   PRO  14           HA       PRO  14  -8.877 -10.274   4.255
  106   1HB   PRO  14          2HB       PRO  14  -7.115 -11.988   2.607
  107   2HB   PRO  14          1HB       PRO  14  -8.618 -11.168   2.168
  108   1HG   PRO  14          2HG       PRO  14  -6.260 -10.279   1.285
  109   2HG   PRO  14          1HG       PRO  14  -7.550  -9.154   1.749
  110   1HD   PRO  14          2HD       PRO  14  -5.093  -9.951   3.265
  111   2HD   PRO  14          1HD       PRO  14  -5.852  -8.354   3.109
  112    H    LYS  15           H        LYS  15  -5.795 -11.650   5.239
  113    HA   LYS  15           HA       LYS  15  -7.143 -14.091   6.144
  114   1HB   LYS  15          2HB       LYS  15  -4.219 -13.422   5.823
  115   2HB   LYS  15          1HB       LYS  15  -4.785 -14.890   6.607
  116   1HG   LYS  15          2HG       LYS  15  -6.049 -15.375   4.465
  117   2HG   LYS  15          1HG       LYS  15  -5.107 -14.071   3.741
  118   1HD   LYS  15          2HD       LYS  15  -3.887 -16.450   5.137
  119   2HD   LYS  15          1HD       LYS  15  -4.168 -16.370   3.398
  120   1HE   LYS  15          2HE       LYS  15  -2.707 -14.420   3.245
  121   2HE   LYS  15          1HE       LYS  15  -2.437 -14.472   4.987
  122   1HZ   LYS  15          1HZ       LYS  15  -0.650 -15.513   3.606
  123   2HZ   LYS  15          2HZ       LYS  15  -1.762 -16.718   3.164
  124   3HZ   LYS  15          3HZ       LYS  15  -1.313 -16.535   4.787
  125    H    ASP  16           H        ASP  16  -4.795 -11.718   7.394
  126    HA   ASP  16           HA       ASP  16  -5.018 -12.693  10.074
  127   1HB   ASP  16          2HB       ASP  16  -2.948 -11.676   9.263
  128   2HB   ASP  16          1HB       ASP  16  -3.782 -10.151   8.993
  129    H    LYS  17           H        LYS  17  -6.604 -10.285   8.188
  130    HA   LYS  17           HA       LYS  17  -8.371  -8.927   8.524
  131   1HB   LYS  17          2HB       LYS  17  -9.240 -11.057   9.661
  132   2HB   LYS  17          1HB       LYS  17  -8.862 -10.258  11.180
  133   1HG   LYS  17          2HG       LYS  17 -11.221 -10.016  10.564
  134   2HG   LYS  17          1HG       LYS  17 -10.395  -8.456  10.652
  135   1HD   LYS  17          2HD       LYS  17 -10.102  -8.514   8.196
  136   2HD   LYS  17          1HD       LYS  17 -11.030 -10.014   8.144
  137   1HE   LYS  17          2HE       LYS  17 -12.973  -8.874   9.034
  138   2HE   LYS  17          1HE       LYS  17 -12.050  -7.380   9.197
  139   1HZ   LYS  17          1HZ       LYS  17 -12.657  -8.770   6.642
  140   2HZ   LYS  17          2HZ       LYS  17 -11.769  -7.336   6.797
  141   3HZ   LYS  17          3HZ       LYS  17 -13.415  -7.364   7.209
  142    H    GLY  18           H        GLY  18  -5.624  -8.648  10.039
  143   1HA   GLY  18          2HA       GLY  18  -6.383  -6.568  11.933
  144   2HA   GLY  18          1HA       GLY  18  -4.757  -7.177  11.648
  145    HA   PRO  19           HA       PRO  19  -5.895  -3.171   9.190
  146   1HB   PRO  19          2HB       PRO  19  -4.710  -1.339  10.856
  147   2HB   PRO  19          1HB       PRO  19  -6.435  -1.714  10.863
  148   1HG   PRO  19          2HG       PRO  19  -4.272  -2.703  12.669
  149   2HG   PRO  19          1HG       PRO  19  -5.931  -2.220  13.067
  150   1HD   PRO  19          2HD       PRO  19  -5.193  -4.806  12.868
  151   2HD   PRO  19          1HD       PRO  19  -6.815  -4.248  12.399
  152    H    LEU  20           H        LEU  20  -4.479  -2.800   7.653
  153    HA   LEU  20           HA       LEU  20  -1.727  -3.621   7.967
  154   1HB   LEU  20          2HB       LEU  20  -3.173  -2.411   5.604
  155   2HB   LEU  20          1HB       LEU  20  -1.562  -3.104   5.567
  156    HG   LEU  20           HG       LEU  20  -4.058  -4.658   6.250
  157   1HD1  LEU  20          1HD1      LEU  20  -2.515  -4.513   3.664
  158   2HD1  LEU  20          2HD1      LEU  20  -4.150  -3.908   3.943
  159   3HD1  LEU  20          3HD1      LEU  20  -3.825  -5.640   4.019
  160   1HD2  LEU  20          1HD2      LEU  20  -2.070  -5.614   7.229
  161   2HD2  LEU  20          2HD2      LEU  20  -1.221  -5.502   5.689
  162   3HD2  LEU  20          3HD2      LEU  20  -2.586  -6.603   5.863
  163    H    ARG  21           H        ARG  21   0.084  -2.272   7.764
  164    HA   ARG  21           HA       ARG  21  -0.398   0.431   8.681
  165   1HB   ARG  21          2HB       ARG  21   1.432  -1.122   9.570
  166   2HB   ARG  21          1HB       ARG  21   2.294  -0.791   8.073
  167   1HG   ARG  21          2HG       ARG  21   2.476   1.523   8.596
  168   2HG   ARG  21          1HG       ARG  21   1.374   1.357   9.963
  169   1HD   ARG  21          2HD       ARG  21   3.044  -0.194  11.006
  170   2HD   ARG  21          1HD       ARG  21   4.159   0.231   9.708
  171    HE   ARG  21           HE       ARG  21   3.447   2.645  10.700
  172   1HH1  ARG  21          1HH1      ARG  21   4.701  -0.283  12.203
  173   2HH1  ARG  21          2HH1      ARG  21   5.455   0.577  13.511
  174   1HH2  ARG  21          1HH2      ARG  21   4.446   3.756  12.439
  175   2HH2  ARG  21          2HH2      ARG  21   5.310   2.849  13.652
  176    H    TYR  22           H        TYR  22  -0.522   2.123   7.429
  177    HA   TYR  22           HA       TYR  22  -0.216   1.736   4.563
  178   1HB   TYR  22          2HB       TYR  22  -2.301   2.684   5.453
  179   2HB   TYR  22          1HB       TYR  22  -1.402   4.019   6.163
  180    HD1  TYR  22           1HD      TYR  22  -2.569   2.534   2.996
  181    HD2  TYR  22           2HD      TYR  22  -0.728   5.899   4.836
  182    HE1  TYR  22           1HE      TYR  22  -2.918   3.842   0.943
  183    HE2  TYR  22           2HE      TYR  22  -1.067   7.213   2.785
  184    HH   TYR  22           HH       TYR  22  -3.160   6.307   0.352
  185    H    LEU  23           H        LEU  23   1.666   2.207   3.649
  186    HA   LEU  23           HA       LEU  23   3.311   4.392   4.690
  187   1HB   LEU  23          2HB       LEU  23   3.799   2.281   2.590
  188   2HB   LEU  23          1HB       LEU  23   4.884   3.636   2.813
  189    HG   LEU  23           HG       LEU  23   5.843   1.782   3.945
  190   1HD1  LEU  23          1HD1      LEU  23   4.510   3.571   5.968
  191   2HD1  LEU  23          2HD1      LEU  23   6.032   3.884   5.133
  192   3HD1  LEU  23          3HD1      LEU  23   5.910   2.542   6.270
  193   1HD2  LEU  23          1HD2      LEU  23   3.837   0.389   4.113
  194   2HD2  LEU  23          2HD2      LEU  23   3.225   1.429   5.399
  195   3HD2  LEU  23          3HD2      LEU  23   4.694   0.486   5.651
  196    H    GLU  24           H        GLU  24   2.906   6.372   3.975
  197    HA   GLU  24           HA       GLU  24   1.110   6.822   1.810
  198   1HB   GLU  24          2HB       GLU  24   2.827   8.971   3.019
  199   2HB   GLU  24          1HB       GLU  24   1.205   9.101   2.359
  200   1HG   GLU  24          2HG       GLU  24   0.691   9.205   4.551
  201   2HG   GLU  24          1HG       GLU  24   0.671   7.450   4.365
  202    H    SER  25           H        SER  25   4.581   6.744   2.067
  203    HA   SER  25           HA       SER  25   5.171   8.530  -0.037
  204   1HB   SER  25          2HB       SER  25   6.863   6.255   1.015
  205   2HB   SER  25          1HB       SER  25   7.436   7.631   0.073
  206    HG   SER  25           HG       SER  25   6.665   8.984   1.813
  207    H    GLU  26           H        GLU  26   4.610   5.035  -0.033
  208    HA   GLU  26           HA       GLU  26   4.836   5.093  -2.962
  209   1HB   GLU  26          2HB       GLU  26   5.988   2.984  -1.128
  210   2HB   GLU  26          1HB       GLU  26   5.947   2.874  -2.884
  211   1HG   GLU  26          2HG       GLU  26   7.365   4.842  -3.055
  212   2HG   GLU  26          1HG       GLU  26   7.368   5.006  -1.302
  213    H    GLN  27           H        GLN  27   2.657   4.887  -0.758
  214    HA   GLN  27           HA       GLN  27   0.685   3.836  -0.383
  215   1HB   GLN  27          2HB       GLN  27   1.049   3.753  -3.322
  216   2HB   GLN  27          1HB       GLN  27  -0.230   2.748  -2.657
  217   1HG   GLN  27          2HG       GLN  27  -1.138   4.869  -3.309
  218   2HG   GLN  27          1HG       GLN  27  -1.178   4.730  -1.551
  219   1HE2  GLN  27          1HE2      GLN  27  -1.228   6.890  -1.161
  220   2HE2  GLN  27          2HE2      GLN  27   0.105   7.947  -1.475
  221    H    LEU  28           H        LEU  28   2.163   2.317   0.843
  222    HA   LEU  28           HA       LEU  28   1.817  -0.412  -0.209
  223   1HB   LEU  28          2HB       LEU  28   3.967   0.668   1.612
  224   2HB   LEU  28          1HB       LEU  28   3.733  -1.035   1.268
  225    HG   LEU  28           HG       LEU  28   4.426   1.058  -0.794
  226   1HD1  LEU  28          1HD1      LEU  28   6.632  -0.002  -0.820
  227   2HD1  LEU  28          2HD1      LEU  28   6.143  -1.051   0.512
  228   3HD1  LEU  28          3HD1      LEU  28   6.267   0.690   0.762
  229   1HD2  LEU  28          1HD2      LEU  28   3.145  -0.813  -1.698
  230   2HD2  LEU  28          2HD2      LEU  28   4.280  -1.950  -0.968
  231   3HD2  LEU  28          3HD2      LEU  28   4.819  -0.864  -2.249
  232    H    LEU  29           H        LEU  29   0.799  -1.866   1.039
  233    HA   LEU  29           HA       LEU  29   0.006  -1.010   3.749
  234   1HB   LEU  29          2HB       LEU  29  -1.318  -2.988   1.887
  235   2HB   LEU  29          1HB       LEU  29  -1.864  -2.610   3.509
  236    HG   LEU  29           HG       LEU  29  -1.763  -0.630   1.232
  237   1HD1  LEU  29          1HD1      LEU  29  -4.206  -0.844   1.210
  238   2HD1  LEU  29          2HD1      LEU  29  -4.096  -2.138   2.405
  239   3HD1  LEU  29          3HD1      LEU  29  -3.412  -2.366   0.794
  240   1HD2  LEU  29          1HD2      LEU  29  -3.138   0.751   2.724
  241   2HD2  LEU  29          2HD2      LEU  29  -1.546   0.422   3.412
  242   3HD2  LEU  29          3HD2      LEU  29  -2.960  -0.461   3.994
  243    H    VAL  30           H        VAL  30   1.298  -1.953   5.208
  244    HA   VAL  30           HA       VAL  30   2.300  -4.652   4.571
  245    HB   VAL  30           HB       VAL  30   3.634  -2.560   6.302
  246   1HG1  VAL  30          1HG1      VAL  30   4.172  -4.822   7.018
  247   2HG1  VAL  30          2HG1      VAL  30   5.570  -4.079   6.246
  248   3HG1  VAL  30          3HG1      VAL  30   4.606  -5.264   5.367
  249   1HG2  VAL  30          1HG2      VAL  30   5.278  -2.386   4.493
  250   2HG2  VAL  30          2HG2      VAL  30   3.666  -1.916   3.956
  251   3HG2  VAL  30          3HG2      VAL  30   4.316  -3.494   3.513
  252    H    ASN  31           H        ASN  31   1.752  -6.259   5.896
  253    HA   ASN  31           HA       ASN  31   0.536  -5.667   8.480
  254   1HB   ASN  31          2HB       ASN  31  -0.379  -7.493   7.020
  255   2HB   ASN  31          1HB       ASN  31   1.136  -8.369   7.233
  256   1HD2  ASN  31          1HD2      ASN  31  -1.892  -7.543   8.609
  257   2HD2  ASN  31          2HD2      ASN  31  -1.741  -8.467  10.064
  258    H    GLU  32           H        GLU  32   1.766  -5.436  10.225
  259    HA   GLU  32           HA       GLU  32   4.610  -5.783   9.913
  260   1HB   GLU  32          2HB       GLU  32   3.458  -3.795  10.943
  261   2HB   GLU  32          1HB       GLU  32   3.098  -4.810  12.331
  262   1HG   GLU  32          2HG       GLU  32   5.408  -5.053  12.846
  263   2HG   GLU  32          1HG       GLU  32   5.879  -4.271  11.334
  264    H    ARG  33           H        ARG  33   2.193  -7.785  10.933
  265    HA   ARG  33           HA       ARG  33   3.793  -9.090  13.004
  266   1HB   ARG  33          2HB       ARG  33   0.926  -9.587  12.180
  267   2HB   ARG  33          1HB       ARG  33   1.737 -10.262  13.589
  268   1HG   ARG  33          2HG       ARG  33   1.883  -8.136  14.637
  269   2HG   ARG  33          1HG       ARG  33   1.384  -7.304  13.164
  270   1HD   ARG  33          2HD       ARG  33  -0.471  -7.353  14.664
  271   2HD   ARG  33          1HD       ARG  33  -0.811  -8.457  13.334
  272    HE   ARG  33           HE       ARG  33   0.159  -9.382  15.965
  273   1HH1  ARG  33          1HH1      ARG  33  -1.945  -9.654  13.191
  274   2HH1  ARG  33          2HH1      ARG  33  -2.801 -11.031  13.800
  275   1HH2  ARG  33          1HH2      ARG  33  -1.015 -11.156  16.819
  276   2HH2  ARG  33          2HH2      ARG  33  -2.291 -11.868  15.874
  277    H    LEU  34           H        LEU  34   2.284  -9.681   9.873
  278    HA   LEU  34           HA       LEU  34   3.421 -12.363   9.755
  279   1HB   LEU  34          2HB       LEU  34   1.749 -10.842   7.749
  280   2HB   LEU  34          1HB       LEU  34   2.235 -12.519   7.597
  281    HG   LEU  34           HG       LEU  34   0.409 -11.401   9.729
  282   1HD1  LEU  34          1HD1      LEU  34  -0.615 -11.485   7.507
  283   2HD1  LEU  34          2HD1      LEU  34  -1.323 -12.686   8.588
  284   3HD1  LEU  34          3HD1      LEU  34  -0.160 -13.183   7.357
  285   1HD2  LEU  34          1HD2      LEU  34   1.732 -13.250  10.578
  286   2HD2  LEU  34          2HD2      LEU  34   1.305 -14.226   9.174
  287   3HD2  LEU  34          3HD2      LEU  34   0.062 -13.756  10.334
  288    H    ASN  35           H        ASN  35   4.188  -9.186   8.828
  289    HA   ASN  35           HA       ASN  35   5.926  -8.236   7.726
  290   1HB   ASN  35          2HB       ASN  35   7.043 -11.052   7.681
  291   2HB   ASN  35          1HB       ASN  35   7.930  -9.617   7.182
  292   1HD2  ASN  35          1HD2      ASN  35   6.746  -7.973   9.312
  293   2HD2  ASN  35          2HD2      ASN  35   7.524  -8.466  10.773
  294    H    LEU  36           H        LEU  36   3.608  -9.041   6.349
  295    HA   LEU  36           HA       LEU  36   4.689  -9.570   3.660
  296   1HB   LEU  36          2HB       LEU  36   1.949 -10.218   4.758
  297   2HB   LEU  36          1HB       LEU  36   2.439 -10.439   3.089
  298    HG   LEU  36           HG       LEU  36   3.707 -11.858   5.431
  299   1HD1  LEU  36          1HD1      LEU  36   1.665 -12.843   3.447
  300   2HD1  LEU  36          2HD1      LEU  36   1.388 -12.546   5.163
  301   3HD1  LEU  36          3HD1      LEU  36   2.487 -13.830   4.657
  302   1HD2  LEU  36          1HD2      LEU  36   5.186 -11.606   3.505
  303   2HD2  LEU  36          2HD2      LEU  36   3.946 -12.289   2.457
  304   3HD2  LEU  36          3HD2      LEU  36   4.689 -13.284   3.706
  305    H    ALA  37           H        ALA  37   3.840  -8.321   1.942
  306    HA   ALA  37           HA       ALA  37   2.524  -5.849   2.861
  307   1HB   ALA  37          1HB       ALA  37   4.705  -6.065   0.791
  308   2HB   ALA  37          2HB       ALA  37   4.917  -5.492   2.443
  309   3HB   ALA  37          3HB       ALA  37   3.910  -4.583   1.319
  310    H    TYR  38           H        TYR  38   0.965  -5.001   1.641
  311    HA   TYR  38           HA       TYR  38   0.267  -6.339  -0.891
  312   1HB   TYR  38          2HB       TYR  38  -1.484  -4.755   1.010
  313   2HB   TYR  38          1HB       TYR  38  -2.019  -5.432  -0.522
  314    HD1  TYR  38           1HD      TYR  38  -2.548  -7.750  -0.725
  315    HD2  TYR  38           2HD      TYR  38  -0.967  -6.229   2.917
  316    HE1  TYR  38           1HE      TYR  38  -3.188  -9.829   0.415
  317    HE2  TYR  38           2HE      TYR  38  -1.597  -8.306   4.067
  318    HH   TYR  38           HH       TYR  38  -2.583 -11.107   2.385
  319    H    ARG  39           H        ARG  39   0.093  -5.085  -2.721
  320    HA   ARG  39           HA       ARG  39   1.036  -2.327  -2.413
  321   1HB   ARG  39          2HB       ARG  39   0.957  -4.207  -4.761
  322   2HB   ARG  39          1HB       ARG  39   1.241  -2.485  -4.965
  323   1HG   ARG  39          2HG       ARG  39   3.200  -2.658  -3.486
  324   2HG   ARG  39          1HG       ARG  39   2.931  -4.399  -3.371
  325   1HD   ARG  39          2HD       ARG  39   3.307  -4.671  -5.723
  326   2HD   ARG  39          1HD       ARG  39   3.369  -2.927  -5.962
  327    HE   ARG  39           HE       ARG  39   5.384  -3.187  -4.304
  328   1HH1  ARG  39          1HH1      ARG  39   4.527  -5.213  -7.036
  329   2HH1  ARG  39          2HH1      ARG  39   6.161  -5.730  -7.314
  330   1HH2  ARG  39          1HH2      ARG  39   7.513  -3.856  -4.678
  331   2HH2  ARG  39          2HH2      ARG  39   7.858  -4.985  -5.957
  332    H    ILE  40           H        ILE  40  -0.125  -0.588  -2.958
  333    HA   ILE  40           HA       ILE  40  -2.813  -0.987  -4.044
  334    HB   ILE  40           HB       ILE  40  -1.511   1.602  -3.164
  335   1HG1  ILE  40          2HG1      ILE  40  -3.440  -0.174  -1.649
  336   2HG1  ILE  40          1HG1      ILE  40  -1.723  -0.018  -1.296
  337   1HG2  ILE  40          1HG2      ILE  40  -3.817   2.452  -3.115
  338   2HG2  ILE  40          2HG2      ILE  40  -4.393   0.899  -3.728
  339   3HG2  ILE  40          3HG2      ILE  40  -3.347   1.912  -4.729
  340   1HD1  ILE  40          1HD1      ILE  40  -3.785   2.161  -1.097
  341   2HD1  ILE  40          2HD1      ILE  40  -2.062   2.349  -0.767
  342   3HD1  ILE  40          3HD1      ILE  40  -3.044   1.293   0.246
  343    H    ASP  41           H        ASP  41  -2.977  -1.027  -6.186
  344    HA   ASP  41           HA       ASP  41  -0.780   0.183  -7.724
  345   1HB   ASP  41          2HB       ASP  41  -0.948  -2.290  -7.820
  346   2HB   ASP  41          1HB       ASP  41  -2.566  -2.132  -8.496
  347    H    ASP  42           H        ASP  42  -1.478   2.120  -8.280
  348    HA   ASP  42           HA       ASP  42  -2.562   3.745  -9.414
  349   1HB   ASP  42          2HB       ASP  42  -2.238   2.053 -11.270
  350   2HB   ASP  42          1HB       ASP  42  -3.900   1.544 -10.995
  351    H    GLY  43           H        GLY  43  -3.662   3.075  -7.001
  352   1HA   GLY  43          2HA       GLY  43  -5.532   4.054  -5.957
  353   2HA   GLY  43          1HA       GLY  43  -6.403   3.969  -7.478
  354    H    ILE  44           H        ILE  44  -5.313   1.036  -7.530
  355    HA   ILE  44           HA       ILE  44  -7.574  -0.012  -5.960
  356    HB   ILE  44           HB       ILE  44  -6.198  -1.263  -8.344
  357   1HG1  ILE  44          2HG1      ILE  44  -7.540   0.697  -8.963
  358   2HG1  ILE  44          1HG1      ILE  44  -8.281  -0.790  -9.548
  359   1HG2  ILE  44          1HG2      ILE  44  -7.063  -2.932  -6.790
  360   2HG2  ILE  44          2HG2      ILE  44  -8.007  -2.906  -8.279
  361   3HG2  ILE  44          3HG2      ILE  44  -8.643  -2.147  -6.818
  362   1HD1  ILE  44          1HD1      ILE  44  -9.944   0.741  -8.667
  363   2HD1  ILE  44          2HD1      ILE  44  -9.123   0.763  -7.106
  364   3HD1  ILE  44          3HD1      ILE  44  -9.868  -0.724  -7.692
  365    HA   PRO  45           HA       PRO  45  -4.243  -1.945  -3.571
  366   1HB   PRO  45          2HB       PRO  45  -6.268  -2.405  -1.553
  367   2HB   PRO  45          1HB       PRO  45  -4.884  -1.314  -1.489
  368   1HG   PRO  45          2HG       PRO  45  -7.487  -0.468  -1.587
  369   2HG   PRO  45          1HG       PRO  45  -6.115   0.490  -2.171
  370   1HD   PRO  45          2HD       PRO  45  -8.066  -1.173  -3.723
  371   2HD   PRO  45          1HD       PRO  45  -7.369   0.413  -4.121
  372    H    VAL  46           H        VAL  46  -3.778  -3.981  -4.145
  373    HA   VAL  46           HA       VAL  46  -5.931  -5.827  -4.750
  374    HB   VAL  46           HB       VAL  46  -2.978  -6.434  -4.882
  375   1HG1  VAL  46          1HG1      VAL  46  -5.383  -7.580  -6.296
  376   2HG1  VAL  46          2HG1      VAL  46  -4.426  -8.363  -5.039
  377   3HG1  VAL  46          3HG1      VAL  46  -3.710  -8.035  -6.616
  378   1HG2  VAL  46          1HG2      VAL  46  -4.701  -5.200  -7.032
  379   2HG2  VAL  46          2HG2      VAL  46  -3.034  -5.746  -7.231
  380   3HG2  VAL  46          3HG2      VAL  46  -3.397  -4.393  -6.158
  381    H    LEU  47           H        LEU  47  -6.800  -6.217  -2.703
  382    HA   LEU  47           HA       LEU  47  -5.066  -7.445  -0.703
  383   1HB   LEU  47          2HB       LEU  47  -7.974  -6.633  -0.560
  384   2HB   LEU  47          1HB       LEU  47  -7.051  -7.302   0.771
  385    HG   LEU  47           HG       LEU  47  -6.500  -4.665  -0.589
  386   1HD1  LEU  47          1HD1      LEU  47  -8.525  -4.607   0.750
  387   2HD1  LEU  47          2HD1      LEU  47  -7.240  -3.688   1.533
  388   3HD1  LEU  47          3HD1      LEU  47  -7.659  -5.297   2.122
  389   1HD2  LEU  47          1HD2      LEU  47  -4.876  -4.322   1.205
  390   2HD2  LEU  47          2HD2      LEU  47  -4.461  -5.729   0.230
  391   3HD2  LEU  47          3HD2      LEU  47  -5.200  -5.944   1.815
  392    H    LEU  48           H        LEU  48  -4.673  -9.487  -1.425
  393    HA   LEU  48           HA       LEU  48  -6.988 -11.298  -1.478
  394   1HB   LEU  48          2HB       LEU  48  -4.629 -11.354  -3.356
  395   2HB   LEU  48          1HB       LEU  48  -5.793 -12.654  -3.206
  396    HG   LEU  48           HG       LEU  48  -6.438  -9.844  -4.110
  397   1HD1  LEU  48          1HD1      LEU  48  -5.086 -11.011  -5.752
  398   2HD1  LEU  48          2HD1      LEU  48  -6.752 -10.873  -6.313
  399   3HD1  LEU  48          3HD1      LEU  48  -6.164 -12.406  -5.671
  400   1HD2  LEU  48          1HD2      LEU  48  -8.136 -12.338  -4.047
  401   2HD2  LEU  48          2HD2      LEU  48  -8.614 -10.774  -4.706
  402   3HD2  LEU  48          3HD2      LEU  48  -8.309 -10.948  -2.978
  403    H    ILE  49           H        ILE  49  -6.164 -13.643  -1.285
  404    HA   ILE  49           HA       ILE  49  -4.889 -13.760   1.256
  405    HB   ILE  49           HB       ILE  49  -5.829 -15.892  -0.654
  406   1HG1  ILE  49          2HG1      ILE  49  -6.850 -14.891   2.013
  407   2HG1  ILE  49          1HG1      ILE  49  -7.578 -14.598   0.439
  408   1HG2  ILE  49          1HG2      ILE  49  -4.652 -16.300   2.093
  409   2HG2  ILE  49          2HG2      ILE  49  -3.945 -16.816   0.563
  410   3HG2  ILE  49          3HG2      ILE  49  -5.451 -17.540   1.125
  411   1HD1  ILE  49          1HD1      ILE  49  -8.081 -16.961   0.213
  412   2HD1  ILE  49          2HD1      ILE  49  -8.774 -16.309   1.698
  413   3HD1  ILE  49          3HD1      ILE  49  -7.309 -17.284   1.763
  414    H    ASP  50           H        ASP  50  -3.865 -14.532  -2.040
  415    HA   ASP  50           HA       ASP  50  -1.223 -15.292  -0.953
  416   1HB   ASP  50          2HB       ASP  50  -2.541 -17.124  -2.057
  417   2HB   ASP  50          1HB       ASP  50  -2.422 -16.229  -3.568
  418    H    GLU  51           H        GLU  51  -2.632 -12.754  -2.287
  419    HA   GLU  51           HA       GLU  51  -0.621 -12.181  -4.317
  420   1HB   GLU  51          2HB       GLU  51  -3.093 -11.614  -4.562
  421   2HB   GLU  51          1HB       GLU  51  -2.825 -10.349  -3.374
  422   1HG   GLU  51          2HG       GLU  51  -2.756  -9.408  -5.569
  423   2HG   GLU  51          1HG       GLU  51  -1.142  -9.349  -4.865
  424    H    ALA  52           H        ALA  52  -0.516 -12.213  -1.155
  425    HA   ALA  52           HA       ALA  52   0.597  -9.604  -0.612
  426   1HB   ALA  52          1HB       ALA  52  -0.626 -10.799   1.134
  427   2HB   ALA  52          2HB       ALA  52   1.044 -10.498   1.619
  428   3HB   ALA  52          3HB       ALA  52   0.560 -12.106   1.075
  429    H    THR  53           H        THR  53   2.681  -9.057  -0.790
  430    HA   THR  53           HA       THR  53   4.524 -11.165  -1.658
  431    HB   THR  53           HB       THR  53   4.381  -9.390  -3.251
  432    HG1  THR  53           1HG      THR  53   6.794  -9.084  -1.767
  433   1HG2  THR  53          1HG2      THR  53   5.095  -7.488  -1.023
  434   2HG2  THR  53          2HG2      THR  53   3.526  -7.610  -1.816
  435   3HG2  THR  53          3HG2      THR  53   4.933  -7.062  -2.723
  436    H    GLU  54           H        GLU  54   6.680 -11.173  -0.882
  437    HA   GLU  54           HA       GLU  54   6.864 -10.838   1.942
  438   1HB   GLU  54          2HB       GLU  54   8.991 -11.438  -0.119
  439   2HB   GLU  54          1HB       GLU  54   9.240 -11.512   1.618
  440   1HG   GLU  54          2HG       GLU  54   7.695 -13.320   1.831
  441   2HG   GLU  54          1HG       GLU  54   7.215 -13.165   0.140
  442    H    TRP  55           H        TRP  55   7.650  -9.184   3.108
  443    HA   TRP  55           HA       TRP  55   8.998  -7.007   1.653
  444   1HB   TRP  55          2HB       TRP  55   6.701  -6.489   2.612
  445   2HB   TRP  55          1HB       TRP  55   7.402  -6.716   4.210
  446    HD1  TRP  55           HD       TRP  55   8.059  -4.505   5.303
  447    HE1  TRP  55           1HE      TRP  55   8.850  -2.193   4.488
  448    HE3  TRP  55           3HE      TRP  55   8.143  -5.403   0.268
  449    HZ2  TRP  55           2HZ      TRP  55   9.435  -0.923   2.035
  450    HZ3  TRP  55           3HZ      TRP  55   8.827  -3.586  -1.245
  451    HH2  TRP  55           HH       TRP  55   9.457  -1.394  -0.377
  452    H    THR  56           H        THR  56  10.441  -5.704   3.225
  453    HA   THR  56           HA       THR  56  12.437  -7.353   4.270
  454    HB   THR  56           HB       THR  56  11.911  -4.490   5.058
  455    HG1  THR  56           1HG      THR  56  12.682  -3.897   3.142
  456   1HG2  THR  56          1HG2      THR  56  14.458  -6.107   4.895
  457   2HG2  THR  56          2HG2      THR  56  13.643  -5.610   6.379
  458   3HG2  THR  56          3HG2      THR  56  14.354  -4.396   5.313
  459    HA   PRO  57           HA       PRO  57  10.282  -8.187   8.113
  460   1HB   PRO  57          2HB       PRO  57  11.421 -10.547   8.608
  461   2HB   PRO  57          1HB       PRO  57  10.281 -10.350   7.272
  462   1HG   PRO  57          2HG       PRO  57  13.241 -10.587   7.218
  463   2HG   PRO  57          1HG       PRO  57  12.049 -11.145   6.034
  464   1HD   PRO  57          2HD       PRO  57  13.585  -8.764   5.925
  465   2HD   PRO  57          1HD       PRO  57  12.244  -9.218   4.857
  466    H    ASN  58           H        ASN  58  11.524  -9.577  10.151
  467    HA   ASN  58           HA       ASN  58  13.143  -7.559  11.357
  468   1HB   ASN  58          2HB       ASN  58  11.561  -9.019  12.629
  469   2HB   ASN  58          1HB       ASN  58  12.611 -10.392  12.297
  470   1HD2  ASN  58          1HD2      ASN  58  12.949 -10.757  14.474
  471   2HD2  ASN  58          2HD2      ASN  58  13.955  -9.737  15.439
  472    H    ASN  59           H        ASN  59  15.322  -7.912  12.175
  473    HA   ASN  59           HA       ASN  59  17.010  -9.007  10.134
  474   1HB   ASN  59          2HB       ASN  59  17.642  -7.731  12.801
  475   2HB   ASN  59          1HB       ASN  59  18.880  -8.305  11.691
  476   1HD2  ASN  59          1HD2      ASN  59  16.611  -5.838  12.413
  477   2HD2  ASN  59          2HD2      ASN  59  17.025  -4.771  11.116
  478    H    LEU  60           H        LEU  60  18.878 -10.434  10.734
  479    HA   LEU  60           HA       LEU  60  17.783 -12.717  12.214
  480   1HB   LEU  60          2HB       LEU  60  19.993 -12.580  10.157
  481   2HB   LEU  60          1HB       LEU  60  19.473 -14.045  10.969
  482    HG   LEU  60           HG       LEU  60  17.758 -12.368   9.132
  483   1HD1  LEU  60          1HD1      LEU  60  19.521 -13.528   7.927
  484   2HD1  LEU  60          2HD1      LEU  60  17.951 -14.257   7.591
  485   3HD1  LEU  60          3HD1      LEU  60  19.070 -15.045   8.701
  486   1HD2  LEU  60          1HD2      LEU  60  17.207 -15.034  10.431
  487   2HD2  LEU  60          2HD2      LEU  60  16.156 -14.193   9.294
  488   3HD2  LEU  60          3HD2      LEU  60  16.471 -13.497  10.883
  489    H    GLU  61           H        GLU  61  19.823 -14.169  12.936
  490    HA   GLU  61           HA       GLU  61  20.802 -12.902  15.235
  491   1HB   GLU  61          2HB       GLU  61  20.470 -15.310  15.111
  492   2HB   GLU  61          1HB       GLU  61  21.711 -15.444  13.875
  493   1HG   GLU  61          2HG       GLU  61  22.569 -16.170  16.006
  494   2HG   GLU  61          1HG       GLU  61  23.395 -14.702  15.490
  Start of MODEL    2
    1   1H    MET   1          1HT       MET   1  -6.331  18.466  -1.122
    2   2H    MET   1          2HT       MET   1  -6.648  19.740  -0.037
    3   3H    MET   1          3HT       MET   1  -7.665  19.483  -1.363
    4    HA   MET   1           HA       MET   1  -8.642  18.690   0.716
    5   1HB   MET   1          2HB       MET   1  -7.897  16.553  -1.294
    6   2HB   MET   1          1HB       MET   1  -9.168  16.389  -0.092
    7   1HG   MET   1          2HG       MET   1 -10.411  18.192  -1.113
    8   2HG   MET   1          1HG       MET   1  -9.110  18.465  -2.269
    9   1HE   MET   1          1HE       MET   1 -11.658  14.605  -2.189
   10   2HE   MET   1          2HE       MET   1 -11.951  15.967  -1.103
   11   3HE   MET   1          3HE       MET   1 -10.473  15.014  -0.948
   12    H    SER   2           H        SER   2  -7.911  18.323   2.706
   13    HA   SER   2           HA       SER   2  -5.431  16.762   2.993
   14   1HB   SER   2          2HB       SER   2  -6.639  18.784   4.888
   15   2HB   SER   2          1HB       SER   2  -5.059  18.010   5.046
   16    HG   SER   2           HG       SER   2  -5.652  20.232   3.747
   17    H    LEU   3           H        LEU   3  -5.852  14.746   3.484
   18    HA   LEU   3           HA       LEU   3  -6.359  12.935   4.715
   19   1HB   LEU   3          2HB       LEU   3  -6.990  15.046   6.746
   20   2HB   LEU   3          1HB       LEU   3  -7.273  13.353   7.089
   21    HG   LEU   3           HG       LEU   3  -5.176  13.931   8.047
   22   1HD1  LEU   3          1HD1      LEU   3  -3.629  12.444   6.872
   23   2HD1  LEU   3          2HD1      LEU   3  -4.701  12.447   5.472
   24   3HD1  LEU   3          3HD1      LEU   3  -5.246  11.748   6.997
   25   1HD2  LEU   3          1HD2      LEU   3  -4.373  15.006   5.347
   26   2HD2  LEU   3          2HD2      LEU   3  -3.321  14.879   6.759
   27   3HD2  LEU   3          3HD2      LEU   3  -4.714  15.962   6.789
   28    H    ASP   4           H        ASP   4  -7.888  11.788   3.812
   29    HA   ASP   4           HA       ASP   4 -10.647  12.299   4.683
   30   1HB   ASP   4          2HB       ASP   4 -10.428  13.088   2.333
   31   2HB   ASP   4          1HB       ASP   4  -9.926  11.466   1.865
   32    HA   PRO   5           HA       PRO   5  -9.402   8.044   5.801
   33   1HB   PRO   5          2HB       PRO   5 -11.507   8.433   7.823
   34   2HB   PRO   5          1HB       PRO   5  -9.816   7.972   8.038
   35   1HG   PRO   5          2HG       PRO   5 -10.717  10.394   8.752
   36   2HG   PRO   5          1HG       PRO   5  -9.086  10.158   8.097
   37   1HD   PRO   5          2HD       PRO   5 -11.545  11.186   6.733
   38   2HD   PRO   5          1HD       PRO   5  -9.867  11.754   6.606
   39    H    GLN   6           H        GLN   6 -12.236   9.473   4.642
   40    HA   GLN   6           HA       GLN   6 -13.976   7.206   4.850
   41   1HB   GLN   6          2HB       GLN   6 -14.677   9.650   4.618
   42   2HB   GLN   6          1HB       GLN   6 -14.250   9.512   2.918
   43   1HG   GLN   6          2HG       GLN   6 -16.578   9.199   3.084
   44   2HG   GLN   6          1HG       GLN   6 -15.868   7.618   2.759
   45   1HE2  GLN   6          1HE2      GLN   6 -18.421   8.320   3.969
   46   2HE2  GLN   6          2HE2      GLN   6 -18.435   7.583   5.535
   47    H    LEU   7           H        LEU   7 -12.078   8.696   2.239
   48    HA   LEU   7           HA       LEU   7 -12.586   6.640   0.337
   49   1HB   LEU   7          2HB       LEU   7 -10.340   8.648   0.543
   50   2HB   LEU   7          1HB       LEU   7 -10.590   7.598  -0.835
   51    HG   LEU   7           HG       LEU   7 -12.561   9.676   0.116
   52   1HD1  LEU   7          1HD1      LEU   7 -11.867  10.957  -1.837
   53   2HD1  LEU   7          2HD1      LEU   7 -10.646   9.741  -2.216
   54   3HD1  LEU   7          3HD1      LEU   7 -10.512  10.698  -0.737
   55   1HD2  LEU   7          1HD2      LEU   7 -12.477   7.967  -2.362
   56   2HD2  LEU   7          2HD2      LEU   7 -13.626   9.267  -2.053
   57   3HD2  LEU   7          3HD2      LEU   7 -13.623   7.832  -1.030
   58    H    LEU   8           H        LEU   8 -10.329   7.054   2.933
   59    HA   LEU   8           HA       LEU   8  -8.483   5.052   2.057
   60   1HB   LEU   8          2HB       LEU   8  -8.850   6.331   4.762
   61   2HB   LEU   8          1HB       LEU   8  -7.508   5.297   4.315
   62    HG   LEU   8           HG       LEU   8  -8.144   7.985   3.093
   63   1HD1  LEU   8          1HD1      LEU   8  -6.108   8.730   4.211
   64   2HD1  LEU   8          2HD1      LEU   8  -5.920   7.136   4.946
   65   3HD1  LEU   8          3HD1      LEU   8  -7.298   8.149   5.376
   66   1HD2  LEU   8          1HD2      LEU   8  -5.852   6.082   2.600
   67   2HD2  LEU   8          2HD2      LEU   8  -5.970   7.726   1.966
   68   3HD2  LEU   8          3HD2      LEU   8  -7.133   6.500   1.462
   69    H    GLU   9           H        GLU   9 -11.108   5.167   4.445
   70    HA   GLU   9           HA       GLU   9 -12.244   3.547   5.562
   71   1HB   GLU   9          2HB       GLU   9 -11.206   1.939   3.236
   72   2HB   GLU   9          1HB       GLU   9 -12.131   1.181   4.521
   73   1HG   GLU   9          2HG       GLU   9 -13.203   3.569   3.087
   74   2HG   GLU   9          1HG       GLU   9 -13.332   1.960   2.379
   75    H    VAL  10           H        VAL  10 -11.785   1.074   6.415
   76    HA   VAL  10           HA       VAL  10  -9.053   1.096   7.507
   77    HB   VAL  10           HB       VAL  10 -11.450  -0.451   8.512
   78   1HG1  VAL  10          1HG1      VAL  10  -8.706  -0.054   9.701
   79   2HG1  VAL  10          2HG1      VAL  10  -9.336  -1.548   9.017
   80   3HG1  VAL  10          3HG1      VAL  10 -10.048  -0.884  10.484
   81   1HG2  VAL  10          1HG2      VAL  10 -11.450   1.135  10.395
   82   2HG2  VAL  10          2HG2      VAL  10 -11.766   1.936   8.856
   83   3HG2  VAL  10          3HG2      VAL  10 -10.172   2.055   9.601
   84    H    LEU  11           H        LEU  11  -7.937   0.118   5.906
   85    HA   LEU  11           HA       LEU  11  -8.959  -2.134   4.469
   86   1HB   LEU  11          2HB       LEU  11  -6.195  -0.924   4.519
   87   2HB   LEU  11          1HB       LEU  11  -6.744  -2.137   3.377
   88    HG   LEU  11           HG       LEU  11  -7.864   0.654   3.634
   89   1HD1  LEU  11          1HD1      LEU  11  -6.053  -0.571   1.565
   90   2HD1  LEU  11          2HD1      LEU  11  -5.627   0.683   2.729
   91   3HD1  LEU  11          3HD1      LEU  11  -6.798   1.024   1.454
   92   1HD2  LEU  11          1HD2      LEU  11  -9.534  -0.979   2.896
   93   2HD2  LEU  11          2HD2      LEU  11  -8.447  -1.509   1.612
   94   3HD2  LEU  11          3HD2      LEU  11  -9.094   0.133   1.600
   95    H    ALA  12           H        ALA  12  -8.979  -4.131   5.195
   96    HA   ALA  12           HA       ALA  12  -6.907  -4.948   7.121
   97   1HB   ALA  12          1HB       ALA  12  -8.494  -6.584   7.972
   98   2HB   ALA  12          2HB       ALA  12  -9.684  -6.079   6.774
   99   3HB   ALA  12          3HB       ALA  12  -9.183  -4.963   8.044
  100    H    CYS  13           H        CYS  13  -5.964  -6.977   6.897
  101    HA   CYS  13           HA       CYS  13  -5.389  -7.650   4.192
  102   1HB   CYS  13          2HB       CYS  13  -4.620  -9.224   6.646
  103   2HB   CYS  13          1HB       CYS  13  -3.766  -9.129   5.108
  104    HG   CYS  13           HG       CYS  13  -4.122  -6.465   7.229
  105    HA   PRO  14           HA       PRO  14  -8.187 -11.088   3.642
  106   1HB   PRO  14          2HB       PRO  14  -6.321 -12.334   1.799
  107   2HB   PRO  14          1HB       PRO  14  -7.854 -11.533   1.449
  108   1HG   PRO  14          2HG       PRO  14  -5.430 -10.517   0.723
  109   2HG   PRO  14          1HG       PRO  14  -6.856  -9.517   1.048
  110   1HD   PRO  14          2HD       PRO  14  -4.498 -10.091   2.802
  111   2HD   PRO  14          1HD       PRO  14  -5.388  -8.570   2.564
  112    H    LYS  15           H        LYS  15  -5.154 -11.308   5.023
  113    HA   LYS  15           HA       LYS  15  -5.087 -14.191   5.266
  114   1HB   LYS  15          2HB       LYS  15  -3.328 -12.041   6.454
  115   2HB   LYS  15          1HB       LYS  15  -3.061 -13.766   6.662
  116   1HG   LYS  15          2HG       LYS  15  -3.040 -12.294   4.033
  117   2HG   LYS  15          1HG       LYS  15  -1.619 -12.821   4.936
  118   1HD   LYS  15          2HD       LYS  15  -3.751 -14.618   3.779
  119   2HD   LYS  15          1HD       LYS  15  -2.129 -14.380   3.130
  120   1HE   LYS  15          2HE       LYS  15  -1.156 -15.322   5.147
  121   2HE   LYS  15          1HE       LYS  15  -2.765 -15.498   5.852
  122   1HZ   LYS  15          1HZ       LYS  15  -3.293 -16.978   3.932
  123   2HZ   LYS  15          2HZ       LYS  15  -2.147 -17.595   5.009
  124   3HZ   LYS  15          3HZ       LYS  15  -1.643 -16.945   3.519
  125    H    ASP  16           H        ASP  16  -4.705 -11.737   7.808
  126    HA   ASP  16           HA       ASP  16  -6.334 -13.431   9.585
  127   1HB   ASP  16          2HB       ASP  16  -5.137 -12.413  11.422
  128   2HB   ASP  16          1HB       ASP  16  -3.956 -12.954  10.232
  129    H    LYS  17           H        LYS  17  -6.687 -10.893   7.654
  130    HA   LYS  17           HA       LYS  17  -7.974  -9.058   7.464
  131   1HB   LYS  17          2HB       LYS  17  -9.672 -10.869   8.257
  132   2HB   LYS  17          1HB       LYS  17  -9.657  -9.978   9.773
  133   1HG   LYS  17          2HG       LYS  17 -10.403  -7.975   8.656
  134   2HG   LYS  17          1HG       LYS  17 -10.298  -8.772   7.089
  135   1HD   LYS  17          2HD       LYS  17 -12.038 -10.353   7.793
  136   2HD   LYS  17          1HD       LYS  17 -12.154  -9.519   9.345
  137   1HE   LYS  17          2HE       LYS  17 -13.932  -8.751   7.909
  138   2HE   LYS  17          1HE       LYS  17 -12.772  -7.447   8.139
  139   1HZ   LYS  17          1HZ       LYS  17 -13.453  -7.588   5.836
  140   2HZ   LYS  17          2HZ       LYS  17 -12.965  -9.207   5.749
  141   3HZ   LYS  17          3HZ       LYS  17 -11.811  -7.984   5.967
  142    H    GLY  18           H        GLY  18  -5.679  -9.014   9.195
  143   1HA   GLY  18          2HA       GLY  18  -6.358  -7.159  11.317
  144   2HA   GLY  18          1HA       GLY  18  -4.745  -7.699  10.867
  145    HA   PRO  19           HA       PRO  19  -6.078  -3.356   9.175
  146   1HB   PRO  19          2HB       PRO  19  -4.262  -2.364  11.297
  147   2HB   PRO  19          1HB       PRO  19  -5.829  -1.739  10.774
  148   1HG   PRO  19          2HG       PRO  19  -5.585  -3.043  13.087
  149   2HG   PRO  19          1HG       PRO  19  -7.013  -3.265  12.057
  150   1HD   PRO  19          2HD       PRO  19  -4.628  -5.047  12.401
  151   2HD   PRO  19          1HD       PRO  19  -6.345  -5.480  12.267
  152    H    LEU  20           H        LEU  20  -4.929  -2.769   7.485
  153    HA   LEU  20           HA       LEU  20  -2.182  -3.554   7.177
  154   1HB   LEU  20          2HB       LEU  20  -4.161  -2.103   5.453
  155   2HB   LEU  20          1HB       LEU  20  -2.472  -2.208   4.995
  156    HG   LEU  20           HG       LEU  20  -4.101  -4.670   5.584
  157   1HD1  LEU  20          1HD1      LEU  20  -3.719  -3.323   2.912
  158   2HD1  LEU  20          2HD1      LEU  20  -5.234  -3.429   3.805
  159   3HD1  LEU  20          3HD1      LEU  20  -4.473  -4.892   3.187
  160   1HD2  LEU  20          1HD2      LEU  20  -1.664  -4.886   5.589
  161   2HD2  LEU  20          2HD2      LEU  20  -1.595  -4.183   3.975
  162   3HD2  LEU  20          3HD2      LEU  20  -2.380  -5.740   4.225
  163    H    ARG  21           H        ARG  21  -0.407  -2.355   7.399
  164    HA   ARG  21           HA       ARG  21  -0.644   0.314   8.498
  165   1HB   ARG  21          2HB       ARG  21   1.005  -1.515   9.245
  166   2HB   ARG  21          1HB       ARG  21   1.908  -1.129   7.786
  167   1HG   ARG  21          2HG       ARG  21   2.193   1.162   8.561
  168   2HG   ARG  21          1HG       ARG  21   1.268   0.788  10.020
  169   1HD   ARG  21          2HD       ARG  21   2.963  -1.011  10.491
  170   2HD   ARG  21          1HD       ARG  21   3.927  -0.345   9.175
  171    HE   ARG  21           HE       ARG  21   3.136   1.424  11.369
  172   1HH1  ARG  21          1HH1      ARG  21   5.640  -0.351   9.689
  173   2HH1  ARG  21          2HH1      ARG  21   6.948   0.428  10.528
  174   1HH2  ARG  21          1HH2      ARG  21   4.823   2.451  12.493
  175   2HH2  ARG  21          2HH2      ARG  21   6.475   2.080  12.090
  176    H    TYR  22           H        TYR  22  -0.918   1.964   7.141
  177    HA   TYR  22           HA       TYR  22  -0.187   1.672   4.352
  178   1HB   TYR  22          2HB       TYR  22  -2.381   2.537   4.770
  179   2HB   TYR  22          1HB       TYR  22  -1.754   3.776   5.851
  180    HD1  TYR  22           1HD      TYR  22  -1.380   2.650   2.304
  181    HD2  TYR  22           2HD      TYR  22  -1.552   5.919   5.020
  182    HE1  TYR  22           1HE      TYR  22  -1.263   4.218   0.416
  183    HE2  TYR  22           2HE      TYR  22  -1.428   7.496   3.140
  184    HH   TYR  22           HH       TYR  22  -0.698   7.576   0.845
  185    H    LEU  23           H        LEU  23   1.727   2.255   3.653
  186    HA   LEU  23           HA       LEU  23   3.210   4.403   4.944
  187   1HB   LEU  23          2HB       LEU  23   3.855   2.539   2.664
  188   2HB   LEU  23          1HB       LEU  23   4.881   3.899   3.067
  189    HG   LEU  23           HG       LEU  23   5.859   1.972   4.044
  190   1HD1  LEU  23          1HD1      LEU  23   5.955   3.937   5.437
  191   2HD1  LEU  23          2HD1      LEU  23   5.802   2.496   6.438
  192   3HD1  LEU  23          3HD1      LEU  23   4.403   3.530   6.165
  193   1HD2  LEU  23          1HD2      LEU  23   3.164   1.393   5.261
  194   2HD2  LEU  23          2HD2      LEU  23   4.656   0.534   5.648
  195   3HD2  LEU  23          3HD2      LEU  23   3.989   0.452   4.017
  196    H    GLU  24           H        GLU  24   3.091   6.447   4.307
  197    HA   GLU  24           HA       GLU  24   1.190   7.125   2.254
  198   1HB   GLU  24          2HB       GLU  24   2.942   8.950   3.910
  199   2HB   GLU  24          1HB       GLU  24   1.506   9.412   3.007
  200   1HG   GLU  24          2HG       GLU  24   0.127   8.043   4.480
  201   2HG   GLU  24          1HG       GLU  24   1.567   7.552   5.371
  202    H    SER  25           H        SER  25   4.587   6.777   2.437
  203    HA   SER  25           HA       SER  25   5.492   8.668   0.611
  204   1HB   SER  25          2HB       SER  25   6.594   5.890   1.071
  205   2HB   SER  25          1HB       SER  25   7.463   7.246   0.365
  206    HG   SER  25           HG       SER  25   6.693   8.261   2.551
  207    H    GLU  26           H        GLU  26   4.899   5.210  -0.103
  208    HA   GLU  26           HA       GLU  26   4.432   5.989  -2.908
  209   1HB   GLU  26          2HB       GLU  26   6.017   3.639  -1.859
  210   2HB   GLU  26          1HB       GLU  26   5.593   3.874  -3.549
  211   1HG   GLU  26          2HG       GLU  26   6.934   5.842  -3.690
  212   2HG   GLU  26          1HG       GLU  26   7.200   5.844  -1.946
  213    H    GLN  27           H        GLN  27   2.618   5.343  -0.630
  214    HA   GLN  27           HA       GLN  27   0.727   4.179  -0.177
  215   1HB   GLN  27          2HB       GLN  27   0.805   3.935  -3.180
  216   2HB   GLN  27          1HB       GLN  27  -0.535   3.323  -2.223
  217   1HG   GLN  27          2HG       GLN  27  -1.220   5.423  -2.977
  218   2HG   GLN  27          1HG       GLN  27  -0.759   5.670  -1.295
  219   1HE2  GLN  27          1HE2      GLN  27  -0.360   7.825  -1.513
  220   2HE2  GLN  27          2HE2      GLN  27   0.973   8.458  -2.417
  221    H    LEU  28           H        LEU  28   2.162   2.652   0.936
  222    HA   LEU  28           HA       LEU  28   2.076  -0.004  -0.336
  223   1HB   LEU  28          2HB       LEU  28   4.061   1.028   1.689
  224   2HB   LEU  28          1HB       LEU  28   3.995  -0.624   1.101
  225    HG   LEU  28           HG       LEU  28   4.633   1.816  -0.563
  226   1HD1  LEU  28          1HD1      LEU  28   6.382  -0.431   0.419
  227   2HD1  LEU  28          2HD1      LEU  28   6.412   1.235   0.993
  228   3HD1  LEU  28          3HD1      LEU  28   6.881   0.867  -0.666
  229   1HD2  LEU  28          1HD2      LEU  28   4.614  -1.113  -1.300
  230   2HD2  LEU  28          2HD2      LEU  28   5.179   0.207  -2.325
  231   3HD2  LEU  28          3HD2      LEU  28   3.474   0.111  -1.872
  232    H    LEU  29           H        LEU  29   1.173  -1.649   0.795
  233    HA   LEU  29           HA       LEU  29   0.115  -0.986   3.467
  234   1HB   LEU  29          2HB       LEU  29  -0.966  -2.868   1.368
  235   2HB   LEU  29          1HB       LEU  29  -1.628  -2.694   2.983
  236    HG   LEU  29           HG       LEU  29  -1.523  -0.501   0.909
  237   1HD1  LEU  29          1HD1      LEU  29  -3.937  -0.817   0.754
  238   2HD1  LEU  29          2HD1      LEU  29  -3.839  -2.175   1.873
  239   3HD1  LEU  29          3HD1      LEU  29  -3.075  -2.283   0.289
  240   1HD2  LEU  29          1HD2      LEU  29  -1.421   0.349   3.192
  241   2HD2  LEU  29          2HD2      LEU  29  -2.834  -0.616   3.625
  242   3HD2  LEU  29          3HD2      LEU  29  -2.987   0.702   2.461
  243    H    VAL  30           H        VAL  30   1.333  -1.921   4.970
  244    HA   VAL  30           HA       VAL  30   2.397  -4.611   4.411
  245    HB   VAL  30           HB       VAL  30   3.533  -2.531   6.285
  246   1HG1  VAL  30          1HG1      VAL  30   4.589  -5.235   5.477
  247   2HG1  VAL  30          2HG1      VAL  30   3.964  -4.790   7.064
  248   3HG1  VAL  30          3HG1      VAL  30   5.450  -4.054   6.464
  249   1HG2  VAL  30          1HG2      VAL  30   3.840  -1.888   3.958
  250   2HG2  VAL  30          2HG2      VAL  30   4.524  -3.473   3.598
  251   3HG2  VAL  30          3HG2      VAL  30   5.380  -2.370   4.674
  252    H    ASN  31           H        ASN  31   1.740  -6.224   5.658
  253    HA   ASN  31           HA       ASN  31   0.043  -5.729   7.951
  254   1HB   ASN  31          2HB       ASN  31  -0.442  -7.624   6.452
  255   2HB   ASN  31          1HB       ASN  31   1.133  -8.325   6.812
  256   1HD2  ASN  31          1HD2      ASN  31  -2.107  -7.868   7.886
  257   2HD2  ASN  31          2HD2      ASN  31  -2.003  -8.867   9.299
  258    H    GLU  32           H        GLU  32   0.843  -5.365   9.920
  259    HA   GLU  32           HA       GLU  32   3.685  -5.515  10.327
  260   1HB   GLU  32          2HB       GLU  32   2.147  -3.637  11.098
  261   2HB   GLU  32          1HB       GLU  32   1.600  -4.726  12.365
  262   1HG   GLU  32          2HG       GLU  32   3.997  -4.925  13.083
  263   2HG   GLU  32          1HG       GLU  32   4.360  -3.606  11.971
  264    H    ARG  33           H        ARG  33   1.428  -7.855  10.544
  265    HA   ARG  33           HA       ARG  33   2.475  -9.009  13.034
  266   1HB   ARG  33          2HB       ARG  33   0.035  -9.757  11.406
  267   2HB   ARG  33          1HB       ARG  33   0.543 -10.555  12.890
  268   1HG   ARG  33          2HG       ARG  33   0.191  -8.544  14.159
  269   2HG   ARG  33          1HG       ARG  33  -0.165  -7.635  12.690
  270   1HD   ARG  33          2HD       ARG  33  -2.155  -8.985  12.316
  271   2HD   ARG  33          1HD       ARG  33  -1.780  -9.960  13.737
  272    HE   ARG  33           HE       ARG  33  -1.903  -7.478  14.767
  273   1HH1  ARG  33          1HH1      ARG  33  -4.099  -9.257  12.677
  274   2HH1  ARG  33          2HH1      ARG  33  -5.515  -8.471  13.316
  275   1HH2  ARG  33          1HH2      ARG  33  -3.738  -6.436  15.566
  276   2HH2  ARG  33          2HH2      ARG  33  -5.317  -6.840  14.942
  277    H    LEU  34           H        LEU  34   1.843  -9.844   9.639
  278    HA   LEU  34           HA       LEU  34   3.424 -12.295   9.971
  279   1HB   LEU  34          2HB       LEU  34   1.682 -11.424   7.666
  280   2HB   LEU  34          1HB       LEU  34   2.438 -12.994   7.856
  281    HG   LEU  34           HG       LEU  34   0.333 -11.878   9.707
  282   1HD1  LEU  34          1HD1      LEU  34  -1.162 -13.512   8.649
  283   2HD1  LEU  34          2HD1      LEU  34   0.101 -13.892   7.479
  284   3HD1  LEU  34          3HD1      LEU  34  -0.607 -12.279   7.517
  285   1HD2  LEU  34          1HD2      LEU  34   1.814 -13.472  10.793
  286   2HD2  LEU  34          2HD2      LEU  34   1.554 -14.628   9.483
  287   3HD2  LEU  34          3HD2      LEU  34   0.217 -14.179  10.543
  288    H    ASN  35           H        ASN  35   3.821  -9.153   8.936
  289    HA   ASN  35           HA       ASN  35   5.490  -8.029   7.875
  290   1HB   ASN  35          2HB       ASN  35   6.879  -9.782   9.179
  291   2HB   ASN  35          1HB       ASN  35   7.030 -10.614   7.637
  292   1HD2  ASN  35          1HD2      ASN  35   8.350  -9.766   6.060
  293   2HD2  ASN  35          2HD2      ASN  35   9.460  -8.472   6.364
  294    H    LEU  36           H        LEU  36   3.401  -8.727   6.343
  295    HA   LEU  36           HA       LEU  36   4.581  -9.564   3.773
  296   1HB   LEU  36          2HB       LEU  36   1.724  -9.853   4.725
  297   2HB   LEU  36          1HB       LEU  36   2.291 -10.258   3.116
  298    HG   LEU  36           HG       LEU  36   3.156 -11.615   5.673
  299   1HD1  LEU  36          1HD1      LEU  36   1.322 -12.519   3.461
  300   2HD1  LEU  36          2HD1      LEU  36   0.871 -12.159   5.128
  301   3HD1  LEU  36          3HD1      LEU  36   1.911 -13.537   4.775
  302   1HD2  LEU  36          1HD2      LEU  36   4.920 -11.580   3.974
  303   2HD2  LEU  36          2HD2      LEU  36   3.800 -12.273   2.800
  304   3HD2  LEU  36          3HD2      LEU  36   4.282 -13.206   4.218
  305    H    ALA  37           H        ALA  37   3.880  -8.421   1.895
  306    HA   ALA  37           HA       ALA  37   2.802  -5.753   2.528
  307   1HB   ALA  37          1HB       ALA  37   5.218  -5.644   2.157
  308   2HB   ALA  37          2HB       ALA  37   4.330  -4.789   0.896
  309   3HB   ALA  37          3HB       ALA  37   5.003  -6.386   0.571
  310    H    TYR  38           H        TYR  38   1.357  -4.895   1.184
  311    HA   TYR  38           HA       TYR  38   0.607  -6.416  -1.228
  312   1HB   TYR  38          2HB       TYR  38  -1.162  -4.829   0.654
  313   2HB   TYR  38          1HB       TYR  38  -1.697  -5.511  -0.877
  314    HD1  TYR  38           1HD      TYR  38  -2.016  -7.910  -1.130
  315    HD2  TYR  38           2HD      TYR  38  -0.767  -6.255   2.586
  316    HE1  TYR  38           1HE      TYR  38  -2.580 -10.019  -0.005
  317    HE2  TYR  38           2HE      TYR  38  -1.330  -8.363   3.720
  318    HH   TYR  38           HH       TYR  38  -1.967 -11.231   2.032
  319    H    ARG  39           H        ARG  39   0.068  -5.196  -3.074
  320    HA   ARG  39           HA       ARG  39   1.290  -2.542  -3.078
  321   1HB   ARG  39          2HB       ARG  39   0.470  -4.260  -5.428
  322   2HB   ARG  39          1HB       ARG  39   1.414  -2.778  -5.498
  323   1HG   ARG  39          2HG       ARG  39   3.194  -3.894  -4.203
  324   2HG   ARG  39          1HG       ARG  39   2.252  -5.386  -4.248
  325   1HD   ARG  39          2HD       ARG  39   2.312  -5.252  -6.742
  326   2HD   ARG  39          1HD       ARG  39   3.414  -3.886  -6.591
  327    HE   ARG  39           HE       ARG  39   4.023  -6.589  -5.569
  328   1HH1  ARG  39          1HH1      ARG  39   4.978  -3.635  -7.226
  329   2HH1  ARG  39          2HH1      ARG  39   6.631  -4.135  -7.406
  330   1HH2  ARG  39          1HH2      ARG  39   6.203  -7.227  -5.806
  331   2HH2  ARG  39          2HH2      ARG  39   7.337  -6.154  -6.581
  332    H    ILE  40           H        ILE  40   0.237  -0.722  -3.684
  333    HA   ILE  40           HA       ILE  40  -2.659  -0.946  -4.124
  334    HB   ILE  40           HB       ILE  40  -1.037   1.477  -3.308
  335   1HG1  ILE  40          2HG1      ILE  40  -2.952  -0.229  -1.706
  336   2HG1  ILE  40          1HG1      ILE  40  -1.199  -0.230  -1.537
  337   1HG2  ILE  40          1HG2      ILE  40  -4.026   1.130  -3.543
  338   2HG2  ILE  40          2HG2      ILE  40  -3.005   2.071  -4.632
  339   3HG2  ILE  40          3HG2      ILE  40  -3.192   2.567  -2.949
  340   1HD1  ILE  40          1HD1      ILE  40  -2.279   1.071   0.216
  341   2HD1  ILE  40          2HD1      ILE  40  -3.010   2.117  -1.003
  342   3HD1  ILE  40          3HD1      ILE  40  -1.256   2.085  -0.799
  343    H    ASP  41           H        ASP  41  -3.223  -0.892  -6.204
  344    HA   ASP  41           HA       ASP  41  -1.416   0.350  -8.132
  345   1HB   ASP  41          2HB       ASP  41  -2.304  -1.927  -8.573
  346   2HB   ASP  41          1HB       ASP  41  -3.931  -1.256  -8.634
  347    H    ASP  42           H        ASP  42  -1.719   2.495  -7.825
  348    HA   ASP  42           HA       ASP  42  -2.544   4.555  -8.276
  349   1HB   ASP  42          2HB       ASP  42  -2.885   3.414 -10.520
  350   2HB   ASP  42          1HB       ASP  42  -4.572   3.210 -10.060
  351    H    GLY  43           H        GLY  43  -3.940   2.702  -6.231
  352   1HA   GLY  43          2HA       GLY  43  -5.352   4.013  -4.615
  353   2HA   GLY  43          1HA       GLY  43  -6.399   4.319  -5.989
  354    H    ILE  44           H        ILE  44  -5.468   1.327  -6.622
  355    HA   ILE  44           HA       ILE  44  -7.630   0.132  -5.022
  356    HB   ILE  44           HB       ILE  44  -6.419  -0.857  -7.610
  357   1HG1  ILE  44          2HG1      ILE  44  -9.134   0.347  -7.025
  358   2HG1  ILE  44          1HG1      ILE  44  -7.818   1.158  -7.866
  359   1HG2  ILE  44          1HG2      ILE  44  -8.724  -1.937  -5.992
  360   2HG2  ILE  44          2HG2      ILE  44  -7.149  -2.699  -6.193
  361   3HG2  ILE  44          3HG2      ILE  44  -8.224  -2.522  -7.576
  362   1HD1  ILE  44          1HD1      ILE  44  -9.304  -1.280  -8.806
  363   2HD1  ILE  44          2HD1      ILE  44  -7.933  -0.542  -9.633
  364   3HD1  ILE  44          3HD1      ILE  44  -9.438   0.356  -9.449
  365    HA   PRO  45           HA       PRO  45  -4.213  -1.968  -2.959
  366   1HB   PRO  45          2HB       PRO  45  -6.319  -3.008  -1.221
  367   2HB   PRO  45          1HB       PRO  45  -4.960  -1.961  -0.816
  368   1HG   PRO  45          2HG       PRO  45  -7.523  -1.091  -0.819
  369   2HG   PRO  45          1HG       PRO  45  -6.154  -0.035  -1.222
  370   1HD   PRO  45          2HD       PRO  45  -8.083  -1.423  -3.044
  371   2HD   PRO  45          1HD       PRO  45  -7.424   0.227  -3.147
  372    H    VAL  46           H        VAL  46  -3.495  -3.777  -3.935
  373    HA   VAL  46           HA       VAL  46  -5.312  -5.766  -4.943
  374    HB   VAL  46           HB       VAL  46  -2.298  -5.909  -4.746
  375   1HG1  VAL  46          1HG1      VAL  46  -2.494  -7.565  -6.545
  376   2HG1  VAL  46          2HG1      VAL  46  -4.253  -7.459  -6.444
  377   3HG1  VAL  46          3HG1      VAL  46  -3.327  -8.086  -5.078
  378   1HG2  VAL  46          1HG2      VAL  46  -2.273  -5.172  -7.077
  379   2HG2  VAL  46          2HG2      VAL  46  -2.997  -3.952  -6.030
  380   3HG2  VAL  46          3HG2      VAL  46  -4.024  -4.973  -7.038
  381    H    LEU  47           H        LEU  47  -6.394  -6.640  -3.200
  382    HA   LEU  47           HA       LEU  47  -4.820  -7.784  -1.023
  383   1HB   LEU  47          2HB       LEU  47  -7.802  -7.442  -1.339
  384   2HB   LEU  47          1HB       LEU  47  -7.020  -8.129   0.071
  385    HG   LEU  47           HG       LEU  47  -6.697  -5.294  -0.915
  386   1HD1  LEU  47          1HD1      LEU  47  -8.149  -6.433   1.472
  387   2HD1  LEU  47          2HD1      LEU  47  -8.888  -5.691   0.054
  388   3HD1  LEU  47          3HD1      LEU  47  -7.907  -4.716   1.146
  389   1HD2  LEU  47          1HD2      LEU  47  -5.582  -6.675   1.526
  390   2HD2  LEU  47          2HD2      LEU  47  -5.471  -4.948   1.187
  391   3HD2  LEU  47          3HD2      LEU  47  -4.657  -6.107   0.136
  392    H    LEU  48           H        LEU  48  -3.929  -9.475  -2.298
  393    HA   LEU  48           HA       LEU  48  -5.794 -11.718  -2.659
  394   1HB   LEU  48          2HB       LEU  48  -3.507 -10.938  -4.474
  395   2HB   LEU  48          1HB       LEU  48  -4.385 -12.452  -4.584
  396    HG   LEU  48           HG       LEU  48  -5.628  -9.725  -4.949
  397   1HD1  LEU  48          1HD1      LEU  48  -4.039 -10.225  -6.725
  398   2HD1  LEU  48          2HD1      LEU  48  -5.700 -10.290  -7.318
  399   3HD1  LEU  48          3HD1      LEU  48  -4.820 -11.785  -6.995
  400   1HD2  LEU  48          1HD2      LEU  48  -7.537 -10.972  -5.804
  401   2HD2  LEU  48          2HD2      LEU  48  -7.180 -11.426  -4.135
  402   3HD2  LEU  48          3HD2      LEU  48  -6.708 -12.492  -5.458
  403    H    ILE  49           H        ILE  49  -4.868 -13.800  -2.272
  404    HA   ILE  49           HA       ILE  49  -3.085 -13.722  -0.037
  405    HB   ILE  49           HB       ILE  49  -4.236 -16.105  -1.498
  406   1HG1  ILE  49          2HG1      ILE  49  -5.160 -14.711   1.027
  407   2HG1  ILE  49          1HG1      ILE  49  -5.938 -14.576  -0.545
  408   1HG2  ILE  49          1HG2      ILE  49  -3.728 -17.351   0.557
  409   2HG2  ILE  49          2HG2      ILE  49  -2.937 -15.921   1.220
  410   3HG2  ILE  49          3HG2      ILE  49  -2.267 -16.718  -0.204
  411   1HD1  ILE  49          1HD1      ILE  49  -6.433 -16.974  -0.490
  412   2HD1  ILE  49          2HD1      ILE  49  -7.134 -16.117   0.881
  413   3HD1  ILE  49          3HD1      ILE  49  -5.680 -17.084   1.101
  414    H    ASP  50           H        ASP  50  -2.813 -14.838  -3.392
  415    HA   ASP  50           HA       ASP  50  -0.183 -15.940  -2.904
  416   1HB   ASP  50          2HB       ASP  50  -1.779 -16.976  -4.513
  417   2HB   ASP  50          1HB       ASP  50  -1.609 -15.562  -5.548
  418    H    GLU  51           H        GLU  51  -1.514 -12.954  -4.083
  419    HA   GLU  51           HA       GLU  51   0.952 -12.019  -5.225
  420   1HB   GLU  51          2HB       GLU  51  -1.715 -10.790  -4.663
  421   2HB   GLU  51          1HB       GLU  51  -0.349  -9.746  -5.014
  422   1HG   GLU  51          2HG       GLU  51  -1.768 -10.267  -6.975
  423   2HG   GLU  51          1HG       GLU  51  -0.075 -10.715  -7.181
  424    H    ALA  52           H        ALA  52  -0.285 -12.261  -2.074
  425    HA   ALA  52           HA       ALA  52   0.946 -10.084  -0.799
  426   1HB   ALA  52          1HB       ALA  52   0.757 -11.380   1.249
  427   2HB   ALA  52          2HB       ALA  52   0.453 -12.844   0.316
  428   3HB   ALA  52          3HB       ALA  52  -0.717 -11.525   0.294
  429    H    THR  53           H        THR  53   3.027  -9.581  -0.792
  430    HA   THR  53           HA       THR  53   4.974 -11.742  -1.227
  431    HB   THR  53           HB       THR  53   5.433  -8.784  -1.627
  432    HG1  THR  53           1HG      THR  53   3.770 -10.217  -2.998
  433   1HG2  THR  53          1HG2      THR  53   6.860 -11.214  -2.717
  434   2HG2  THR  53          2HG2      THR  53   7.452 -10.175  -1.419
  435   3HG2  THR  53          3HG2      THR  53   7.272  -9.531  -3.054
  436    H    GLU  54           H        GLU  54   6.918 -11.744  -0.031
  437    HA   GLU  54           HA       GLU  54   6.600 -10.899   2.700
  438   1HB   GLU  54          2HB       GLU  54   8.943 -12.232   1.321
  439   2HB   GLU  54          1HB       GLU  54   8.744 -12.048   3.058
  440   1HG   GLU  54          2HG       GLU  54   6.815 -13.493   3.036
  441   2HG   GLU  54          1HG       GLU  54   6.878 -13.595   1.278
  442    H    TRP  55           H        TRP  55   7.325  -9.066   3.546
  443    HA   TRP  55           HA       TRP  55   8.747  -7.205   1.846
  444   1HB   TRP  55          2HB       TRP  55   6.758  -6.685   3.418
  445   2HB   TRP  55          1HB       TRP  55   7.952  -6.715   4.707
  446    HD1  TRP  55           HD       TRP  55   8.168  -4.228   5.344
  447    HE1  TRP  55           1HE      TRP  55   8.762  -2.067   4.084
  448    HE3  TRP  55           3HE      TRP  55   8.176  -6.045   0.570
  449    HZ2  TRP  55           2HZ      TRP  55   9.182  -1.238   1.418
  450    HZ3  TRP  55           3HZ      TRP  55   8.685  -4.504  -1.275
  451    HH2  TRP  55           HH       TRP  55   9.177  -2.151  -0.861
  452    H    THR  56           H        THR  56  10.220  -5.769   3.601
  453    HA   THR  56           HA       THR  56  12.728  -6.643   3.530
  454    HB   THR  56           HB       THR  56  11.639  -5.230   5.954
  455    HG1  THR  56           1HG      THR  56  12.601  -3.764   3.781
  456   1HG2  THR  56          1HG2      THR  56  13.817  -4.083   5.932
  457   2HG2  THR  56          2HG2      THR  56  14.318  -5.085   4.567
  458   3HG2  THR  56          3HG2      THR  56  13.993  -5.827   6.136
  459    HA   PRO  57           HA       PRO  57  13.123 -10.411   5.906
  460   1HB   PRO  57          2HB       PRO  57  15.944  -9.467   6.059
  461   2HB   PRO  57          1HB       PRO  57  15.307 -11.036   5.553
  462   1HG   PRO  57          2HG       PRO  57  16.204  -9.301   3.752
  463   2HG   PRO  57          1HG       PRO  57  14.756 -10.278   3.433
  464   1HD   PRO  57          2HD       PRO  57  14.971  -7.396   4.193
  465   2HD   PRO  57          1HD       PRO  57  13.841  -8.189   3.077
  466    H    ASN  58           H        ASN  58  13.578 -11.050   8.050
  467    HA   ASN  58           HA       ASN  58  13.189  -8.867   9.909
  468   1HB   ASN  58          2HB       ASN  58  11.859 -11.032   9.937
  469   2HB   ASN  58          1HB       ASN  58  13.302 -11.807  10.580
  470   1HD2  ASN  58          1HD2      ASN  58  13.855 -11.495  12.702
  471   2HD2  ASN  58          2HD2      ASN  58  12.859 -10.639  13.829
  472    H    ASN  59           H        ASN  59  15.458  -8.236   9.241
  473    HA   ASN  59           HA       ASN  59  17.584  -7.787   9.733
  474   1HB   ASN  59          2HB       ASN  59  18.176  -7.628  12.151
  475   2HB   ASN  59          1HB       ASN  59  16.708  -6.790  11.684
  476   1HD2  ASN  59          1HD2      ASN  59  14.761  -7.450  12.509
  477   2HD2  ASN  59          2HD2      ASN  59  14.626  -8.595  13.796
  478    H    LEU  60           H        LEU  60  19.660  -8.392  10.730
  479    HA   LEU  60           HA       LEU  60  21.454  -9.748  10.557
  480   1HB   LEU  60          2HB       LEU  60  20.380 -10.396  12.760
  481   2HB   LEU  60          1HB       LEU  60  19.711 -11.787  11.927
  482    HG   LEU  60           HG       LEU  60  21.998 -12.527  11.380
  483   1HD1  LEU  60          1HD1      LEU  60  23.111 -10.372  11.414
  484   2HD1  LEU  60          2HD1      LEU  60  23.898 -11.501  12.517
  485   3HD1  LEU  60          3HD1      LEU  60  22.836 -10.245  13.153
  486   1HD2  LEU  60          1HD2      LEU  60  21.463 -12.086  14.312
  487   2HD2  LEU  60          2HD2      LEU  60  22.597 -13.258  13.642
  488   3HD2  LEU  60          3HD2      LEU  60  20.867 -13.425  13.334
  489    H    GLU  61           H        GLU  61  20.256  -9.655   8.214
  490    HA   GLU  61           HA       GLU  61  19.657 -12.385   7.377
  491   1HB   GLU  61          2HB       GLU  61  18.687 -11.369   5.345
  492   2HB   GLU  61          1HB       GLU  61  17.922 -10.821   6.825
  493   1HG   GLU  61          2HG       GLU  61  19.981  -9.248   5.283
  494   2HG   GLU  61          1HG       GLU  61  18.240  -9.044   5.128
  Start of MODEL    3
    1   1H    MET   1          1HT       MET   1  -1.921  16.731   4.114
    2   2H    MET   1          2HT       MET   1  -3.593  16.804   4.393
    3   3H    MET   1          3HT       MET   1  -2.713  15.439   4.881
    4    HA   MET   1           HA       MET   1  -1.493  16.717   6.480
    5   1HB   MET   1          2HB       MET   1  -1.968  19.035   6.904
    6   2HB   MET   1          1HB       MET   1  -1.598  18.857   5.193
    7   1HG   MET   1          2HG       MET   1  -3.945  18.963   4.636
    8   2HG   MET   1          1HG       MET   1  -4.377  19.030   6.346
    9   1HE   MET   1          1HE       MET   1  -5.850  21.158   5.949
   10   2HE   MET   1          2HE       MET   1  -5.463  21.138   4.228
   11   3HE   MET   1          3HE       MET   1  -5.276  22.626   5.158
   12    H    SER   2           H        SER   2  -4.659  15.953   5.625
   13    HA   SER   2           HA       SER   2  -5.557  16.220   8.412
   14   1HB   SER   2          2HB       SER   2  -6.856  17.587   6.795
   15   2HB   SER   2          1HB       SER   2  -7.263  16.117   5.909
   16    HG   SER   2           HG       SER   2  -8.884  15.999   7.222
   17    H    LEU   3           H        LEU   3  -6.944  14.514   9.210
   18    HA   LEU   3           HA       LEU   3  -6.103  11.900   8.222
   19   1HB   LEU   3          2HB       LEU   3  -6.039  12.720  10.687
   20   2HB   LEU   3          1HB       LEU   3  -7.764  12.427  10.681
   21    HG   LEU   3           HG       LEU   3  -6.380  10.594  11.677
   22   1HD1  LEU   3          1HD1      LEU   3  -7.574   8.767  10.585
   23   2HD1  LEU   3          2HD1      LEU   3  -8.019   9.848   9.264
   24   3HD1  LEU   3          3HD1      LEU   3  -8.630  10.145  10.891
   25   1HD2  LEU   3          1HD2      LEU   3  -5.193   9.089  10.154
   26   2HD2  LEU   3          2HD2      LEU   3  -4.483  10.704  10.168
   27   3HD2  LEU   3          3HD2      LEU   3  -5.504  10.200   8.820
   28    H    ASP   4           H        ASP   4  -7.413  10.700   6.984
   29    HA   ASP   4           HA       ASP   4 -10.301  11.283   7.034
   30   1HB   ASP   4          2HB       ASP   4  -9.060  11.980   4.916
   31   2HB   ASP   4          1HB       ASP   4  -8.836  10.260   4.604
   32    HA   PRO   5           HA       PRO   5  -9.718   6.990   8.497
   33   1HB   PRO   5          2HB       PRO   5 -12.097   6.885   9.831
   34   2HB   PRO   5          1HB       PRO   5 -10.619   7.562  10.519
   35   1HG   PRO   5          2HG       PRO   5 -12.945   8.968   9.272
   36   2HG   PRO   5          1HG       PRO   5 -12.018   9.399  10.721
   37   1HD   PRO   5          2HD       PRO   5 -11.621  10.609   8.339
   38   2HD   PRO   5          1HD       PRO   5 -10.306  10.344   9.501
   39    H    GLN   6           H        GLN   6 -12.007   8.416   6.407
   40    HA   GLN   6           HA       GLN   6 -13.560   6.005   6.007
   41   1HB   GLN   6          2HB       GLN   6 -14.622   8.228   5.830
   42   2HB   GLN   6          1HB       GLN   6 -13.593   8.598   4.454
   43   1HG   GLN   6          2HG       GLN   6 -14.599   6.747   3.212
   44   2HG   GLN   6          1HG       GLN   6 -15.641   6.401   4.591
   45   1HE2  GLN   6          1HE2      GLN   6 -17.510   6.764   3.427
   46   2HE2  GLN   6          2HE2      GLN   6 -18.007   8.355   2.960
   47    H    LEU   7           H        LEU   7 -11.181   7.931   4.205
   48    HA   LEU   7           HA       LEU   7 -11.089   6.224   1.945
   49   1HB   LEU   7          2HB       LEU   7  -9.039   8.151   3.034
   50   2HB   LEU   7          1HB       LEU   7  -8.881   7.323   1.499
   51    HG   LEU   7           HG       LEU   7 -11.029   9.314   2.230
   52   1HD1  LEU   7          1HD1      LEU   7  -9.950  10.706   0.528
   53   2HD1  LEU   7          2HD1      LEU   7  -8.693   9.485   0.332
   54   3HD1  LEU   7          3HD1      LEU   7  -8.861  10.341   1.865
   55   1HD2  LEU   7          1HD2      LEU   7 -10.544   7.814  -0.343
   56   2HD2  LEU   7          2HD2      LEU   7 -11.692   9.137  -0.131
   57   3HD2  LEU   7          3HD2      LEU   7 -11.920   7.620   0.741
   58    H    LEU   8           H        LEU   8  -9.855   5.888   5.091
   59    HA   LEU   8           HA       LEU   8  -7.716   4.088   4.447
   60   1HB   LEU   8          2HB       LEU   8  -9.119   4.628   7.068
   61   2HB   LEU   8          1HB       LEU   8  -7.665   3.666   6.884
   62    HG   LEU   8           HG       LEU   8  -7.895   6.618   6.280
   63   1HD1  LEU   8          1HD1      LEU   8  -6.533   5.164   8.540
   64   2HD1  LEU   8          2HD1      LEU   8  -8.011   6.119   8.669
   65   3HD1  LEU   8          3HD1      LEU   8  -6.486   6.902   8.251
   66   1HD2  LEU   8          1HD2      LEU   8  -5.457   6.515   6.036
   67   2HD2  LEU   8          2HD2      LEU   8  -6.275   5.510   4.837
   68   3HD2  LEU   8          3HD2      LEU   8  -5.516   4.767   6.246
   69    H    GLU   9           H        GLU   9 -11.065   3.795   5.516
   70    HA   GLU   9           HA       GLU   9 -12.499   2.057   5.718
   71   1HB   GLU   9          2HB       GLU   9 -10.784   1.130   3.429
   72   2HB   GLU   9          1HB       GLU   9 -12.153   0.185   3.998
   73   1HG   GLU   9          2HG       GLU   9 -13.550   2.283   3.635
   74   2HG   GLU   9          1HG       GLU   9 -12.159   2.915   2.754
   75    H    VAL  10           H        VAL  10 -12.244  -0.694   5.475
   76    HA   VAL  10           HA       VAL  10 -10.546  -1.329   7.771
   77    HB   VAL  10           HB       VAL  10 -12.578  -3.062   6.348
   78   1HG1  VAL  10          1HG1      VAL  10 -11.136  -3.435   8.970
   79   2HG1  VAL  10          2HG1      VAL  10 -10.893  -4.375   7.497
   80   3HG1  VAL  10          3HG1      VAL  10 -12.428  -4.469   8.360
   81   1HG2  VAL  10          1HG2      VAL  10 -13.643  -1.138   7.389
   82   2HG2  VAL  10          2HG2      VAL  10 -12.825  -1.493   8.913
   83   3HG2  VAL  10          3HG2      VAL  10 -14.026  -2.617   8.272
   84    H    LEU  11           H        LEU  11  -8.503  -1.784   7.225
   85    HA   LEU  11           HA       LEU  11  -8.036  -3.367   4.784
   86   1HB   LEU  11          2HB       LEU  11  -6.179  -1.501   6.259
   87   2HB   LEU  11          1HB       LEU  11  -5.727  -2.465   4.867
   88    HG   LEU  11           HG       LEU  11  -7.812  -0.278   4.869
   89   1HD1  LEU  11          1HD1      LEU  11  -5.013  -0.330   3.751
   90   2HD1  LEU  11          2HD1      LEU  11  -5.565   0.610   5.139
   91   3HD1  LEU  11          3HD1      LEU  11  -6.190   0.964   3.528
   92   1HD2  LEU  11          1HD2      LEU  11  -7.800  -0.571   2.445
   93   2HD2  LEU  11          2HD2      LEU  11  -8.298  -2.052   3.259
   94   3HD2  LEU  11          3HD2      LEU  11  -6.666  -1.912   2.606
   95    H    ALA  12           H        ALA  12  -7.918  -5.437   5.326
   96    HA   ALA  12           HA       ALA  12  -6.155  -6.171   7.572
   97   1HB   ALA  12          1HB       ALA  12  -8.495  -6.535   8.190
   98   2HB   ALA  12          2HB       ALA  12  -7.621  -8.059   8.048
   99   3HB   ALA  12          3HB       ALA  12  -8.712  -7.551   6.761
  100    H    CYS  13           H        CYS  13  -4.797  -7.872   7.253
  101    HA   CYS  13           HA       CYS  13  -4.194  -8.659   4.577
  102   1HB   CYS  13          2HB       CYS  13  -2.430  -8.491   6.245
  103   2HB   CYS  13          1HB       CYS  13  -3.216  -9.706   7.246
  104    HG   CYS  13           HG       CYS  13  -2.023 -10.389   4.112
  105    HA   PRO  14           HA       PRO  14  -7.351 -11.778   4.194
  106   1HB   PRO  14          2HB       PRO  14  -5.509 -12.787   2.086
  107   2HB   PRO  14          1HB       PRO  14  -7.228 -12.392   1.989
  108   1HG   PRO  14          2HG       PRO  14  -5.411 -10.760   0.939
  109   2HG   PRO  14          1HG       PRO  14  -6.827 -10.113   1.787
  110   1HD   PRO  14          2HD       PRO  14  -3.999 -10.355   2.732
  111   2HD   PRO  14          1HD       PRO  14  -5.168  -9.044   2.995
  112    H    LYS  15           H        LYS  15  -4.086 -12.384   5.032
  113    HA   LYS  15           HA       LYS  15  -4.343 -15.248   5.216
  114   1HB   LYS  15          2HB       LYS  15  -2.246 -13.243   5.794
  115   2HB   LYS  15          1HB       LYS  15  -2.200 -14.703   6.768
  116   1HG   LYS  15          2HG       LYS  15  -0.748 -14.876   4.827
  117   2HG   LYS  15          1HG       LYS  15  -2.047 -16.065   4.756
  118   1HD   LYS  15          2HD       LYS  15  -3.228 -14.781   3.130
  119   2HD   LYS  15          1HD       LYS  15  -2.134 -13.413   3.328
  120   1HE   LYS  15          2HE       LYS  15  -1.650 -14.665   1.281
  121   2HE   LYS  15          1HE       LYS  15  -0.297 -14.728   2.411
  122   1HZ   LYS  15          1HZ       LYS  15  -0.979 -16.939   3.073
  123   2HZ   LYS  15          2HZ       LYS  15  -0.759 -16.887   1.394
  124   3HZ   LYS  15          3HZ       LYS  15  -2.325 -16.874   2.046
  125    H    ASP  16           H        ASP  16  -3.765 -12.764   7.741
  126    HA   ASP  16           HA       ASP  16  -5.073 -14.598   9.644
  127   1HB   ASP  16          2HB       ASP  16  -2.623 -14.358   9.947
  128   2HB   ASP  16          1HB       ASP  16  -2.844 -12.633  10.206
  129    H    LYS  17           H        LYS  17  -5.685 -11.870   8.047
  130    HA   LYS  17           HA       LYS  17  -7.229 -10.231   8.263
  131   1HB   LYS  17          2HB       LYS  17  -7.902 -11.664  10.828
  132   2HB   LYS  17          1HB       LYS  17  -8.801 -10.282  10.216
  133   1HG   LYS  17          2HG       LYS  17  -9.373 -11.513   8.208
  134   2HG   LYS  17          1HG       LYS  17  -8.431 -12.896   8.773
  135   1HD   LYS  17          2HD       LYS  17  -9.914 -13.189  10.653
  136   2HD   LYS  17          1HD       LYS  17 -10.798 -11.722  10.227
  137   1HE   LYS  17          2HE       LYS  17 -10.575 -14.123   8.425
  138   2HE   LYS  17          1HE       LYS  17 -11.908 -13.866   9.550
  139   1HZ   LYS  17          1HZ       LYS  17 -11.201 -11.784   7.580
  140   2HZ   LYS  17          2HZ       LYS  17 -12.687 -12.064   8.350
  141   3HZ   LYS  17          3HZ       LYS  17 -12.159 -13.103   7.119
  142    H    GLY  18           H        GLY  18  -4.467 -10.228   9.666
  143   1HA   GLY  18          2HA       GLY  18  -4.694  -8.332  11.776
  144   2HA   GLY  18          1HA       GLY  18  -3.220  -8.748  10.915
  145    HA   PRO  19           HA       PRO  19  -5.357  -4.557   9.564
  146   1HB   PRO  19          2HB       PRO  19  -3.666  -3.301  11.649
  147   2HB   PRO  19          1HB       PRO  19  -5.337  -2.952  11.193
  148   1HG   PRO  19          2HG       PRO  19  -4.772  -4.223  13.469
  149   2HG   PRO  19          1HG       PRO  19  -6.189  -4.669  12.500
  150   1HD   PRO  19          2HD       PRO  19  -3.528  -6.027  12.708
  151   2HD   PRO  19          1HD       PRO  19  -5.154  -6.739  12.638
  152    H    LEU  20           H        LEU  20  -4.342  -3.362   8.042
  153    HA   LEU  20           HA       LEU  20  -1.527  -3.984   7.562
  154   1HB   LEU  20          2HB       LEU  20  -3.606  -2.681   5.802
  155   2HB   LEU  20          1HB       LEU  20  -1.962  -3.043   5.313
  156    HG   LEU  20           HG       LEU  20  -3.984  -5.123   6.153
  157   1HD1  LEU  20          1HD1      LEU  20  -3.045  -4.355   3.390
  158   2HD1  LEU  20          2HD1      LEU  20  -4.633  -3.999   4.073
  159   3HD1  LEU  20          3HD1      LEU  20  -4.148  -5.672   3.795
  160   1HD2  LEU  20          1HD2      LEU  20  -1.275  -5.380   4.852
  161   2HD2  LEU  20          2HD2      LEU  20  -2.378  -6.704   5.230
  162   3HD2  LEU  20          3HD2      LEU  20  -1.652  -5.760   6.531
  163    H    ARG  21           H        ARG  21   0.066  -2.472   7.362
  164    HA   ARG  21           HA       ARG  21  -0.448   0.184   8.418
  165   1HB   ARG  21          2HB       ARG  21   1.581  -1.182   9.035
  166   2HB   ARG  21          1HB       ARG  21   2.143  -0.990   7.382
  167   1HG   ARG  21          2HG       ARG  21   3.289   0.617   8.664
  168   2HG   ARG  21          1HG       ARG  21   2.053   1.496   7.761
  169   1HD   ARG  21          2HD       ARG  21   0.605   1.453   9.749
  170   2HD   ARG  21          1HD       ARG  21   1.880   0.628  10.645
  171    HE   ARG  21           HE       ARG  21   2.340   3.285   9.471
  172   1HH1  ARG  21          1HH1      ARG  21   2.211   1.173  12.273
  173   2HH1  ARG  21          2HH1      ARG  21   2.934   2.347  13.336
  174   1HH2  ARG  21          1HH2      ARG  21   3.280   4.812  10.854
  175   2HH2  ARG  21          2HH2      ARG  21   3.545   4.416  12.531
  176    H    TYR  22           H        TYR  22  -0.761   1.947   7.179
  177    HA   TYR  22           HA       TYR  22  -0.772   1.593   4.286
  178   1HB   TYR  22          2HB       TYR  22  -2.661   2.638   5.671
  179   2HB   TYR  22          1HB       TYR  22  -1.624   4.048   5.831
  180    HD1  TYR  22           1HD      TYR  22  -4.067   2.410   3.844
  181    HD2  TYR  22           2HD      TYR  22  -0.838   5.169   3.615
  182    HE1  TYR  22           1HE      TYR  22  -4.956   3.267   1.718
  183    HE2  TYR  22           2HE      TYR  22  -1.722   6.035   1.491
  184    HH   TYR  22           HH       TYR  22  -4.834   5.350   0.382
  185    H    LEU  23           H        LEU  23   1.247   1.789   3.460
  186    HA   LEU  23           HA       LEU  23   2.953   3.999   4.311
  187   1HB   LEU  23          2HB       LEU  23   3.394   1.633   2.510
  188   2HB   LEU  23          1HB       LEU  23   4.516   2.978   2.530
  189    HG   LEU  23           HG       LEU  23   4.800   2.571   5.006
  190   1HD1  LEU  23          1HD1      LEU  23   2.758   1.282   5.372
  191   2HD1  LEU  23          2HD1      LEU  23   4.195   0.394   5.879
  192   3HD1  LEU  23          3HD1      LEU  23   3.399  -0.010   4.358
  193   1HD2  LEU  23          1HD2      LEU  23   6.329   0.700   4.673
  194   2HD2  LEU  23          2HD2      LEU  23   6.451   1.879   3.367
  195   3HD2  LEU  23          3HD2      LEU  23   5.581   0.366   3.112
  196    H    GLU  24           H        GLU  24   2.458   5.887   3.477
  197    HA   GLU  24           HA       GLU  24   1.138   6.215   0.962
  198   1HB   GLU  24          2HB       GLU  24   2.391   8.229   2.837
  199   2HB   GLU  24          1HB       GLU  24   1.375   8.633   1.458
  200   1HG   GLU  24          2HG       GLU  24  -0.535   7.698   2.455
  201   2HG   GLU  24          1HG       GLU  24   0.417   6.864   3.684
  202    H    SER  25           H        SER  25   4.341   5.713   1.763
  203    HA   SER  25           HA       SER  25   5.573   7.493  -0.107
  204   1HB   SER  25          2HB       SER  25   7.617   6.054   0.412
  205   2HB   SER  25          1HB       SER  25   6.877   6.884   1.781
  206    HG   SER  25           HG       SER  25   7.433   4.457   1.859
  207    H    GLU  26           H        GLU  26   5.404   3.934  -0.019
  208    HA   GLU  26           HA       GLU  26   5.910   3.923  -2.913
  209   1HB   GLU  26          2HB       GLU  26   6.173   1.665  -0.923
  210   2HB   GLU  26          1HB       GLU  26   6.690   1.642  -2.603
  211   1HG   GLU  26          2HG       GLU  26   8.370   3.312  -2.148
  212   2HG   GLU  26          1HG       GLU  26   7.815   3.457  -0.481
  213    H    GLN  27           H        GLN  27   3.287   4.142  -1.261
  214    HA   GLN  27           HA       GLN  27   1.143   3.402  -1.294
  215   1HB   GLN  27          2HB       GLN  27   2.049   2.602  -4.052
  216   2HB   GLN  27          1HB       GLN  27   0.415   2.278  -3.497
  217   1HG   GLN  27          2HG       GLN  27   0.263   4.271  -4.706
  218   2HG   GLN  27          1HG       GLN  27   0.243   4.763  -3.016
  219   1HE2  GLN  27          1HE2      GLN  27   1.940   5.965  -2.208
  220   2HE2  GLN  27          2HE2      GLN  27   3.177   6.634  -3.209
  221    H    LEU  28           H        LEU  28   2.420   1.877   0.313
  222    HA   LEU  28           HA       LEU  28   1.967  -0.915  -0.512
  223   1HB   LEU  28          2HB       LEU  28   4.048   0.216   1.356
  224   2HB   LEU  28          1HB       LEU  28   3.717  -1.496   1.186
  225    HG   LEU  28           HG       LEU  28   4.701   0.296  -1.034
  226   1HD1  LEU  28          1HD1      LEU  28   6.166  -1.727   0.652
  227   2HD1  LEU  28          2HD1      LEU  28   6.388   0.022   0.689
  228   3HD1  LEU  28          3HD1      LEU  28   6.823  -0.890  -0.756
  229   1HD2  LEU  28          1HD2      LEU  28   5.098  -1.812  -2.219
  230   2HD2  LEU  28          2HD2      LEU  28   3.388  -1.585  -1.850
  231   3HD2  LEU  28          3HD2      LEU  28   4.358  -2.697  -0.885
  232    H    LEU  29           H        LEU  29   0.782  -2.181   0.773
  233    HA   LEU  29           HA       LEU  29   0.033  -1.147   3.431
  234   1HB   LEU  29          2HB       LEU  29  -1.337  -3.235   1.724
  235   2HB   LEU  29          1HB       LEU  29  -1.851  -2.748   3.327
  236    HG   LEU  29           HG       LEU  29  -1.803  -0.961   0.893
  237   1HD1  LEU  29          1HD1      LEU  29  -4.106  -2.264   2.337
  238   2HD1  LEU  29          2HD1      LEU  29  -3.519  -2.672   0.725
  239   3HD1  LEU  29          3HD1      LEU  29  -4.245  -1.092   1.026
  240   1HD2  LEU  29          1HD2      LEU  29  -2.844  -0.475   3.684
  241   2HD2  LEU  29          2HD2      LEU  29  -3.023   0.617   2.311
  242   3HD2  LEU  29          3HD2      LEU  29  -1.421   0.273   2.960
  243    H    VAL  30           H        VAL  30   1.335  -1.983   4.927
  244    HA   VAL  30           HA       VAL  30   2.408  -4.693   4.433
  245    HB   VAL  30           HB       VAL  30   3.726  -2.465   5.991
  246   1HG1  VAL  30          1HG1      VAL  30   4.766  -5.172   5.160
  247   2HG1  VAL  30          2HG1      VAL  30   4.348  -4.675   6.800
  248   3HG1  VAL  30          3HG1      VAL  30   5.702  -3.913   5.965
  249   1HG2  VAL  30          1HG2      VAL  30   3.642  -1.968   3.597
  250   2HG2  VAL  30          2HG2      VAL  30   4.391  -3.528   3.249
  251   3HG2  VAL  30          3HG2      VAL  30   5.288  -2.296   4.136
  252    H    ASN  31           H        ASN  31   1.811  -6.201   5.821
  253    HA   ASN  31           HA       ASN  31   0.763  -5.412   8.436
  254   1HB   ASN  31          2HB       ASN  31  -0.546  -7.063   7.205
  255   2HB   ASN  31          1HB       ASN  31   0.861  -8.110   7.060
  256   1HD2  ASN  31          1HD2      ASN  31  -0.249  -9.789   8.074
  257   2HD2  ASN  31          2HD2      ASN  31  -0.528  -9.798   9.780
  258    H    GLU  32           H        GLU  32   2.128  -5.224  10.040
  259    HA   GLU  32           HA       GLU  32   4.817  -6.186   9.876
  260   1HB   GLU  32          2HB       GLU  32   4.990  -5.186  12.187
  261   2HB   GLU  32          1HB       GLU  32   4.490  -4.078  10.917
  262   1HG   GLU  32          2HG       GLU  32   2.151  -4.361  11.622
  263   2HG   GLU  32          1HG       GLU  32   2.692  -5.405  12.934
  264    H    ARG  33           H        ARG  33   1.927  -7.518  10.960
  265    HA   ARG  33           HA       ARG  33   2.998  -9.195  13.026
  266   1HB   ARG  33          2HB       ARG  33   0.375  -9.179  11.534
  267   2HB   ARG  33          1HB       ARG  33   0.754 -10.359  12.781
  268   1HG   ARG  33          2HG       ARG  33   0.760  -8.758  14.469
  269   2HG   ARG  33          1HG       ARG  33   0.935  -7.424  13.328
  270   1HD   ARG  33          2HD       ARG  33  -1.335  -7.596  14.308
  271   2HD   ARG  33          1HD       ARG  33  -1.316  -7.717  12.552
  272    HE   ARG  33           HE       ARG  33  -1.350 -10.276  13.119
  273   1HH1  ARG  33          1HH1      ARG  33  -3.037  -7.724  14.835
  274   2HH1  ARG  33          2HH1      ARG  33  -4.403  -8.725  15.240
  275   1HH2  ARG  33          1HH2      ARG  33  -3.176 -11.584  13.621
  276   2HH2  ARG  33          2HH2      ARG  33  -4.486 -10.899  14.540
  277    H    LEU  34           H        LEU  34   2.612  -9.425   9.571
  278    HA   LEU  34           HA       LEU  34   3.516 -12.224   9.706
  279   1HB   LEU  34          2HB       LEU  34   1.556 -11.006   7.766
  280   2HB   LEU  34          1HB       LEU  34   2.235 -12.612   7.602
  281    HG   LEU  34           HG       LEU  34   0.509 -11.695   9.906
  282   1HD1  LEU  34          1HD1      LEU  34  -0.734 -11.830   7.801
  283   2HD1  LEU  34          2HD1      LEU  34  -1.209 -13.115   8.911
  284   3HD1  LEU  34          3HD1      LEU  34  -0.141 -13.473   7.554
  285   1HD2  LEU  34          1HD2      LEU  34   1.555 -14.427   9.164
  286   2HD2  LEU  34          2HD2      LEU  34   0.458 -14.062  10.496
  287   3HD2  LEU  34          3HD2      LEU  34   2.108 -13.441  10.519
  288    H    ASN  35           H        ASN  35   4.429  -9.203   8.807
  289    HA   ASN  35           HA       ASN  35   6.043  -8.336   7.462
  290   1HB   ASN  35          2HB       ASN  35   6.885 -11.237   7.421
  291   2HB   ASN  35          1HB       ASN  35   7.795  -9.979   6.592
  292   1HD2  ASN  35          1HD2      ASN  35   9.595 -10.349   7.874
  293   2HD2  ASN  35          2HD2      ASN  35   9.663  -9.856   9.528
  294    H    LEU  36           H        LEU  36   3.558  -8.825   6.282
  295    HA   LEU  36           HA       LEU  36   4.316  -9.633   3.553
  296   1HB   LEU  36          2HB       LEU  36   1.623  -9.861   4.905
  297   2HB   LEU  36          1HB       LEU  36   1.931 -10.233   3.220
  298    HG   LEU  36           HG       LEU  36   3.132 -11.687   5.578
  299   1HD1  LEU  36          1HD1      LEU  36   1.697 -13.535   4.907
  300   2HD1  LEU  36          2HD1      LEU  36   0.998 -12.546   3.625
  301   3HD1  LEU  36          3HD1      LEU  36   0.739 -12.112   5.314
  302   1HD2  LEU  36          1HD2      LEU  36   3.306 -12.278   2.625
  303   2HD2  LEU  36          2HD2      LEU  36   3.979 -13.256   3.929
  304   3HD2  LEU  36          3HD2      LEU  36   4.610 -11.638   3.627
  305    H    ALA  37           H        ALA  37   3.955  -8.234   1.943
  306    HA   ALA  37           HA       ALA  37   2.574  -5.716   2.609
  307   1HB   ALA  37          1HB       ALA  37   4.993  -5.396   2.511
  308   2HB   ALA  37          2HB       ALA  37   4.183  -4.542   1.199
  309   3HB   ALA  37          3HB       ALA  37   5.017  -6.061   0.877
  310    H    TYR  38           H        TYR  38   1.168  -4.914   1.201
  311    HA   TYR  38           HA       TYR  38   0.865  -6.223  -1.430
  312   1HB   TYR  38          2HB       TYR  38  -1.310  -4.905   0.225
  313   2HB   TYR  38          1HB       TYR  38  -1.526  -5.751  -1.301
  314    HD1  TYR  38           1HD      TYR  38  -0.855  -6.156   2.292
  315    HD2  TYR  38           2HD      TYR  38  -1.620  -8.154  -1.384
  316    HE1  TYR  38           1HE      TYR  38  -1.275  -8.242   3.522
  317    HE2  TYR  38           2HE      TYR  38  -2.031 -10.247  -0.163
  318    HH   TYR  38           HH       TYR  38  -1.506 -11.271   1.955
  319    H    ARG  39           H        ARG  39   0.286  -4.792  -3.191
  320    HA   ARG  39           HA       ARG  39   1.121  -2.037  -2.637
  321   1HB   ARG  39          2HB       ARG  39   1.374  -3.805  -4.976
  322   2HB   ARG  39          1HB       ARG  39   0.992  -2.128  -5.339
  323   1HG   ARG  39          2HG       ARG  39   2.937  -1.486  -3.875
  324   2HG   ARG  39          1HG       ARG  39   3.372  -3.196  -3.852
  325   1HD   ARG  39          2HD       ARG  39   3.701  -3.227  -6.203
  326   2HD   ARG  39          1HD       ARG  39   2.981  -1.626  -6.386
  327    HE   ARG  39           HE       ARG  39   5.327  -1.714  -4.707
  328   1HH1  ARG  39          1HH1      ARG  39   4.100  -1.294  -7.954
  329   2HH1  ARG  39          2HH1      ARG  39   5.473  -0.376  -8.488
  330   1HH2  ARG  39          1HH2      ARG  39   7.163  -0.532  -5.421
  331   2HH2  ARG  39          2HH2      ARG  39   7.227   0.008  -7.076
  332    H    ILE  40           H        ILE  40  -0.063  -0.291  -3.155
  333    HA   ILE  40           HA       ILE  40  -2.845  -0.712  -3.963
  334    HB   ILE  40           HB       ILE  40  -1.455   1.849  -3.131
  335   1HG1  ILE  40          2HG1      ILE  40  -3.260   0.052  -1.493
  336   2HG1  ILE  40          1HG1      ILE  40  -1.510   0.141  -1.327
  337   1HG2  ILE  40          1HG2      ILE  40  -3.427   2.229  -4.495
  338   2HG2  ILE  40          2HG2      ILE  40  -3.716   2.723  -2.830
  339   3HG2  ILE  40          3HG2      ILE  40  -4.385   1.204  -3.425
  340   1HD1  ILE  40          1HD1      ILE  40  -2.636   1.417   0.395
  341   2HD1  ILE  40          2HD1      ILE  40  -3.444   2.390  -0.835
  342   3HD1  ILE  40          3HD1      ILE  40  -1.690   2.472  -0.655
  343    H    ASP  41           H        ASP  41  -3.234  -0.678  -6.099
  344    HA   ASP  41           HA       ASP  41  -1.305   0.745  -7.813
  345   1HB   ASP  41          2HB       ASP  41  -1.419  -1.748  -8.026
  346   2HB   ASP  41          1HB       ASP  41  -3.084  -1.577  -8.573
  347    H    ASP  42           H        ASP  42  -2.047   2.563  -8.601
  348    HA   ASP  42           HA       ASP  42  -3.375   4.187  -9.450
  349   1HB   ASP  42          2HB       ASP  42  -3.675   2.435 -11.241
  350   2HB   ASP  42          1HB       ASP  42  -5.160   1.947 -10.427
  351    H    GLY  43           H        GLY  43  -3.757   3.437  -6.766
  352   1HA   GLY  43          2HA       GLY  43  -5.150   4.311  -5.118
  353   2HA   GLY  43          1HA       GLY  43  -6.362   4.632  -6.346
  354    H    ILE  44           H        ILE  44  -5.465   1.528  -6.855
  355    HA   ILE  44           HA       ILE  44  -7.652   0.517  -5.167
  356    HB   ILE  44           HB       ILE  44  -6.477  -0.672  -7.688
  357   1HG1  ILE  44          2HG1      ILE  44  -9.172   0.601  -7.177
  358   2HG1  ILE  44          1HG1      ILE  44  -7.845   1.353  -8.058
  359   1HG2  ILE  44          1HG2      ILE  44  -8.823  -1.599  -6.030
  360   2HG2  ILE  44          2HG2      ILE  44  -7.251  -2.391  -6.125
  361   3HG2  ILE  44          3HG2      ILE  44  -8.282  -2.309  -7.553
  362   1HD1  ILE  44          1HD1      ILE  44  -9.340  -1.135  -8.862
  363   2HD1  ILE  44          2HD1      ILE  44  -7.987  -0.418  -9.743
  364   3HD1  ILE  44          3HD1      ILE  44  -9.502   0.471  -9.574
  365    HA   PRO  45           HA       PRO  45  -4.256  -1.492  -2.974
  366   1HB   PRO  45          2HB       PRO  45  -5.823  -2.456  -0.961
  367   2HB   PRO  45          1HB       PRO  45  -5.199  -0.805  -0.997
  368   1HG   PRO  45          2HG       PRO  45  -7.911  -1.824  -1.731
  369   2HG   PRO  45          1HG       PRO  45  -7.463  -0.348  -0.856
  370   1HD   PRO  45          2HD       PRO  45  -8.156  -0.359  -3.484
  371   2HD   PRO  45          1HD       PRO  45  -7.022   0.815  -2.789
  372    H    VAL  46           H        VAL  46  -3.615  -3.292  -4.014
  373    HA   VAL  46           HA       VAL  46  -5.505  -5.279  -4.875
  374    HB   VAL  46           HB       VAL  46  -2.486  -5.387  -4.981
  375   1HG1  VAL  46          1HG1      VAL  46  -4.572  -6.907  -6.539
  376   2HG1  VAL  46          2HG1      VAL  46  -3.570  -7.561  -5.244
  377   3HG1  VAL  46          3HG1      VAL  46  -2.826  -7.023  -6.751
  378   1HG2  VAL  46          1HG2      VAL  46  -3.309  -3.417  -6.157
  379   2HG2  VAL  46          2HG2      VAL  46  -4.448  -4.415  -7.062
  380   3HG2  VAL  46          3HG2      VAL  46  -2.713  -4.620  -7.300
  381    H    LEU  47           H        LEU  47  -6.388  -6.128  -2.994
  382    HA   LEU  47           HA       LEU  47  -4.551  -7.431  -1.130
  383   1HB   LEU  47          2HB       LEU  47  -7.510  -6.897  -0.872
  384   2HB   LEU  47          1HB       LEU  47  -6.500  -7.629   0.359
  385    HG   LEU  47           HG       LEU  47  -6.256  -4.802  -0.677
  386   1HD1  LEU  47          1HD1      LEU  47  -7.182  -5.851   1.995
  387   2HD1  LEU  47          2HD1      LEU  47  -8.220  -5.173   0.740
  388   3HD1  LEU  47          3HD1      LEU  47  -7.020  -4.155   1.539
  389   1HD2  LEU  47          1HD2      LEU  47  -4.597  -4.521   1.101
  390   2HD2  LEU  47          2HD2      LEU  47  -4.086  -5.728  -0.079
  391   3HD2  LEU  47          3HD2      LEU  47  -4.720  -6.236   1.486
  392    H    LEU  48           H        LEU  48  -4.066  -9.107  -2.645
  393    HA   LEU  48           HA       LEU  48  -6.154 -11.177  -2.705
  394   1HB   LEU  48          2HB       LEU  48  -3.835 -10.827  -4.604
  395   2HB   LEU  48          1HB       LEU  48  -4.997 -12.138  -4.653
  396    HG   LEU  48           HG       LEU  48  -5.608  -9.223  -5.147
  397   1HD1  LEU  48          1HD1      LEU  48  -4.334 -10.245  -6.951
  398   2HD1  LEU  48          2HD1      LEU  48  -6.000  -9.948  -7.451
  399   3HD1  LEU  48          3HD1      LEU  48  -5.483 -11.579  -7.025
  400   1HD2  LEU  48          1HD2      LEU  48  -7.491 -10.369  -4.108
  401   2HD2  LEU  48          2HD2      LEU  48  -7.386 -11.656  -5.308
  402   3HD2  LEU  48          3HD2      LEU  48  -7.831 -10.024  -5.804
  403    H    ILE  49           H        ILE  49  -5.454 -13.335  -2.332
  404    HA   ILE  49           HA       ILE  49  -3.815 -13.575  -0.101
  405    HB   ILE  49           HB       ILE  49  -4.800 -15.634  -2.060
  406   1HG1  ILE  49          2HG1      ILE  49  -5.568 -14.866   0.764
  407   2HG1  ILE  49          1HG1      ILE  49  -6.505 -14.583  -0.702
  408   1HG2  ILE  49          1HG2      ILE  49  -3.290 -16.150   0.500
  409   2HG2  ILE  49          2HG2      ILE  49  -2.726 -16.501  -1.134
  410   3HG2  ILE  49          3HG2      ILE  49  -4.110 -17.370  -0.473
  411   1HD1  ILE  49          1HD1      ILE  49  -6.762 -17.005  -0.968
  412   2HD1  ILE  49          2HD1      ILE  49  -7.421 -16.417   0.557
  413   3HD1  ILE  49          3HD1      ILE  49  -5.866 -17.251   0.531
  414    H    ASP  50           H        ASP  50  -3.034 -14.324  -3.493
  415    HA   ASP  50           HA       ASP  50  -0.335 -15.070  -2.694
  416   1HB   ASP  50          2HB       ASP  50  -1.791 -15.199  -5.325
  417   2HB   ASP  50          1HB       ASP  50  -0.062 -15.503  -5.197
  418    H    GLU  51           H        GLU  51  -1.613 -12.219  -2.917
  419    HA   GLU  51           HA       GLU  51   0.531 -10.958  -4.452
  420   1HB   GLU  51          2HB       GLU  51  -1.947  -9.912  -3.103
  421   2HB   GLU  51          1HB       GLU  51  -0.677  -8.829  -3.653
  422   1HG   GLU  51          2HG       GLU  51  -2.159 -10.777  -5.401
  423   2HG   GLU  51          1HG       GLU  51  -2.524  -9.058  -5.261
  424    H    ALA  52           H        ALA  52  -0.021 -12.144  -1.417
  425    HA   ALA  52           HA       ALA  52   1.191 -10.138   0.198
  426   1HB   ALA  52          1HB       ALA  52   1.205 -11.813   1.945
  427   2HB   ALA  52          2HB       ALA  52   0.873 -13.083   0.766
  428   3HB   ALA  52          3HB       ALA  52  -0.337 -11.843   1.092
  429    H    THR  53           H        THR  53   3.166  -9.532  -0.512
  430    HA   THR  53           HA       THR  53   5.208 -11.564  -0.966
  431    HB   THR  53           HB       THR  53   6.635  -9.580  -1.592
  432    HG1  THR  53           1HG      THR  53   4.151  -8.179  -1.400
  433   1HG2  THR  53          1HG2      THR  53   5.500  -9.191  -3.741
  434   2HG2  THR  53          2HG2      THR  53   4.041  -9.946  -3.096
  435   3HG2  THR  53          3HG2      THR  53   5.513 -10.897  -3.300
  436    H    GLU  54           H        GLU  54   7.047 -11.774   0.315
  437    HA   GLU  54           HA       GLU  54   6.770 -10.893   3.037
  438   1HB   GLU  54          2HB       GLU  54   9.039 -12.327   1.637
  439   2HB   GLU  54          1HB       GLU  54   8.922 -12.080   3.376
  440   1HG   GLU  54          2HG       GLU  54   6.885 -13.406   3.445
  441   2HG   GLU  54          1HG       GLU  54   6.960 -13.632   1.698
  442    H    TRP  55           H        TRP  55   7.564  -9.099   3.913
  443    HA   TRP  55           HA       TRP  55   9.323  -7.444   2.220
  444   1HB   TRP  55          2HB       TRP  55   6.843  -6.786   2.512
  445   2HB   TRP  55          1HB       TRP  55   7.291  -6.348   4.155
  446    HD1  TRP  55           HD       TRP  55   7.992  -3.896   4.445
  447    HE1  TRP  55           1HE      TRP  55   8.835  -2.019   2.889
  448    HE3  TRP  55           3HE      TRP  55   8.360  -6.557   0.094
  449    HZ2  TRP  55           2HZ      TRP  55   9.557  -1.721   0.179
  450    HZ3  TRP  55           3HZ      TRP  55   9.137  -5.403  -1.931
  451    HH2  TRP  55           HH       TRP  55   9.724  -3.035  -1.891
  452    H    THR  56           H        THR  56  10.328  -5.620   3.580
  453    HA   THR  56           HA       THR  56  12.098  -6.635   5.456
  454    HB   THR  56           HB       THR  56  11.234  -3.756   5.401
  455    HG1  THR  56           1HG      THR  56  12.191  -3.487   3.483
  456   1HG2  THR  56          1HG2      THR  56  13.919  -5.086   5.780
  457   2HG2  THR  56          2HG2      THR  56  12.929  -4.372   7.054
  458   3HG2  THR  56          3HG2      THR  56  13.622  -3.347   5.796
  459    HA   PRO  57           HA       PRO  57   9.453  -6.992   9.060
  460   1HB   PRO  57          2HB       PRO  57  11.521  -7.184  10.880
  461   2HB   PRO  57          1HB       PRO  57  10.861  -8.543   9.963
  462   1HG   PRO  57          2HG       PRO  57  13.308  -6.909   9.445
  463   2HG   PRO  57          1HG       PRO  57  13.062  -8.655   9.257
  464   1HD   PRO  57          2HD       PRO  57  13.058  -6.987   7.150
  465   2HD   PRO  57          1HD       PRO  57  12.004  -8.415   7.214
  466    H    ASN  58           H        ASN  58   8.528  -5.408  10.176
  467    HA   ASN  58           HA       ASN  58   9.530  -2.765  10.093
  468   1HB   ASN  58          2HB       ASN  58   7.137  -3.209  10.157
  469   2HB   ASN  58          1HB       ASN  58   7.289  -3.947  11.749
  470   1HD2  ASN  58          1HD2      ASN  58   5.738  -2.437  12.510
  471   2HD2  ASN  58          2HD2      ASN  58   6.194  -0.812  12.867
  472    H    ASN  59           H        ASN  59  11.067  -1.907  11.263
  473    HA   ASN  59           HA       ASN  59  12.124  -3.209  13.568
  474   1HB   ASN  59          2HB       ASN  59  13.642  -2.111  12.050
  475   2HB   ASN  59          1HB       ASN  59  12.797  -0.582  12.242
  476   1HD2  ASN  59          1HD2      ASN  59  13.302   0.730  13.924
  477   2HD2  ASN  59          2HD2      ASN  59  14.541   0.384  15.085
  478    H    LEU  60           H        LEU  60   9.609  -1.144  13.141
  479    HA   LEU  60           HA       LEU  60   9.800   0.176  15.722
  480   1HB   LEU  60          2HB       LEU  60   7.554   0.144  13.698
  481   2HB   LEU  60          1HB       LEU  60   7.577   1.111  15.160
  482    HG   LEU  60           HG       LEU  60   9.509   1.391  12.853
  483   1HD1  LEU  60          1HD1      LEU  60   7.249   2.124  12.290
  484   2HD1  LEU  60          2HD1      LEU  60   8.359   3.489  12.415
  485   3HD1  LEU  60          3HD1      LEU  60   7.224   3.153  13.723
  486   1HD2  LEU  60          1HD2      LEU  60   9.170   3.034  15.360
  487   2HD2  LEU  60          2HD2      LEU  60  10.246   3.413  14.017
  488   3HD2  LEU  60          3HD2      LEU  60  10.526   1.970  14.989
  489    H    GLU  61           H        GLU  61   9.946  -1.824  16.915
  490    HA   GLU  61           HA       GLU  61   7.571  -3.513  16.983
  491   1HB   GLU  61          2HB       GLU  61  10.217  -4.095  17.155
  492   2HB   GLU  61          1HB       GLU  61   9.825  -3.970  18.862
  493   1HG   GLU  61          2HG       GLU  61   8.255  -5.713  16.993
  494   2HG   GLU  61          1HG       GLU  61   9.726  -6.272  17.786
  Start of MODEL    4
    1   1H    MET   1          1HT       MET   1 -12.551  20.274   3.240
    2   2H    MET   1          2HT       MET   1 -12.781  20.241   4.918
    3   3H    MET   1          3HT       MET   1 -13.293  18.934   3.971
    4    HA   MET   1           HA       MET   1 -11.050  18.383   3.405
    5   1HB   MET   1          2HB       MET   1  -9.165  19.579   4.327
    6   2HB   MET   1          1HB       MET   1 -10.194  20.722   3.480
    7   1HG   MET   1          2HG       MET   1 -10.165  20.320   6.466
    8   2HG   MET   1          1HG       MET   1  -9.289  21.585   5.608
    9   1HE   MET   1          1HE       MET   1 -12.144  23.556   7.420
   10   2HE   MET   1          2HE       MET   1 -10.408  23.443   7.143
   11   3HE   MET   1          3HE       MET   1 -11.245  22.166   8.022
   12    H    SER   2           H        SER   2 -10.139  16.756   4.607
   13    HA   SER   2           HA       SER   2 -10.058  16.520   7.378
   14   1HB   SER   2          2HB       SER   2 -12.515  16.546   7.313
   15   2HB   SER   2          1HB       SER   2 -12.517  15.245   6.124
   16    HG   SER   2           HG       SER   2 -12.081  13.824   7.646
   17    H    LEU   3           H        LEU   3  -9.452  14.272   8.028
   18    HA   LEU   3           HA       LEU   3  -8.066  12.800   6.041
   19   1HB   LEU   3          2HB       LEU   3  -9.000  12.098   8.816
   20   2HB   LEU   3          1HB       LEU   3  -8.205  10.920   7.793
   21    HG   LEU   3           HG       LEU   3  -6.251  12.532   7.652
   22   1HD1  LEU   3          1HD1      LEU   3  -7.390  14.555   8.361
   23   2HD1  LEU   3          2HD1      LEU   3  -6.054  14.178   9.450
   24   3HD1  LEU   3          3HD1      LEU   3  -7.714  13.838   9.940
   25   1HD2  LEU   3          1HD2      LEU   3  -5.358  11.849   9.817
   26   2HD2  LEU   3          2HD2      LEU   3  -6.222  10.522   9.039
   27   3HD2  LEU   3          3HD2      LEU   3  -6.979  11.415  10.357
   28    H    ASP   4           H        ASP   4  -8.707  10.983   4.866
   29    HA   ASP   4           HA       ASP   4 -11.637  10.684   4.777
   30   1HB   ASP   4          2HB       ASP   4 -10.459  11.977   2.879
   31   2HB   ASP   4          1HB       ASP   4  -9.879  10.398   2.359
   32    HA   PRO   5           HA       PRO   5 -10.036   6.449   5.472
   33   1HB   PRO   5          2HB       PRO   5 -12.153   5.615   6.941
   34   2HB   PRO   5          1HB       PRO   5 -10.801   6.517   7.637
   35   1HG   PRO   5          2HG       PRO   5 -13.503   7.491   6.810
   36   2HG   PRO   5          1HG       PRO   5 -12.557   7.905   8.252
   37   1HD   PRO   5          2HD       PRO   5 -12.696   9.507   6.058
   38   2HD   PRO   5          1HD       PRO   5 -11.285   9.447   7.131
   39    H    GLN   6           H        GLN   6 -12.576   7.817   3.754
   40    HA   GLN   6           HA       GLN   6 -13.832   5.323   2.978
   41   1HB   GLN   6          2HB       GLN   6 -14.218   8.069   1.777
   42   2HB   GLN   6          1HB       GLN   6 -15.278   6.677   1.596
   43   1HG   GLN   6          2HG       GLN   6 -14.773   8.257   4.104
   44   2HG   GLN   6          1HG       GLN   6 -16.251   8.220   3.145
   45   1HE2  GLN   6          1HE2      GLN   6 -15.778   7.578   5.964
   46   2HE2  GLN   6          2HE2      GLN   6 -16.339   5.950   6.179
   47    H    LEU   7           H        LEU   7 -11.393   7.526   1.840
   48    HA   LEU   7           HA       LEU   7 -11.055   6.125  -0.669
   49   1HB   LEU   7          2HB       LEU   7  -9.291   8.147   0.720
   50   2HB   LEU   7          1HB       LEU   7  -9.035   7.538  -0.903
   51    HG   LEU   7           HG       LEU   7 -11.383   9.202   0.015
   52   1HD1  LEU   7          1HD1      LEU   7  -9.326  10.483  -0.137
   53   2HD1  LEU   7          2HD1      LEU   7 -10.430  10.917  -1.442
   54   3HD1  LEU   7          3HD1      LEU   7  -9.046   9.871  -1.768
   55   1HD2  LEU   7          1HD2      LEU   7 -12.016   7.601  -1.716
   56   2HD2  LEU   7          2HD2      LEU   7 -10.690   8.169  -2.729
   57   3HD2  LEU   7          3HD2      LEU   7 -12.021   9.252  -2.331
   58    H    LEU   8           H        LEU   8 -10.620   5.168   2.335
   59    HA   LEU   8           HA       LEU   8  -8.103   3.744   1.794
   60   1HB   LEU   8          2HB       LEU   8  -9.299   4.490   4.464
   61   2HB   LEU   8          1HB       LEU   8  -7.815   3.586   4.229
   62    HG   LEU   8           HG       LEU   8  -8.267   6.452   3.390
   63   1HD1  LEU   8          1HD1      LEU   8  -6.657   5.282   5.656
   64   2HD1  LEU   8          2HD1      LEU   8  -8.146   6.217   5.805
   65   3HD1  LEU   8          3HD1      LEU   8  -6.681   6.979   5.182
   66   1HD2  LEU   8          1HD2      LEU   8  -5.860   6.458   2.934
   67   2HD2  LEU   8          2HD2      LEU   8  -6.715   5.308   1.908
   68   3HD2  LEU   8          3HD2      LEU   8  -5.791   4.733   3.293
   69    H    GLU   9           H        GLU   9 -11.395   3.507   3.026
   70    HA   GLU   9           HA       GLU   9 -12.805   1.762   3.336
   71   1HB   GLU   9          2HB       GLU   9 -10.762   0.444   1.579
   72   2HB   GLU   9          1HB       GLU   9 -12.059  -0.502   2.296
   73   1HG   GLU   9          2HG       GLU   9 -12.455   1.918   0.551
   74   2HG   GLU   9          1HG       GLU   9 -12.547   0.243   0.004
   75    H    VAL  10           H        VAL  10 -12.604  -0.796   4.075
   76    HA   VAL  10           HA       VAL  10 -11.223  -0.648   6.611
   77    HB   VAL  10           HB       VAL  10 -12.796  -2.957   5.456
   78   1HG1  VAL  10          1HG1      VAL  10 -11.278  -3.650   7.220
   79   2HG1  VAL  10          2HG1      VAL  10 -12.945  -3.718   7.785
   80   3HG1  VAL  10          3HG1      VAL  10 -11.901  -2.387   8.280
   81   1HG2  VAL  10          1HG2      VAL  10 -14.200  -0.985   5.667
   82   2HG2  VAL  10          2HG2      VAL  10 -13.680  -0.773   7.339
   83   3HG2  VAL  10          3HG2      VAL  10 -14.634  -2.185   6.883
   84    H    LEU  11           H        LEU  11  -9.064  -0.769   6.294
   85    HA   LEU  11           HA       LEU  11  -7.979  -2.719   4.442
   86   1HB   LEU  11          2HB       LEU  11  -6.656  -0.606   6.132
   87   2HB   LEU  11          1HB       LEU  11  -5.787  -1.691   5.065
   88    HG   LEU  11           HG       LEU  11  -7.873   0.310   4.189
   89   1HD1  LEU  11          1HD1      LEU  11  -5.810   1.376   4.955
   90   2HD1  LEU  11          2HD1      LEU  11  -6.014   1.530   3.209
   91   3HD1  LEU  11          3HD1      LEU  11  -4.878   0.350   3.863
   92   1HD2  LEU  11          1HD2      LEU  11  -6.087  -1.531   2.597
   93   2HD2  LEU  11          2HD2      LEU  11  -7.101  -0.255   1.919
   94   3HD2  LEU  11          3HD2      LEU  11  -7.845  -1.632   2.738
   95    H    ALA  12           H        ALA  12  -8.020  -4.715   5.197
   96    HA   ALA  12           HA       ALA  12  -6.381  -5.294   7.551
   97   1HB   ALA  12          1HB       ALA  12  -8.671  -5.432   8.348
   98   2HB   ALA  12          2HB       ALA  12  -7.971  -7.047   8.258
   99   3HB   ALA  12          3HB       ALA  12  -9.095  -6.503   7.014
  100    H    CYS  13           H        CYS  13  -5.243  -7.229   7.390
  101    HA   CYS  13           HA       CYS  13  -4.767  -8.090   4.697
  102   1HB   CYS  13          2HB       CYS  13  -3.147  -9.676   5.843
  103   2HB   CYS  13          1HB       CYS  13  -2.855  -7.958   6.095
  104    HG   CYS  13           HG       CYS  13  -3.787  -7.866   8.670
  105    HA   PRO  14           HA       PRO  14  -7.876 -11.225   4.504
  106   1HB   PRO  14          2HB       PRO  14  -5.989 -12.527   2.620
  107   2HB   PRO  14          1HB       PRO  14  -7.678 -12.068   2.384
  108   1HG   PRO  14          2HG       PRO  14  -5.709 -10.664   1.262
  109   2HG   PRO  14          1HG       PRO  14  -7.153  -9.864   1.913
  110   1HD   PRO  14          2HD       PRO  14  -4.404 -10.056   3.073
  111   2HD   PRO  14          1HD       PRO  14  -5.551  -8.702   3.103
  112    H    LYS  15           H        LYS  15  -4.488 -12.056   4.970
  113    HA   LYS  15           HA       LYS  15  -5.018 -14.789   5.664
  114   1HB   LYS  15          2HB       LYS  15  -2.532 -13.102   5.975
  115   2HB   LYS  15          1HB       LYS  15  -2.614 -14.820   6.340
  116   1HG   LYS  15          2HG       LYS  15  -3.261 -15.221   3.966
  117   2HG   LYS  15          1HG       LYS  15  -2.959 -13.510   3.655
  118   1HD   LYS  15          2HD       LYS  15  -1.021 -14.856   3.045
  119   2HD   LYS  15          1HD       LYS  15  -0.643 -13.785   4.393
  120   1HE   LYS  15          2HE       LYS  15  -0.850 -15.596   5.961
  121   2HE   LYS  15          1HE       LYS  15  -1.431 -16.680   4.700
  122   1HZ   LYS  15          1HZ       LYS  15   1.290 -15.491   4.870
  123   2HZ   LYS  15          2HZ       LYS  15   0.734 -16.477   3.612
  124   3HZ   LYS  15          3HZ       LYS  15   0.876 -17.103   5.182
  125    H    ASP  16           H        ASP  16  -3.762 -12.039   7.547
  126    HA   ASP  16           HA       ASP  16  -4.023 -13.607   9.977
  127   1HB   ASP  16          2HB       ASP  16  -1.943 -12.422   9.582
  128   2HB   ASP  16          1HB       ASP  16  -2.801 -10.899   9.418
  129    H    LYS  17           H        LYS  17  -5.702 -11.109   8.324
  130    HA   LYS  17           HA       LYS  17  -7.549  -9.885   8.771
  131   1HB   LYS  17          2HB       LYS  17  -7.769 -12.055  10.764
  132   2HB   LYS  17          1HB       LYS  17  -8.691 -10.601  11.122
  133   1HG   LYS  17          2HG       LYS  17 -10.112 -12.101   9.936
  134   2HG   LYS  17          1HG       LYS  17  -9.716 -10.763   8.859
  135   1HD   LYS  17          2HD       LYS  17  -9.554 -12.730   7.557
  136   2HD   LYS  17          1HD       LYS  17  -7.895 -12.238   7.907
  137   1HE   LYS  17          2HE       LYS  17  -7.732 -13.891   9.656
  138   2HE   LYS  17          1HE       LYS  17  -9.429 -14.325   9.452
  139   1HZ   LYS  17          1HZ       LYS  17  -8.851 -14.982   7.131
  140   2HZ   LYS  17          2HZ       LYS  17  -8.124 -15.943   8.327
  141   3HZ   LYS  17          3HZ       LYS  17  -7.216 -14.763   7.523
  142    H    GLY  18           H        GLY  18  -4.821  -9.365   9.962
  143   1HA   GLY  18          2HA       GLY  18  -5.536  -7.624  12.197
  144   2HA   GLY  18          1HA       GLY  18  -3.907  -7.999  11.654
  145    HA   PRO  19           HA       PRO  19  -5.663  -3.845   9.997
  146   1HB   PRO  19          2HB       PRO  19  -4.085  -2.178  11.486
  147   2HB   PRO  19          1HB       PRO  19  -5.717  -2.662  11.958
  148   1HG   PRO  19          2HG       PRO  19  -3.081  -3.738  12.867
  149   2HG   PRO  19          1HG       PRO  19  -4.544  -3.410  13.813
  150   1HD   PRO  19          2HD       PRO  19  -3.859  -5.899  13.039
  151   2HD   PRO  19          1HD       PRO  19  -5.552  -5.387  13.174
  152    H    LEU  20           H        LEU  20  -4.709  -2.974   8.259
  153    HA   LEU  20           HA       LEU  20  -1.950  -3.695   7.696
  154   1HB   LEU  20          2HB       LEU  20  -4.113  -2.437   6.020
  155   2HB   LEU  20          1HB       LEU  20  -2.468  -2.658   5.451
  156    HG   LEU  20           HG       LEU  20  -4.305  -4.886   6.323
  157   1HD1  LEU  20          1HD1      LEU  20  -3.488  -3.990   3.565
  158   2HD1  LEU  20          2HD1      LEU  20  -5.093  -3.831   4.279
  159   3HD1  LEU  20          3HD1      LEU  20  -4.430  -5.431   3.945
  160   1HD2  LEU  20          1HD2      LEU  20  -1.968  -5.422   6.667
  161   2HD2  LEU  20          2HD2      LEU  20  -1.587  -4.914   5.023
  162   3HD2  LEU  20          3HD2      LEU  20  -2.603  -6.329   5.295
  163    H    ARG  21           H        ARG  21  -0.285  -2.339   7.670
  164    HA   ARG  21           HA       ARG  21  -0.698   0.386   8.559
  165   1HB   ARG  21          2HB       ARG  21   1.833  -1.146   7.918
  166   2HB   ARG  21          1HB       ARG  21   1.786   0.491   8.565
  167   1HG   ARG  21          2HG       ARG  21   0.682  -0.319  10.574
  168   2HG   ARG  21          1HG       ARG  21   0.686  -1.961   9.929
  169   1HD   ARG  21          2HD       ARG  21   2.504  -1.652  11.520
  170   2HD   ARG  21          1HD       ARG  21   3.134  -1.941   9.899
  171    HE   ARG  21           HE       ARG  21   3.114   0.724   9.974
  172   1HH1  ARG  21          1HH1      ARG  21   4.263  -1.612  12.333
  173   2HH1  ARG  21          2HH1      ARG  21   5.490  -0.556  12.960
  174   1HH2  ARG  21          1HH2      ARG  21   4.748   2.074  10.748
  175   2HH2  ARG  21          2HH2      ARG  21   5.772   1.546  12.048
  176    H    TYR  22           H        TYR  22  -0.638   2.123   7.309
  177    HA   TYR  22           HA       TYR  22  -0.592   1.638   4.432
  178   1HB   TYR  22          2HB       TYR  22  -2.541   2.751   5.622
  179   2HB   TYR  22          1HB       TYR  22  -1.486   4.129   5.886
  180    HD1  TYR  22           1HD      TYR  22  -3.404   2.242   3.420
  181    HD2  TYR  22           2HD      TYR  22  -0.863   5.593   4.035
  182    HE1  TYR  22           1HE      TYR  22  -4.079   3.142   1.236
  183    HE2  TYR  22           2HE      TYR  22  -1.530   6.503   1.849
  184    HH   TYR  22           HH       TYR  22  -4.186   5.279   0.084
  185    H    LEU  23           H        LEU  23   1.233   2.053   3.374
  186    HA   LEU  23           HA       LEU  23   2.963   4.221   4.351
  187   1HB   LEU  23          2HB       LEU  23   3.520   1.860   2.562
  188   2HB   LEU  23          1HB       LEU  23   4.631   3.205   2.707
  189    HG   LEU  23           HG       LEU  23   5.451   1.499   4.120
  190   1HD1  LEU  23          1HD1      LEU  23   4.002   3.551   5.777
  191   2HD1  LEU  23          2HD1      LEU  23   5.628   3.681   5.098
  192   3HD1  LEU  23          3HD1      LEU  23   5.291   2.500   6.366
  193   1HD2  LEU  23          1HD2      LEU  23   3.422   0.140   4.270
  194   2HD2  LEU  23          2HD2      LEU  23   2.714   1.320   5.377
  195   3HD2  LEU  23          3HD2      LEU  23   4.146   0.408   5.856
  196    H    GLU  24           H        GLU  24   2.143   6.042   3.490
  197    HA   GLU  24           HA       GLU  24   0.925   6.259   0.968
  198   1HB   GLU  24          2HB       GLU  24   2.312   8.460   2.502
  199   2HB   GLU  24          1HB       GLU  24   1.075   8.658   1.269
  200   1HG   GLU  24          2HG       GLU  24  -0.232   8.896   3.089
  201   2HG   GLU  24          1HG       GLU  24  -0.295   7.140   2.971
  202    H    SER  25           H        SER  25   4.247   6.666   1.998
  203    HA   SER  25           HA       SER  25   5.320   8.145  -0.039
  204   1HB   SER  25          2HB       SER  25   6.733   5.853   1.316
  205   2HB   SER  25          1HB       SER  25   7.452   7.326   0.668
  206    HG   SER  25           HG       SER  25   7.175   7.403   2.960
  207    H    GLU  26           H        GLU  26   4.680   4.656  -0.070
  208    HA   GLU  26           HA       GLU  26   5.518   4.624  -2.886
  209   1HB   GLU  26          2HB       GLU  26   7.245   3.698  -1.220
  210   2HB   GLU  26          1HB       GLU  26   6.134   2.351  -1.011
  211   1HG   GLU  26          2HG       GLU  26   6.357   1.706  -3.282
  212   2HG   GLU  26          1HG       GLU  26   7.225   3.187  -3.683
  213    H    GLN  27           H        GLN  27   2.968   4.427  -1.059
  214    HA   GLN  27           HA       GLN  27   0.902   3.491  -1.178
  215   1HB   GLN  27          2HB       GLN  27   1.823   2.755  -3.961
  216   2HB   GLN  27          1HB       GLN  27   0.161   2.691  -3.399
  217   1HG   GLN  27          2HG       GLN  27   1.847   5.176  -3.559
  218   2HG   GLN  27          1HG       GLN  27   0.629   4.690  -4.737
  219   1HE2  GLN  27          1HE2      GLN  27   1.213   6.035  -1.608
  220   2HE2  GLN  27          2HE2      GLN  27  -0.421   6.484  -1.259
  221    H    LEU  28           H        LEU  28   2.097   1.953   0.403
  222    HA   LEU  28           HA       LEU  28   1.703  -0.792  -0.577
  223   1HB   LEU  28          2HB       LEU  28   3.956   0.234   1.144
  224   2HB   LEU  28          1HB       LEU  28   3.582  -1.467   0.952
  225    HG   LEU  28           HG       LEU  28   4.394   0.385  -1.292
  226   1HD1  LEU  28          1HD1      LEU  28   5.957  -1.757   0.146
  227   2HD1  LEU  28          2HD1      LEU  28   6.221  -0.020   0.288
  228   3HD1  LEU  28          3HD1      LEU  28   6.510  -0.834  -1.251
  229   1HD2  LEU  28          1HD2      LEU  28   2.949  -1.435  -2.037
  230   2HD2  LEU  28          2HD2      LEU  28   3.984  -2.605  -1.217
  231   3HD2  LEU  28          3HD2      LEU  28   4.606  -1.686  -2.588
  232    H    LEU  29           H        LEU  29   0.847  -2.243   0.871
  233    HA   LEU  29           HA       LEU  29   0.038  -1.170   3.498
  234   1HB   LEU  29          2HB       LEU  29  -1.362  -3.191   1.741
  235   2HB   LEU  29          1HB       LEU  29  -1.855  -2.791   3.377
  236    HG   LEU  29           HG       LEU  29  -1.785  -0.838   1.074
  237   1HD1  LEU  29          1HD1      LEU  29  -4.245  -0.965   1.207
  238   2HD1  LEU  29          2HD1      LEU  29  -4.092  -2.290   2.362
  239   3HD1  LEU  29          3HD1      LEU  29  -3.510  -2.488   0.709
  240   1HD2  LEU  29          1HD2      LEU  29  -3.020   0.622   2.593
  241   2HD2  LEU  29          2HD2      LEU  29  -1.436   0.208   3.251
  242   3HD2  LEU  29          3HD2      LEU  29  -2.883  -0.586   3.871
  243    H    VAL  30           H        VAL  30   1.261  -2.039   5.040
  244    HA   VAL  30           HA       VAL  30   2.201  -4.815   4.664
  245    HB   VAL  30           HB       VAL  30   3.651  -2.623   6.156
  246   1HG1  VAL  30          1HG1      VAL  30   5.550  -4.184   6.115
  247   2HG1  VAL  30          2HG1      VAL  30   4.522  -5.394   5.349
  248   3HG1  VAL  30          3HG1      VAL  30   4.164  -4.842   6.986
  249   1HG2  VAL  30          1HG2      VAL  30   5.224  -2.565   4.285
  250   2HG2  VAL  30          2HG2      VAL  30   3.598  -2.111   3.773
  251   3HG2  VAL  30          3HG2      VAL  30   4.222  -3.719   3.402
  252    H    ASN  31           H        ASN  31   1.777  -6.237   6.276
  253    HA   ASN  31           HA       ASN  31   0.733  -5.128   8.790
  254   1HB   ASN  31          2HB       ASN  31  -0.813  -6.699   7.730
  255   2HB   ASN  31          1HB       ASN  31   0.441  -7.935   7.693
  256   1HD2  ASN  31          1HD2      ASN  31  -0.985  -9.278   8.902
  257   2HD2  ASN  31          2HD2      ASN  31  -1.170  -9.069  10.608
  258    H    GLU  32           H        GLU  32   1.879  -5.234  10.547
  259    HA   GLU  32           HA       GLU  32   4.584  -5.885  10.548
  260   1HB   GLU  32          2HB       GLU  32   3.470  -4.308  12.106
  261   2HB   GLU  32          1HB       GLU  32   2.728  -5.674  12.923
  262   1HG   GLU  32          2HG       GLU  32   5.060  -6.508  13.392
  263   2HG   GLU  32          1HG       GLU  32   5.638  -4.943  12.819
  264    H    ARG  33           H        ARG  33   1.796  -7.732  11.690
  265    HA   ARG  33           HA       ARG  33   3.524  -9.810  12.746
  266   1HB   ARG  33          2HB       ARG  33   0.552  -9.345  12.816
  267   2HB   ARG  33          1HB       ARG  33   1.277 -10.841  13.396
  268   1HG   ARG  33          2HG       ARG  33   2.569  -9.636  15.038
  269   2HG   ARG  33          1HG       ARG  33   1.999  -8.096  14.399
  270   1HD   ARG  33          2HD       ARG  33   0.170 -10.194  15.551
  271   2HD   ARG  33          1HD       ARG  33   0.873  -8.888  16.504
  272    HE   ARG  33           HE       ARG  33  -1.172  -8.646  14.426
  273   1HH1  ARG  33          1HH1      ARG  33   0.920  -7.076  16.762
  274   2HH1  ARG  33          2HH1      ARG  33   0.006  -5.603  16.775
  275   1HH2  ARG  33          1HH2      ARG  33  -2.384  -6.736  14.467
  276   2HH2  ARG  33          2HH2      ARG  33  -1.886  -5.405  15.479
  277    H    LEU  34           H        LEU  34   2.857  -9.181   9.742
  278    HA   LEU  34           HA       LEU  34   2.734 -12.041   9.053
  279   1HB   LEU  34          2HB       LEU  34   1.625  -9.675   7.571
  280   2HB   LEU  34          1HB       LEU  34   1.960 -11.194   6.763
  281    HG   LEU  34           HG       LEU  34   0.016 -10.779   9.031
  282   1HD1  LEU  34          1HD1      LEU  34  -0.402 -11.411   6.107
  283   2HD1  LEU  34          2HD1      LEU  34  -0.764  -9.877   6.903
  284   3HD1  LEU  34          3HD1      LEU  34  -1.670 -11.330   7.332
  285   1HD2  LEU  34          1HD2      LEU  34   1.048 -12.970   9.187
  286   2HD2  LEU  34          2HD2      LEU  34   0.736 -13.268   7.476
  287   3HD2  LEU  34          3HD2      LEU  34  -0.610 -13.132   8.606
  288    H    ASN  35           H        ASN  35   4.317  -8.981   8.621
  289    HA   ASN  35           HA       ASN  35   6.229  -8.324   7.589
  290   1HB   ASN  35          2HB       ASN  35   6.794 -11.299   7.525
  291   2HB   ASN  35          1HB       ASN  35   7.952 -10.069   7.035
  292   1HD2  ASN  35          1HD2      ASN  35   7.143  -8.207   9.121
  293   2HD2  ASN  35          2HD2      ASN  35   7.769  -8.834  10.600
  294    H    LEU  36           H        LEU  36   3.773  -8.926   6.164
  295    HA   LEU  36           HA       LEU  36   4.847  -9.443   3.473
  296   1HB   LEU  36          2HB       LEU  36   2.042  -9.941   4.485
  297   2HB   LEU  36          1HB       LEU  36   2.600 -10.219   2.847
  298    HG   LEU  36           HG       LEU  36   3.573 -11.697   5.293
  299   1HD1  LEU  36          1HD1      LEU  36   1.734 -12.555   3.062
  300   2HD1  LEU  36          2HD1      LEU  36   1.271 -12.258   4.738
  301   3HD1  LEU  36          3HD1      LEU  36   2.351 -13.594   4.345
  302   1HD2  LEU  36          1HD2      LEU  36   5.291 -11.511   3.560
  303   2HD2  LEU  36          2HD2      LEU  36   4.158 -12.137   2.365
  304   3HD2  LEU  36          3HD2      LEU  36   4.694 -13.164   3.692
  305    H    ALA  37           H        ALA  37   4.154  -8.117   1.809
  306    HA   ALA  37           HA       ALA  37   2.676  -5.705   2.634
  307   1HB   ALA  37          1HB       ALA  37   4.041  -4.414   1.094
  308   2HB   ALA  37          2HB       ALA  37   4.935  -5.863   0.640
  309   3HB   ALA  37          3HB       ALA  37   5.053  -5.230   2.284
  310    H    TYR  38           H        TYR  38   1.036  -5.066   1.378
  311    HA   TYR  38           HA       TYR  38   0.553  -6.532  -1.132
  312   1HB   TYR  38          2HB       TYR  38  -1.440  -4.993   0.559
  313   2HB   TYR  38          1HB       TYR  38  -1.805  -5.972  -0.858
  314    HD1  TYR  38           1HD      TYR  38  -1.487  -5.950   2.689
  315    HD2  TYR  38           2HD      TYR  38  -1.266  -8.491  -0.717
  316    HE1  TYR  38           1HE      TYR  38  -1.800  -7.910   4.140
  317    HE2  TYR  38           2HE      TYR  38  -1.576 -10.459   0.728
  318    HH   TYR  38           HH       TYR  38  -1.248 -11.085   3.090
  319    H    ARG  39           H        ARG  39   0.129  -5.371  -3.002
  320    HA   ARG  39           HA       ARG  39   1.240  -2.683  -2.941
  321   1HB   ARG  39          2HB       ARG  39   1.318  -2.920  -5.414
  322   2HB   ARG  39          1HB       ARG  39   2.212  -4.168  -4.557
  323   1HG   ARG  39          2HG       ARG  39   0.411  -5.752  -4.930
  324   2HG   ARG  39          1HG       ARG  39  -0.547  -4.500  -5.724
  325   1HD   ARG  39          2HD       ARG  39   1.112  -4.303  -7.481
  326   2HD   ARG  39          1HD       ARG  39   2.147  -5.472  -6.664
  327    HE   ARG  39           HE       ARG  39  -0.304  -6.719  -7.109
  328   1HH1  ARG  39          1HH1      ARG  39   2.318  -5.350  -8.993
  329   2HH1  ARG  39          2HH1      ARG  39   2.076  -6.416 -10.346
  330   1HH2  ARG  39          1HH2      ARG  39  -0.613  -8.137  -8.852
  331   2HH2  ARG  39          2HH2      ARG  39   0.407  -8.029 -10.261
  332    H    ILE  40           H        ILE  40   0.240  -0.869  -3.655
  333    HA   ILE  40           HA       ILE  40  -2.658  -1.048  -4.158
  334    HB   ILE  40           HB       ILE  40  -1.014   1.340  -3.286
  335   1HG1  ILE  40          2HG1      ILE  40  -2.983  -0.332  -1.708
  336   2HG1  ILE  40          1HG1      ILE  40  -1.233  -0.396  -1.534
  337   1HG2  ILE  40          1HG2      ILE  40  -3.151   2.457  -2.953
  338   2HG2  ILE  40          2HG2      ILE  40  -3.999   1.033  -3.553
  339   3HG2  ILE  40          3HG2      ILE  40  -2.956   1.956  -4.632
  340   1HD1  ILE  40          1HD1      ILE  40  -1.227   1.931  -0.797
  341   2HD1  ILE  40          2HD1      ILE  40  -2.246   0.920   0.232
  342   3HD1  ILE  40          3HD1      ILE  40  -2.983   1.985  -0.964
  343    H    ASP  41           H        ASP  41  -3.150  -0.934  -6.269
  344    HA   ASP  41           HA       ASP  41  -1.158   0.208  -8.085
  345   1HB   ASP  41          2HB       ASP  41  -2.068  -2.112  -8.460
  346   2HB   ASP  41          1HB       ASP  41  -3.628  -1.378  -8.815
  347    H    ASP  42           H        ASP  42  -1.396   2.311  -8.342
  348    HA   ASP  42           HA       ASP  42  -2.211   4.292  -9.061
  349   1HB   ASP  42          2HB       ASP  42  -2.892   2.843 -11.015
  350   2HB   ASP  42          1HB       ASP  42  -4.495   2.742 -10.294
  351    H    GLY  43           H        GLY  43  -3.262   2.966  -6.527
  352   1HA   GLY  43          2HA       GLY  43  -4.370   4.340  -4.867
  353   2HA   GLY  43          1HA       GLY  43  -5.454   4.900  -6.135
  354    H    ILE  44           H        ILE  44  -5.130   1.739  -6.767
  355    HA   ILE  44           HA       ILE  44  -7.457   1.020  -5.116
  356    HB   ILE  44           HB       ILE  44  -6.492  -0.196  -7.717
  357   1HG1  ILE  44          2HG1      ILE  44  -8.898   0.548  -8.388
  358   2HG1  ILE  44          1HG1      ILE  44  -8.774   1.623  -7.002
  359   1HG2  ILE  44          1HG2      ILE  44  -8.867  -0.959  -6.027
  360   2HG2  ILE  44          2HG2      ILE  44  -7.406  -1.918  -6.261
  361   3HG2  ILE  44          3HG2      ILE  44  -8.487  -1.611  -7.622
  362   1HD1  ILE  44          1HD1      ILE  44  -8.207   2.729  -9.094
  363   2HD1  ILE  44          2HD1      ILE  44  -6.893   1.579  -9.346
  364   3HD1  ILE  44          3HD1      ILE  44  -6.841   2.695  -7.981
  365    HA   PRO  45           HA       PRO  45  -4.364  -1.563  -3.079
  366   1HB   PRO  45          2HB       PRO  45  -6.408  -1.944  -1.043
  367   2HB   PRO  45          1HB       PRO  45  -4.856  -1.113  -0.915
  368   1HG   PRO  45          2HG       PRO  45  -7.243   0.180  -0.819
  369   2HG   PRO  45          1HG       PRO  45  -5.756   0.929  -1.431
  370   1HD   PRO  45          2HD       PRO  45  -8.043  -0.263  -2.954
  371   2HD   PRO  45          1HD       PRO  45  -7.119   1.218  -3.287
  372    H    VAL  46           H        VAL  46  -4.201  -3.509  -4.035
  373    HA   VAL  46           HA       VAL  46  -6.550  -5.211  -4.297
  374    HB   VAL  46           HB       VAL  46  -3.716  -5.765  -5.206
  375   1HG1  VAL  46          1HG1      VAL  46  -6.337  -7.033  -5.990
  376   2HG1  VAL  46          2HG1      VAL  46  -5.089  -7.765  -4.983
  377   3HG1  VAL  46          3HG1      VAL  46  -4.761  -7.417  -6.680
  378   1HG2  VAL  46          1HG2      VAL  46  -6.027  -4.593  -6.750
  379   2HG2  VAL  46          2HG2      VAL  46  -4.492  -5.101  -7.449
  380   3HG2  VAL  46          3HG2      VAL  46  -4.540  -3.761  -6.303
  381    H    LEU  47           H        LEU  47  -7.038  -6.061  -2.341
  382    HA   LEU  47           HA       LEU  47  -4.881  -7.091  -0.668
  383   1HB   LEU  47          2HB       LEU  47  -7.832  -6.797  -0.095
  384   2HB   LEU  47          1HB       LEU  47  -6.623  -7.324   1.060
  385    HG   LEU  47           HG       LEU  47  -6.818  -4.597  -0.210
  386   1HD1  LEU  47          1HD1      LEU  47  -8.483  -5.016   1.523
  387   2HD1  LEU  47          2HD1      LEU  47  -7.283  -3.840   2.060
  388   3HD1  LEU  47          3HD1      LEU  47  -7.206  -5.506   2.636
  389   1HD2  LEU  47          1HD2      LEU  47  -4.800  -5.701   1.739
  390   2HD2  LEU  47          2HD2      LEU  47  -4.947  -4.006   1.273
  391   3HD2  LEU  47          3HD2      LEU  47  -4.492  -5.215   0.071
  392    H    LEU  48           H        LEU  48  -4.312  -8.929  -1.806
  393    HA   LEU  48           HA       LEU  48  -6.176 -11.170  -1.463
  394   1HB   LEU  48          2HB       LEU  48  -4.529 -10.609  -3.933
  395   2HB   LEU  48          1HB       LEU  48  -5.365 -12.117  -3.625
  396    HG   LEU  48           HG       LEU  48  -6.701  -9.430  -3.957
  397   1HD1  LEU  48          1HD1      LEU  48  -6.530 -11.790  -5.827
  398   2HD1  LEU  48          2HD1      LEU  48  -5.716 -10.239  -6.038
  399   3HD1  LEU  48          3HD1      LEU  48  -7.478 -10.326  -6.092
  400   1HD2  LEU  48          1HD2      LEU  48  -8.767 -10.752  -4.053
  401   2HD2  LEU  48          2HD2      LEU  48  -7.960 -10.905  -2.495
  402   3HD2  LEU  48          3HD2      LEU  48  -7.845 -12.206  -3.678
  403    H    ILE  49           H        ILE  49  -5.130 -13.219  -1.216
  404    HA   ILE  49           HA       ILE  49  -2.573 -13.055   0.100
  405    HB   ILE  49           HB       ILE  49  -4.104 -15.546  -0.685
  406   1HG1  ILE  49          2HG1      ILE  49  -4.267 -13.975   1.897
  407   2HG1  ILE  49          1HG1      ILE  49  -5.502 -13.970   0.643
  408   1HG2  ILE  49          1HG2      ILE  49  -2.905 -16.564   1.202
  409   2HG2  ILE  49          2HG2      ILE  49  -2.036 -15.049   1.454
  410   3HG2  ILE  49          3HG2      ILE  49  -1.798 -15.964  -0.035
  411   1HD1  ILE  49          1HD1      ILE  49  -6.153 -15.424   2.439
  412   2HD1  ILE  49          2HD1      ILE  49  -4.641 -16.321   2.308
  413   3HD1  ILE  49          3HD1      ILE  49  -5.820 -16.387   1.000
  414    H    ASP  50           H        ASP  50  -3.763 -13.623  -3.024
  415    HA   ASP  50           HA       ASP  50  -1.538 -14.990  -4.156
  416   1HB   ASP  50          2HB       ASP  50  -3.709 -15.062  -5.226
  417   2HB   ASP  50          1HB       ASP  50  -3.745 -13.311  -5.364
  418    H    GLU  51           H        GLU  51  -2.107 -11.786  -3.163
  419    HA   GLU  51           HA       GLU  51   0.051 -10.694  -4.831
  420   1HB   GLU  51          2HB       GLU  51  -2.068  -9.310  -3.172
  421   2HB   GLU  51          1HB       GLU  51  -0.818  -8.485  -4.091
  422   1HG   GLU  51          2HG       GLU  51  -2.759 -10.355  -5.391
  423   2HG   GLU  51          1HG       GLU  51  -3.136  -8.654  -5.121
  424    H    ALA  52           H        ALA  52   0.073 -12.330  -2.180
  425    HA   ALA  52           HA       ALA  52   1.101 -10.467  -0.237
  426   1HB   ALA  52          1HB       ALA  52   1.045 -13.482  -0.156
  427   2HB   ALA  52          2HB       ALA  52  -0.216 -12.411   0.457
  428   3HB   ALA  52          3HB       ALA  52   1.382 -12.408   1.203
  429    H    THR  53           H        THR  53   3.057  -9.626  -0.508
  430    HA   THR  53           HA       THR  53   5.248 -11.405  -1.348
  431    HB   THR  53           HB       THR  53   6.456  -9.259  -1.917
  432    HG1  THR  53           1HG      THR  53   3.863  -8.208  -1.404
  433   1HG2  THR  53          1HG2      THR  53   3.903  -9.844  -3.416
  434   2HG2  THR  53          2HG2      THR  53   5.457 -10.642  -3.653
  435   3HG2  THR  53          3HG2      THR  53   5.276  -8.934  -4.045
  436    H    GLU  54           H        GLU  54   7.085 -11.526  -0.101
  437    HA   GLU  54           HA       GLU  54   6.833 -10.770   2.658
  438   1HB   GLU  54          2HB       GLU  54   7.893 -12.905   1.800
  439   2HB   GLU  54          1HB       GLU  54   9.252 -11.933   1.262
  440   1HG   GLU  54          2HG       GLU  54   9.762 -11.297   3.521
  441   2HG   GLU  54          1HG       GLU  54   8.312 -12.108   4.114
  442    H    TRP  55           H        TRP  55   7.827  -9.074   3.709
  443    HA   TRP  55           HA       TRP  55   9.432  -7.271   2.031
  444   1HB   TRP  55          2HB       TRP  55   7.064  -6.640   1.824
  445   2HB   TRP  55          1HB       TRP  55   6.964  -6.459   3.571
  446    HD1  TRP  55           HD       TRP  55   7.682  -4.187   4.588
  447    HE1  TRP  55           1HE      TRP  55   8.542  -1.973   3.603
  448    HE3  TRP  55           3HE      TRP  55   8.594  -5.725  -0.203
  449    HZ2  TRP  55           2HZ      TRP  55   9.478  -1.000   1.119
  450    HZ3  TRP  55           3HZ      TRP  55   9.466  -4.090  -1.819
  451    HH2  TRP  55           HH       TRP  55   9.897  -1.778  -1.172
  452    H    THR  56           H        THR  56  11.204  -6.724   3.039
  453    HA   THR  56           HA       THR  56  12.553  -5.660   4.490
  454    HB   THR  56           HB       THR  56  10.002  -5.162   5.990
  455    HG1  THR  56           1HG      THR  56  11.313  -4.002   3.904
  456   1HG2  THR  56          1HG2      THR  56  11.258  -3.489   7.295
  457   2HG2  THR  56          2HG2      THR  56  12.756  -4.049   6.551
  458   3HG2  THR  56          3HG2      THR  56  11.836  -5.126   7.601
  459    HA   PRO  57           HA       PRO  57  13.429  -8.800   7.573
  460   1HB   PRO  57          2HB       PRO  57  16.056  -9.035   6.775
  461   2HB   PRO  57          1HB       PRO  57  14.730 -10.010   6.141
  462   1HG   PRO  57          2HG       PRO  57  16.293  -8.032   4.766
  463   2HG   PRO  57          1HG       PRO  57  14.980  -9.032   4.126
  464   1HD   PRO  57          2HD       PRO  57  14.924  -6.230   5.068
  465   2HD   PRO  57          1HD       PRO  57  13.826  -7.068   3.952
  466    H    ASN  58           H        ASN  58  13.618  -7.781   9.501
  467    HA   ASN  58           HA       ASN  58  15.228  -5.388   9.772
  468   1HB   ASN  58          2HB       ASN  58  12.954  -5.677  10.829
  469   2HB   ASN  58          1HB       ASN  58  13.676  -6.858  11.914
  470   1HD2  ASN  58          1HD2      ASN  58  15.195  -3.884  10.792
  471   2HD2  ASN  58          2HD2      ASN  58  15.239  -3.120  12.344
  472    H    ASN  59           H        ASN  59  16.955  -5.140  11.267
  473    HA   ASN  59           HA       ASN  59  18.811  -7.227  11.408
  474   1HB   ASN  59          2HB       ASN  59  18.588  -4.689  13.025
  475   2HB   ASN  59          1HB       ASN  59  19.938  -5.805  13.185
  476   1HD2  ASN  59          1HD2      ASN  59  18.527  -3.294  11.331
  477   2HD2  ASN  59          2HD2      ASN  59  19.795  -3.155  10.160
  478    H    LEU  60           H        LEU  60  18.542  -9.072  12.458
  479    HA   LEU  60           HA       LEU  60  17.277  -9.055  15.100
  480   1HB   LEU  60          2HB       LEU  60  18.029 -11.352  13.289
  481   2HB   LEU  60          1HB       LEU  60  17.268 -11.524  14.860
  482    HG   LEU  60           HG       LEU  60  16.048 -10.168  12.451
  483   1HD1  LEU  60          1HD1      LEU  60  15.388 -12.787  13.789
  484   2HD1  LEU  60          2HD1      LEU  60  16.186 -12.595  12.227
  485   3HD1  LEU  60          3HD1      LEU  60  14.518 -12.059  12.440
  486   1HD2  LEU  60          1HD2      LEU  60  14.016 -10.056  13.799
  487   2HD2  LEU  60          2HD2      LEU  60  15.326  -9.139  14.541
  488   3HD2  LEU  60          3HD2      LEU  60  14.887 -10.724  15.180
  489    H    GLU  61           H        GLU  61  18.350 -10.827  16.598
  490    HA   GLU  61           HA       GLU  61  21.083  -9.887  16.945
  491   1HB   GLU  61          2HB       GLU  61  19.440  -9.800  18.821
  492   2HB   GLU  61          1HB       GLU  61  19.392 -11.557  18.815
  493   1HG   GLU  61          2HG       GLU  61  20.850 -10.681  20.567
  494   2HG   GLU  61          1HG       GLU  61  21.734 -11.656  19.395
  Start of MODEL    5
    1   1H    MET   1          1HT       MET   1  -1.813  21.992   1.615
    2   2H    MET   1          2HT       MET   1  -0.180  21.823   2.051
    3   3H    MET   1          3HT       MET   1  -1.401  21.396   3.151
    4    HA   MET   1           HA       MET   1  -0.897  20.066   0.555
    5   1HB   MET   1          2HB       MET   1   0.880  19.597   2.190
    6   2HB   MET   1          1HB       MET   1  -0.326  19.148   3.387
    7   1HG   MET   1          2HG       MET   1  -0.980  17.235   2.091
    8   2HG   MET   1          1HG       MET   1   0.081  17.721   0.769
    9   1HE   MET   1          1HE       MET   1   3.629  17.225   2.322
   10   2HE   MET   1          2HE       MET   1   2.671  18.705   2.312
   11   3HE   MET   1          3HE       MET   1   2.712  17.673   0.884
   12    H    SER   2           H        SER   2  -2.825  19.535  -0.210
   13    HA   SER   2           HA       SER   2  -5.103  19.288   1.519
   14   1HB   SER   2          2HB       SER   2  -4.854  18.808  -1.461
   15   2HB   SER   2          1HB       SER   2  -6.363  18.997  -0.561
   16    HG   SER   2           HG       SER   2  -5.958  20.994  -1.344
   17    H    LEU   3           H        LEU   3  -4.868  17.498   2.805
   18    HA   LEU   3           HA       LEU   3  -4.387  14.898   1.637
   19   1HB   LEU   3          2HB       LEU   3  -3.563  15.441   3.903
   20   2HB   LEU   3          1HB       LEU   3  -5.218  15.639   4.447
   21    HG   LEU   3           HG       LEU   3  -5.649  13.257   3.971
   22   1HD1  LEU   3          1HD1      LEU   3  -2.705  13.163   3.322
   23   2HD1  LEU   3          2HD1      LEU   3  -4.033  12.913   2.188
   24   3HD1  LEU   3          3HD1      LEU   3  -3.762  11.763   3.497
   25   1HD2  LEU   3          1HD2      LEU   3  -4.990  13.923   6.202
   26   2HD2  LEU   3          2HD2      LEU   3  -3.287  13.793   5.760
   27   3HD2  LEU   3          3HD2      LEU   3  -4.298  12.349   5.806
   28    H    ASP   4           H        ASP   4  -5.893  13.610   0.852
   29    HA   ASP   4           HA       ASP   4  -8.706  14.239   1.425
   30   1HB   ASP   4          2HB       ASP   4  -7.777  14.809  -0.929
   31   2HB   ASP   4          1HB       ASP   4  -7.841  13.069  -1.200
   32    HA   PRO   5           HA       PRO   5  -8.019  10.086   3.151
   33   1HB   PRO   5          2HB       PRO   5 -10.771  10.643   4.111
   34   2HB   PRO   5          1HB       PRO   5  -9.350  10.092   5.004
   35   1HG   PRO   5          2HG       PRO   5 -10.180  12.599   5.232
   36   2HG   PRO   5          1HG       PRO   5  -8.447  12.228   5.146
   37   1HD   PRO   5          2HD       PRO   5 -10.265  13.286   3.013
   38   2HD   PRO   5          1HD       PRO   5  -8.596  13.751   3.403
   39    H    GLN   6           H        GLN   6  -9.818  10.826   0.490
   40    HA   GLN   6           HA       GLN   6 -11.455   8.488   0.324
   41   1HB   GLN   6          2HB       GLN   6 -10.267  10.275  -1.801
   42   2HB   GLN   6          1HB       GLN   6 -11.299   8.904  -2.173
   43   1HG   GLN   6          2HG       GLN   6 -13.119   9.918  -0.910
   44   2HG   GLN   6          1HG       GLN   6 -12.082  11.295  -0.524
   45   1HE2  GLN   6          1HE2      GLN   6 -11.500  12.734  -2.170
   46   2HE2  GLN   6          2HE2      GLN   6 -12.427  12.845  -3.636
   47    H    LEU   7           H        LEU   7  -8.115   9.109   0.135
   48    HA   LEU   7           HA       LEU   7  -7.480   6.644  -1.275
   49   1HB   LEU   7          2HB       LEU   7  -5.676   8.688   0.030
   50   2HB   LEU   7          1HB       LEU   7  -5.141   7.342  -0.957
   51    HG   LEU   7           HG       LEU   7  -6.833   9.645  -1.937
   52   1HD1  LEU   7          1HD1      LEU   7  -3.914   9.030  -2.377
   53   2HD1  LEU   7          2HD1      LEU   7  -4.560  10.333  -1.380
   54   3HD1  LEU   7          3HD1      LEU   7  -4.821  10.346  -3.124
   55   1HD2  LEU   7          1HD2      LEU   7  -7.265   7.571  -3.158
   56   2HD2  LEU   7          2HD2      LEU   7  -5.534   7.365  -3.434
   57   3HD2  LEU   7          3HD2      LEU   7  -6.388   8.726  -4.163
   58    H    LEU   8           H        LEU   8  -8.584   7.211   1.668
   59    HA   LEU   8           HA       LEU   8  -6.860   5.194   2.947
   60   1HB   LEU   8          2HB       LEU   8  -8.270   7.531   4.242
   61   2HB   LEU   8          1HB       LEU   8  -7.425   6.267   5.112
   62    HG   LEU   8           HG       LEU   8  -6.137   8.205   3.187
   63   1HD1  LEU   8          1HD1      LEU   8  -5.118   9.171   5.193
   64   2HD1  LEU   8          2HD1      LEU   8  -6.081   8.084   6.196
   65   3HD1  LEU   8          3HD1      LEU   8  -6.875   9.313   5.214
   66   1HD2  LEU   8          1HD2      LEU   8  -4.988   6.063   3.240
   67   2HD2  LEU   8          2HD2      LEU   8  -4.940   6.114   5.001
   68   3HD2  LEU   8          3HD2      LEU   8  -4.032   7.295   4.060
   69    H    GLU   9           H        GLU   9  -7.855   3.494   3.871
   70    HA   GLU   9           HA       GLU   9 -10.673   3.533   4.482
   71   1HB   GLU   9          2HB       GLU   9 -10.528   3.037   2.005
   72   2HB   GLU   9          1HB       GLU   9  -9.640   1.577   2.414
   73   1HG   GLU   9          2HG       GLU   9 -11.596   0.825   3.740
   74   2HG   GLU   9          1HG       GLU   9 -12.478   2.238   3.163
   75    H    VAL  10           H        VAL  10 -11.283   1.683   5.753
   76    HA   VAL  10           HA       VAL  10  -9.181   0.530   7.283
   77    HB   VAL  10           HB       VAL  10 -12.041  -0.426   7.092
   78   1HG1  VAL  10          1HG1      VAL  10  -9.963  -0.779   9.257
   79   2HG1  VAL  10          2HG1      VAL  10 -10.556  -2.034   8.164
   80   3HG1  VAL  10          3HG1      VAL  10 -11.643  -1.308   9.350
   81   1HG2  VAL  10          1HG2      VAL  10 -11.969   1.951   7.640
   82   2HG2  VAL  10          2HG2      VAL  10 -10.846   1.620   8.960
   83   3HG2  VAL  10          3HG2      VAL  10 -12.493   0.994   9.024
   84    H    LEU  11           H        LEU  11  -7.778  -0.575   6.011
   85    HA   LEU  11           HA       LEU  11  -8.820  -2.656   4.238
   86   1HB   LEU  11          2HB       LEU  11  -6.060  -1.435   4.401
   87   2HB   LEU  11          1HB       LEU  11  -6.578  -2.629   3.226
   88    HG   LEU  11           HG       LEU  11  -7.733   0.156   3.473
   89   1HD1  LEU  11          1HD1      LEU  11  -5.418   0.196   2.700
   90   2HD1  LEU  11          2HD1      LEU  11  -6.540   0.639   1.414
   91   3HD1  LEU  11          3HD1      LEU  11  -5.816  -0.970   1.438
   92   1HD2  LEU  11          1HD2      LEU  11  -8.789  -0.368   1.325
   93   2HD2  LEU  11          2HD2      LEU  11  -9.325  -1.458   2.603
   94   3HD2  LEU  11          3HD2      LEU  11  -8.145  -2.008   1.414
   95    H    ALA  12           H        ALA  12  -8.394  -4.761   4.523
   96    HA   ALA  12           HA       ALA  12  -6.628  -5.538   6.739
   97   1HB   ALA  12          1HB       ALA  12  -8.950  -5.494   7.542
   98   2HB   ALA  12          2HB       ALA  12  -8.276  -7.121   7.549
   99   3HB   ALA  12          3HB       ALA  12  -9.399  -6.639   6.279
  100    H    CYS  13           H        CYS  13  -5.845  -7.707   6.626
  101    HA   CYS  13           HA       CYS  13  -5.219  -8.572   3.981
  102   1HB   CYS  13          2HB       CYS  13  -4.804 -10.085   6.564
  103   2HB   CYS  13          1HB       CYS  13  -3.934 -10.307   5.051
  104    HG   CYS  13           HG       CYS  13  -2.398  -8.119   5.198
  105    HA   PRO  14           HA       PRO  14  -8.605 -11.387   3.301
  106   1HB   PRO  14          2HB       PRO  14  -7.470 -13.030   1.472
  107   2HB   PRO  14          1HB       PRO  14  -7.980 -11.381   1.094
  108   1HG   PRO  14          2HG       PRO  14  -5.241 -12.409   1.738
  109   2HG   PRO  14          1HG       PRO  14  -5.740 -11.271   0.474
  110   1HD   PRO  14          2HD       PRO  14  -4.646 -10.449   2.802
  111   2HD   PRO  14          1HD       PRO  14  -5.865  -9.496   1.932
  112    H    LYS  15           H        LYS  15  -6.252 -12.041   5.289
  113    HA   LYS  15           HA       LYS  15  -7.181 -14.771   5.785
  114   1HB   LYS  15          2HB       LYS  15  -4.931 -14.952   4.767
  115   2HB   LYS  15          1HB       LYS  15  -4.290 -13.884   6.011
  116   1HG   LYS  15          2HG       LYS  15  -5.191 -15.614   7.677
  117   2HG   LYS  15          1HG       LYS  15  -5.303 -16.688   6.284
  118   1HD   LYS  15          2HD       LYS  15  -2.779 -15.273   7.121
  119   2HD   LYS  15          1HD       LYS  15  -3.204 -16.908   7.626
  120   1HE   LYS  15          2HE       LYS  15  -3.361 -17.491   5.172
  121   2HE   LYS  15          1HE       LYS  15  -2.632 -15.917   4.844
  122   1HZ   LYS  15          1HZ       LYS  15  -0.706 -16.546   6.107
  123   2HZ   LYS  15          2HZ       LYS  15  -1.000 -17.735   4.935
  124   3HZ   LYS  15          3HZ       LYS  15  -1.418 -18.019   6.551
  125    H    ASP  16           H        ASP  16  -5.002 -12.356   7.196
  126    HA   ASP  16           HA       ASP  16  -5.718 -12.973   9.868
  127   1HB   ASP  16          2HB       ASP  16  -3.513 -12.129   9.380
  128   2HB   ASP  16          1HB       ASP  16  -4.182 -10.662   8.670
  129    H    LYS  17           H        LYS  17  -6.705 -10.469   7.588
  130    HA   LYS  17           HA       LYS  17  -8.362  -8.928   7.602
  131   1HB   LYS  17          2HB       LYS  17  -9.465 -10.823   9.668
  132   2HB   LYS  17          1HB       LYS  17 -10.344  -9.403   9.115
  133   1HG   LYS  17          2HG       LYS  17 -10.405 -10.231   6.876
  134   2HG   LYS  17          1HG       LYS  17  -9.336 -11.570   7.294
  135   1HD   LYS  17          2HD       LYS  17 -11.626 -12.331   7.144
  136   2HD   LYS  17          1HD       LYS  17 -11.056 -12.453   8.806
  137   1HE   LYS  17          2HE       LYS  17 -13.287 -11.591   8.847
  138   2HE   LYS  17          1HE       LYS  17 -12.189 -10.282   9.278
  139   1HZ   LYS  17          1HZ       LYS  17 -13.205 -10.670   6.516
  140   2HZ   LYS  17          2HZ       LYS  17 -12.442  -9.298   7.163
  141   3HZ   LYS  17          3HZ       LYS  17 -14.009  -9.713   7.658
  142    H    GLY  18           H        GLY  18  -6.024  -8.778   9.528
  143   1HA   GLY  18          2HA       GLY  18  -7.136  -7.044  11.602
  144   2HA   GLY  18          1HA       GLY  18  -5.481  -7.628  11.515
  145    HA   PRO  19           HA       PRO  19  -5.699  -3.214  10.071
  146   1HB   PRO  19          2HB       PRO  19  -3.842  -2.190  11.741
  147   2HB   PRO  19          1HB       PRO  19  -5.531  -2.408  12.213
  148   1HG   PRO  19          2HG       PRO  19  -3.149  -4.089  12.855
  149   2HG   PRO  19          1HG       PRO  19  -4.517  -3.643  13.888
  150   1HD   PRO  19          2HD       PRO  19  -4.267  -6.066  12.618
  151   2HD   PRO  19          1HD       PRO  19  -5.814  -5.354  13.106
  152    H    LEU  20           H        LEU  20  -4.562  -2.533   8.402
  153    HA   LEU  20           HA       LEU  20  -1.857  -3.575   7.956
  154   1HB   LEU  20          2HB       LEU  20  -3.904  -2.335   6.124
  155   2HB   LEU  20          1HB       LEU  20  -2.239  -2.579   5.633
  156    HG   LEU  20           HG       LEU  20  -4.085  -4.798   6.508
  157   1HD1  LEU  20          1HD1      LEU  20  -4.892  -3.782   4.449
  158   2HD1  LEU  20          2HD1      LEU  20  -4.215  -5.380   4.141
  159   3HD1  LEU  20          3HD1      LEU  20  -3.288  -3.937   3.730
  160   1HD2  LEU  20          1HD2      LEU  20  -1.731  -5.280   6.849
  161   2HD2  LEU  20          2HD2      LEU  20  -1.379  -4.823   5.181
  162   3HD2  LEU  20          3HD2      LEU  20  -2.377  -6.239   5.516
  163    H    ARG  21           H        ARG  21  -0.105  -2.238   7.860
  164    HA   ARG  21           HA       ARG  21  -0.489   0.534   8.629
  165   1HB   ARG  21          2HB       ARG  21   1.981  -1.137   8.178
  166   2HB   ARG  21          1HB       ARG  21   2.059   0.591   8.482
  167   1HG   ARG  21          2HG       ARG  21   0.706   0.068  10.604
  168   2HG   ARG  21          1HG       ARG  21   1.187  -1.605  10.317
  169   1HD   ARG  21          2HD       ARG  21   3.145   0.681  10.483
  170   2HD   ARG  21          1HD       ARG  21   2.673  -0.292  11.873
  171    HE   ARG  21           HE       ARG  21   3.728  -2.185  10.839
  172   1HH1  ARG  21          1HH1      ARG  21   4.364   0.895   9.257
  173   2HH1  ARG  21          2HH1      ARG  21   5.857   0.347   8.557
  174   1HH2  ARG  21          1HH2      ARG  21   5.693  -2.869   9.945
  175   2HH2  ARG  21          2HH2      ARG  21   6.606  -1.790   8.916
  176    H    TYR  22           H        TYR  22  -0.597   2.167   7.260
  177    HA   TYR  22           HA       TYR  22  -0.134   1.644   4.433
  178   1HB   TYR  22          2HB       TYR  22  -2.217   2.735   4.938
  179   2HB   TYR  22          1HB       TYR  22  -1.397   3.971   5.886
  180    HD1  TYR  22           1HD      TYR  22  -1.406   2.592   2.407
  181    HD2  TYR  22           2HD      TYR  22  -1.013   6.024   4.891
  182    HE1  TYR  22           1HE      TYR  22  -1.236   4.016   0.406
  183    HE2  TYR  22           2HE      TYR  22  -0.844   7.456   2.900
  184    HH   TYR  22           HH       TYR  22  -1.545   6.315  -0.261
  185    H    LEU  23           H        LEU  23   1.942   1.784   3.892
  186    HA   LEU  23           HA       LEU  23   3.636   3.869   4.968
  187   1HB   LEU  23          2HB       LEU  23   4.081   1.713   2.908
  188   2HB   LEU  23          1HB       LEU  23   5.277   2.947   3.239
  189    HG   LEU  23           HG       LEU  23   5.914   1.001   4.439
  190   1HD1  LEU  23          1HD1      LEU  23   6.216   3.107   5.631
  191   2HD1  LEU  23          2HD1      LEU  23   5.922   1.767   6.739
  192   3HD1  LEU  23          3HD1      LEU  23   4.630   2.912   6.381
  193   1HD2  LEU  23          1HD2      LEU  23   3.814  -0.194   4.454
  194   2HD2  LEU  23          2HD2      LEU  23   3.133   0.960   5.600
  195   3HD2  LEU  23          3HD2      LEU  23   4.463  -0.089   6.091
  196    H    GLU  24           H        GLU  24   3.387   5.864   4.268
  197    HA   GLU  24           HA       GLU  24   2.021   6.444   1.818
  198   1HB   GLU  24          2HB       GLU  24   2.204   8.758   2.454
  199   2HB   GLU  24          1HB       GLU  24   1.768   7.818   3.867
  200   1HG   GLU  24          2HG       GLU  24   4.520   8.871   3.234
  201   2HG   GLU  24          1HG       GLU  24   3.389   9.570   4.389
  202    H    SER  25           H        SER  25   5.301   6.615   2.969
  203    HA   SER  25           HA       SER  25   6.374   7.938   0.703
  204   1HB   SER  25          2HB       SER  25   7.805   6.162   2.688
  205   2HB   SER  25          1HB       SER  25   8.530   7.404   1.665
  206    HG   SER  25           HG       SER  25   6.784   7.724   3.874
  207    H    GLU  26           H        GLU  26   5.781   4.559   1.435
  208    HA   GLU  26           HA       GLU  26   7.325   3.745  -0.934
  209   1HB   GLU  26          2HB       GLU  26   6.365   2.096   1.412
  210   2HB   GLU  26          1HB       GLU  26   7.336   1.501   0.072
  211   1HG   GLU  26          2HG       GLU  26   9.188   2.867   0.709
  212   2HG   GLU  26          1HG       GLU  26   8.218   3.707   1.917
  213    H    GLN  27           H        GLN  27   4.154   4.081   0.240
  214    HA   GLN  27           HA       GLN  27   2.103   3.633  -0.580
  215   1HB   GLN  27          2HB       GLN  27   3.727   3.414  -3.099
  216   2HB   GLN  27          1HB       GLN  27   1.978   3.221  -3.100
  217   1HG   GLN  27          2HG       GLN  27   3.486   5.650  -2.157
  218   2HG   GLN  27          1HG       GLN  27   2.618   5.493  -3.685
  219   1HE2  GLN  27          1HE2      GLN  27   2.249   7.322  -1.380
  220   2HE2  GLN  27          2HE2      GLN  27   0.596   7.129  -0.906
  221    H    LEU  28           H        LEU  28   3.041   1.589   0.818
  222    HA   LEU  28           HA       LEU  28   1.872  -0.719  -0.559
  223   1HB   LEU  28          2HB       LEU  28   4.422  -0.726   1.065
  224   2HB   LEU  28          1HB       LEU  28   3.554  -2.179   0.612
  225    HG   LEU  28           HG       LEU  28   4.764  -0.222  -1.347
  226   1HD1  LEU  28          1HD1      LEU  28   6.442  -1.960  -1.727
  227   2HD1  LEU  28          2HD1      LEU  28   5.734  -2.929  -0.436
  228   3HD1  LEU  28          3HD1      LEU  28   6.487  -1.379  -0.064
  229   1HD2  LEU  28          1HD2      LEU  28   3.540  -2.951  -1.744
  230   2HD2  LEU  28          2HD2      LEU  28   4.320  -1.981  -2.991
  231   3HD2  LEU  28          3HD2      LEU  28   2.830  -1.415  -2.238
  232    H    LEU  29           H        LEU  29   0.977  -2.302   0.906
  233    HA   LEU  29           HA       LEU  29   0.203  -1.130   3.502
  234   1HB   LEU  29          2HB       LEU  29  -1.199  -3.240   1.856
  235   2HB   LEU  29          1HB       LEU  29  -1.781  -2.560   3.361
  236    HG   LEU  29           HG       LEU  29  -1.381  -0.950   0.842
  237   1HD1  LEU  29          1HD1      LEU  29  -3.086  -2.652   0.499
  238   2HD1  LEU  29          2HD1      LEU  29  -3.809  -1.047   0.605
  239   3HD1  LEU  29          3HD1      LEU  29  -3.901  -2.151   1.981
  240   1HD2  LEU  29          1HD2      LEU  29  -2.829  -0.349   3.421
  241   2HD2  LEU  29          2HD2      LEU  29  -2.747   0.705   2.007
  242   3HD2  LEU  29          3HD2      LEU  29  -1.283   0.336   2.920
  243    H    VAL  30           H        VAL  30   1.329  -2.021   5.137
  244    HA   VAL  30           HA       VAL  30   2.244  -4.811   4.810
  245    HB   VAL  30           HB       VAL  30   3.547  -2.634   6.454
  246   1HG1  VAL  30          1HG1      VAL  30   3.964  -4.865   7.332
  247   2HG1  VAL  30          2HG1      VAL  30   5.431  -4.193   6.623
  248   3HG1  VAL  30          3HG1      VAL  30   4.503  -5.407   5.745
  249   1HG2  VAL  30          1HG2      VAL  30   5.310  -2.654   4.726
  250   2HG2  VAL  30          2HG2      VAL  30   3.753  -2.102   4.109
  251   3HG2  VAL  30          3HG2      VAL  30   4.313  -3.734   3.752
  252    H    ASN  31           H        ASN  31   1.485  -6.260   6.200
  253    HA   ASN  31           HA       ASN  31   0.203  -5.352   8.667
  254   1HB   ASN  31          2HB       ASN  31  -0.938  -7.073   7.251
  255   2HB   ASN  31          1HB       ASN  31   0.402  -8.167   7.564
  256   1HD2  ASN  31          1HD2      ASN  31  -2.475  -8.345   8.209
  257   2HD2  ASN  31          2HD2      ASN  31  -2.565  -8.609   9.920
  258    H    GLU  32           H        GLU  32   1.319  -5.231  10.451
  259    HA   GLU  32           HA       GLU  32   4.052  -5.847  10.607
  260   1HB   GLU  32          2HB       GLU  32   2.812  -4.082  11.897
  261   2HB   GLU  32          1HB       GLU  32   2.153  -5.358  12.908
  262   1HG   GLU  32          2HG       GLU  32   4.009  -4.312  14.020
  263   2HG   GLU  32          1HG       GLU  32   4.426  -5.970  13.590
  264    H    ARG  33           H        ARG  33   1.229  -7.729  11.354
  265    HA   ARG  33           HA       ARG  33   2.711  -9.568  13.056
  266   1HB   ARG  33          2HB       ARG  33  -0.171  -9.723  12.166
  267   2HB   ARG  33          1HB       ARG  33   0.584 -10.657  13.451
  268   1HG   ARG  33          2HG       ARG  33   1.064  -8.435  14.574
  269   2HG   ARG  33          1HG       ARG  33  -0.053  -7.726  13.408
  270   1HD   ARG  33          2HD       ARG  33  -0.681  -9.928  15.373
  271   2HD   ARG  33          1HD       ARG  33  -1.175  -8.244  15.510
  272    HE   ARG  33           HE       ARG  33  -2.061  -9.749  13.162
  273   1HH1  ARG  33          1HH1      ARG  33  -2.796  -8.231  16.227
  274   2HH1  ARG  33          2HH1      ARG  33  -4.521  -8.350  16.023
  275   1HH2  ARG  33          1HH2      ARG  33  -4.331  -9.964  12.895
  276   2HH2  ARG  33          2HH2      ARG  33  -5.390  -9.367  14.147
  277    H    LEU  34           H        LEU  34   2.175  -9.205   9.764
  278    HA   LEU  34           HA       LEU  34   2.487 -12.107   9.317
  279   1HB   LEU  34          2HB       LEU  34   1.202 -10.057   7.511
  280   2HB   LEU  34          1HB       LEU  34   1.484 -11.732   7.076
  281    HG   LEU  34           HG       LEU  34  -0.328 -10.755   9.280
  282   1HD1  LEU  34          1HD1      LEU  34  -1.221 -10.336   7.063
  283   2HD1  LEU  34          2HD1      LEU  34  -2.119 -11.621   7.869
  284   3HD1  LEU  34          3HD1      LEU  34  -0.943 -12.018   6.616
  285   1HD2  LEU  34          1HD2      LEU  34   0.229 -13.560   8.313
  286   2HD2  LEU  34          2HD2      LEU  34  -1.023 -13.097   9.469
  287   3HD2  LEU  34          3HD2      LEU  34   0.679 -12.881   9.882
  288    H    ASN  35           H        ASN  35   3.853  -9.000   8.818
  289    HA   ASN  35           HA       ASN  35   5.761  -8.254   7.839
  290   1HB   ASN  35          2HB       ASN  35   6.424 -11.202   7.772
  291   2HB   ASN  35          1HB       ASN  35   7.552  -9.934   7.311
  292   1HD2  ASN  35          1HD2      ASN  35   8.438  -8.609   8.884
  293   2HD2  ASN  35          2HD2      ASN  35   8.354  -9.011  10.567
  294    H    LEU  36           H        LEU  36   3.366  -9.021   6.280
  295    HA   LEU  36           HA       LEU  36   4.632  -9.299   3.641
  296   1HB   LEU  36          2HB       LEU  36   1.889 -10.198   4.526
  297   2HB   LEU  36          1HB       LEU  36   2.453 -10.224   2.867
  298    HG   LEU  36           HG       LEU  36   3.645 -11.817   5.140
  299   1HD1  LEU  36          1HD1      LEU  36   1.955 -12.712   2.810
  300   2HD1  LEU  36          2HD1      LEU  36   1.413 -12.588   4.484
  301   3HD1  LEU  36          3HD1      LEU  36   2.668 -13.747   4.049
  302   1HD2  LEU  36          1HD2      LEU  36   4.918 -12.945   3.381
  303   2HD2  LEU  36          2HD2      LEU  36   5.307 -11.227   3.468
  304   3HD2  LEU  36          3HD2      LEU  36   4.256 -11.829   2.185
  305    H    ALA  37           H        ALA  37   3.856  -8.020   1.969
  306    HA   ALA  37           HA       ALA  37   2.209  -5.726   2.823
  307   1HB   ALA  37          1HB       ALA  37   4.520  -5.666   0.886
  308   2HB   ALA  37          2HB       ALA  37   4.583  -5.106   2.555
  309   3HB   ALA  37          3HB       ALA  37   3.541  -4.289   1.387
  310    H    TYR  38           H        TYR  38   0.581  -5.155   1.525
  311    HA   TYR  38           HA       TYR  38   0.139  -6.756  -0.888
  312   1HB   TYR  38          2HB       TYR  38  -1.768  -5.077   0.754
  313   2HB   TYR  38          1HB       TYR  38  -2.210  -5.939  -0.719
  314    HD1  TYR  38           1HD      TYR  38  -1.428  -6.258   2.827
  315    HD2  TYR  38           2HD      TYR  38  -2.265  -8.396  -0.755
  316    HE1  TYR  38           1HE      TYR  38  -1.832  -8.296   4.144
  317    HE2  TYR  38           2HE      TYR  38  -2.673 -10.437   0.553
  318    HH   TYR  38           HH       TYR  38  -2.007 -11.366   2.764
  319    H    ARG  39           H        ARG  39  -0.539  -5.759  -2.836
  320    HA   ARG  39           HA       ARG  39   1.026  -3.389  -3.314
  321   1HB   ARG  39          2HB       ARG  39  -0.606  -5.078  -5.213
  322   2HB   ARG  39          1HB       ARG  39   0.495  -3.792  -5.685
  323   1HG   ARG  39          2HG       ARG  39   2.372  -5.059  -4.774
  324   2HG   ARG  39          1HG       ARG  39   1.266  -6.353  -4.297
  325   1HD   ARG  39          2HD       ARG  39   0.634  -6.677  -6.635
  326   2HD   ARG  39          1HD       ARG  39   1.718  -5.371  -7.114
  327    HE   ARG  39           HE       ARG  39   2.742  -7.794  -5.792
  328   1HH1  ARG  39          1HH1      ARG  39   2.757  -5.506  -8.454
  329   2HH1  ARG  39          2HH1      ARG  39   4.124  -6.240  -9.235
  330   1HH2  ARG  39          1HH2      ARG  39   4.542  -8.751  -6.806
  331   2HH2  ARG  39          2HH2      ARG  39   5.140  -8.087  -8.299
  332    H    ILE  40           H        ILE  40   0.308  -1.389  -3.761
  333    HA   ILE  40           HA       ILE  40  -2.580  -0.983  -4.067
  334    HB   ILE  40           HB       ILE  40  -0.395   1.063  -3.596
  335   1HG1  ILE  40          2HG1      ILE  40  -2.553   0.064  -1.718
  336   2HG1  ILE  40          1HG1      ILE  40  -0.862  -0.417  -1.645
  337   1HG2  ILE  40          1HG2      ILE  40  -3.397   1.391  -3.675
  338   2HG2  ILE  40          2HG2      ILE  40  -2.253   1.971  -4.889
  339   3HG2  ILE  40          3HG2      ILE  40  -2.230   2.650  -3.260
  340   1HD1  ILE  40          1HD1      ILE  40  -1.401   1.275   0.019
  341   2HD1  ILE  40          2HD1      ILE  40  -1.908   2.376  -1.265
  342   3HD1  ILE  40          3HD1      ILE  40  -0.220   1.875  -1.149
  343    H    ASP  41           H        ASP  41  -3.240  -0.992  -6.117
  344    HA   ASP  41           HA       ASP  41  -1.225  -0.501  -8.194
  345   1HB   ASP  41          2HB       ASP  41  -2.271  -2.744  -8.125
  346   2HB   ASP  41          1HB       ASP  41  -3.845  -2.000  -8.380
  347    H    ASP  42           H        ASP  42  -1.313   1.611  -8.590
  348    HA   ASP  42           HA       ASP  42  -2.014   3.618  -9.383
  349   1HB   ASP  42          2HB       ASP  42  -2.508   2.036 -11.318
  350   2HB   ASP  42          1HB       ASP  42  -4.194   2.096 -10.814
  351    H    GLY  43           H        GLY  43  -3.168   2.705  -6.867
  352   1HA   GLY  43          2HA       GLY  43  -4.440   4.256  -5.514
  353   2HA   GLY  43          1HA       GLY  43  -5.499   4.508  -6.893
  354    H    ILE  44           H        ILE  44  -5.187   1.367  -7.137
  355    HA   ILE  44           HA       ILE  44  -7.402   0.827  -5.268
  356    HB   ILE  44           HB       ILE  44  -6.680  -0.634  -7.821
  357   1HG1  ILE  44          2HG1      ILE  44  -9.002   1.199  -7.182
  358   2HG1  ILE  44          1HG1      ILE  44  -7.629   1.613  -8.201
  359   1HG2  ILE  44          1HG2      ILE  44  -9.006  -1.014  -5.940
  360   2HG2  ILE  44          2HG2      ILE  44  -7.662  -2.132  -6.173
  361   3HG2  ILE  44          3HG2      ILE  44  -8.796  -1.831  -7.490
  362   1HD1  ILE  44          1HD1      ILE  44  -9.663  -0.527  -8.759
  363   2HD1  ILE  44          2HD1      ILE  44  -8.289  -0.120  -9.784
  364   3HD1  ILE  44          3HD1      ILE  44  -9.577   1.057  -9.529
  365    HA   PRO  45           HA       PRO  45  -4.347  -1.708  -3.179
  366   1HB   PRO  45          2HB       PRO  45  -5.940  -2.413  -1.100
  367   2HB   PRO  45          1HB       PRO  45  -5.165  -0.830  -1.218
  368   1HG   PRO  45          2HG       PRO  45  -7.977  -1.618  -1.869
  369   2HG   PRO  45          1HG       PRO  45  -7.388  -0.177  -1.021
  370   1HD   PRO  45          2HD       PRO  45  -8.116  -0.159  -3.642
  371   2HD   PRO  45          1HD       PRO  45  -6.861   0.913  -2.980
  372    H    VAL  46           H        VAL  46  -3.891  -3.668  -3.931
  373    HA   VAL  46           HA       VAL  46  -6.046  -5.537  -4.564
  374    HB   VAL  46           HB       VAL  46  -3.081  -5.831  -5.082
  375   1HG1  VAL  46          1HG1      VAL  46  -4.272  -7.953  -5.026
  376   2HG1  VAL  46          2HG1      VAL  46  -3.771  -7.566  -6.673
  377   3HG1  VAL  46          3HG1      VAL  46  -5.451  -7.336  -6.183
  378   1HG2  VAL  46          1HG2      VAL  46  -5.278  -4.865  -6.912
  379   2HG2  VAL  46          2HG2      VAL  46  -3.624  -5.217  -7.409
  380   3HG2  VAL  46          3HG2      VAL  46  -3.944  -3.905  -6.279
  381    H    LEU  47           H        LEU  47  -6.727  -6.478  -2.720
  382    HA   LEU  47           HA       LEU  47  -4.759  -7.380  -0.773
  383   1HB   LEU  47          2HB       LEU  47  -7.774  -7.339  -0.628
  384   2HB   LEU  47          1HB       LEU  47  -6.701  -7.796   0.682
  385    HG   LEU  47           HG       LEU  47  -6.808  -5.055  -0.583
  386   1HD1  LEU  47          1HD1      LEU  47  -8.847  -5.548   0.652
  387   2HD1  LEU  47          2HD1      LEU  47  -7.863  -4.364   1.514
  388   3HD1  LEU  47          3HD1      LEU  47  -7.893  -6.043   2.049
  389   1HD2  LEU  47          1HD2      LEU  47  -5.424  -4.396   1.330
  390   2HD2  LEU  47          2HD2      LEU  47  -4.612  -5.588   0.315
  391   3HD2  LEU  47          3HD2      LEU  47  -5.343  -6.080   1.844
  392    H    LEU  48           H        LEU  48  -3.977  -9.040  -2.253
  393    HA   LEU  48           HA       LEU  48  -5.505 -11.518  -1.858
  394   1HB   LEU  48          2HB       LEU  48  -4.070 -10.701  -4.391
  395   2HB   LEU  48          1HB       LEU  48  -4.666 -12.318  -4.075
  396    HG   LEU  48           HG       LEU  48  -6.400  -9.854  -4.260
  397   1HD1  LEU  48          1HD1      LEU  48  -5.409 -10.385  -6.414
  398   2HD1  LEU  48          2HD1      LEU  48  -7.129 -10.776  -6.405
  399   3HD1  LEU  48          3HD1      LEU  48  -5.928 -12.062  -6.257
  400   1HD2  LEU  48          1HD2      LEU  48  -7.347 -11.578  -2.829
  401   2HD2  LEU  48          2HD2      LEU  48  -7.105 -12.780  -4.097
  402   3HD2  LEU  48          3HD2      LEU  48  -8.243 -11.455  -4.339
  403    H    ILE  49           H        ILE  49  -4.231 -13.353  -1.467
  404    HA   ILE  49           HA       ILE  49  -1.872 -12.741  -0.005
  405    HB   ILE  49           HB       ILE  49  -2.924 -15.463  -0.799
  406   1HG1  ILE  49          2HG1      ILE  49  -3.399 -13.857   1.723
  407   2HG1  ILE  49          1HG1      ILE  49  -4.572 -14.068   0.428
  408   1HG2  ILE  49          1HG2      ILE  49  -0.598 -15.518  -0.055
  409   2HG2  ILE  49          2HG2      ILE  49  -1.658 -16.276   1.133
  410   3HG2  ILE  49          3HG2      ILE  49  -1.040 -14.648   1.413
  411   1HD1  ILE  49          1HD1      ILE  49  -5.074 -15.550   2.264
  412   2HD1  ILE  49          2HD1      ILE  49  -3.447 -16.225   2.198
  413   3HD1  ILE  49          3HD1      ILE  49  -4.567 -16.491   0.861
  414    H    ASP  50           H        ASP  50  -2.422 -14.314  -3.139
  415    HA   ASP  50           HA       ASP  50   0.366 -14.968  -3.469
  416   1HB   ASP  50          2HB       ASP  50  -1.943 -15.086  -5.419
  417   2HB   ASP  50          1HB       ASP  50  -0.316 -15.661  -5.764
  418    H    GLU  51           H        GLU  51  -1.554 -12.226  -4.006
  419    HA   GLU  51           HA       GLU  51   0.171 -11.131  -6.081
  420   1HB   GLU  51          2HB       GLU  51  -2.189  -9.893  -4.654
  421   2HB   GLU  51          1HB       GLU  51  -1.365  -9.219  -6.053
  422   1HG   GLU  51          2HG       GLU  51  -2.904 -11.802  -5.983
  423   2HG   GLU  51          1HG       GLU  51  -3.462 -10.276  -6.663
  424    H    ALA  52           H        ALA  52   0.216 -11.409  -2.794
  425    HA   ALA  52           HA       ALA  52   1.111  -8.765  -2.103
  426   1HB   ALA  52          1HB       ALA  52   1.408  -9.667   0.136
  427   2HB   ALA  52          2HB       ALA  52   1.139 -11.302  -0.473
  428   3HB   ALA  52          3HB       ALA  52  -0.168 -10.119  -0.514
  429    H    THR  53           H        THR  53   3.167  -8.465  -0.927
  430    HA   THR  53           HA       THR  53   5.353 -10.132  -1.993
  431    HB   THR  53           HB       THR  53   5.552  -7.141  -1.615
  432    HG1  THR  53           1HG      THR  53   4.609  -8.647  -3.804
  433   1HG2  THR  53          1HG2      THR  53   7.492  -7.361  -3.093
  434   2HG2  THR  53          2HG2      THR  53   7.214  -9.100  -3.199
  435   3HG2  THR  53          3HG2      THR  53   7.665  -8.371  -1.658
  436    H    GLU  54           H        GLU  54   7.226 -10.231  -0.585
  437    HA   GLU  54           HA       GLU  54   6.553  -9.985   2.210
  438   1HB   GLU  54          2HB       GLU  54   7.832 -11.923   1.407
  439   2HB   GLU  54          1HB       GLU  54   9.125 -10.855   0.879
  440   1HG   GLU  54          2HG       GLU  54   9.567 -10.209   3.161
  441   2HG   GLU  54          1HG       GLU  54   8.211 -11.186   3.724
  442    H    TRP  55           H        TRP  55   7.119  -8.349   3.541
  443    HA   TRP  55           HA       TRP  55   9.113  -6.421   2.619
  444   1HB   TRP  55          2HB       TRP  55   6.695  -5.823   1.904
  445   2HB   TRP  55          1HB       TRP  55   6.448  -5.442   3.603
  446    HD1  TRP  55           HD       TRP  55   7.156  -3.070   4.370
  447    HE1  TRP  55           1HE      TRP  55   8.387  -1.097   3.264
  448    HE3  TRP  55           3HE      TRP  55   8.712  -5.382   0.081
  449    HZ2  TRP  55           2HZ      TRP  55   9.830  -0.595   0.889
  450    HZ3  TRP  55           3HZ      TRP  55  10.012  -4.082  -1.551
  451    HH2  TRP  55           HH       TRP  55  10.558  -1.739  -1.154
  452    H    THR  56           H        THR  56  10.367  -5.763   4.213
  453    HA   THR  56           HA       THR  56  11.309  -5.523   6.241
  454    HB   THR  56           HB       THR  56   8.488  -5.276   7.257
  455    HG1  THR  56           1HG      THR  56   9.876  -3.725   5.562
  456   1HG2  THR  56          1HG2      THR  56  11.095  -4.220   8.357
  457   2HG2  THR  56          2HG2      THR  56  10.164  -5.556   9.033
  458   3HG2  THR  56          3HG2      THR  56   9.497  -3.922   9.034
  459    HA   PRO  57           HA       PRO  57  10.740  -9.820   7.706
  460   1HB   PRO  57          2HB       PRO  57  13.482 -10.329   7.104
  461   2HB   PRO  57          1HB       PRO  57  12.067 -10.959   6.261
  462   1HG   PRO  57          2HG       PRO  57  13.910  -9.187   5.181
  463   2HG   PRO  57          1HG       PRO  57  12.270  -9.450   4.569
  464   1HD   PRO  57          2HD       PRO  57  13.315  -7.269   6.326
  465   2HD   PRO  57          1HD       PRO  57  12.107  -7.190   5.023
  466    H    ASN  58           H        ASN  58  12.234 -10.955   9.368
  467    HA   ASN  58           HA       ASN  58  13.018  -8.913  11.291
  468   1HB   ASN  58          2HB       ASN  58  12.397 -11.833  11.505
  469   2HB   ASN  58          1HB       ASN  58  13.331 -11.041  12.772
  470   1HD2  ASN  58          1HD2      ASN  58  12.359  -9.464  14.042
  471   2HD2  ASN  58          2HD2      ASN  58  10.639  -9.275  14.107
  472    H    ASN  59           H        ASN  59  14.988  -8.527  11.949
  473    HA   ASN  59           HA       ASN  59  17.215  -9.840  10.604
  474   1HB   ASN  59          2HB       ASN  59  17.065  -7.340  10.797
  475   2HB   ASN  59          1HB       ASN  59  17.217  -7.505  12.541
  476   1HD2  ASN  59          1HD2      ASN  59  19.090  -6.301  12.591
  477   2HD2  ASN  59          2HD2      ASN  59  20.611  -6.919  12.012
  478    H    LEU  60           H        LEU  60  19.239 -10.142  12.198
  479    HA   LEU  60           HA       LEU  60  18.385 -12.105  14.098
  480   1HB   LEU  60          2HB       LEU  60  20.652 -12.663  14.423
  481   2HB   LEU  60          1HB       LEU  60  20.493 -12.276  12.725
  482    HG   LEU  60           HG       LEU  60  21.504 -10.245  14.703
  483   1HD1  LEU  60          1HD1      LEU  60  23.126 -12.273  13.170
  484   2HD1  LEU  60          2HD1      LEU  60  22.908 -12.223  14.920
  485   3HD1  LEU  60          3HD1      LEU  60  23.774 -10.923  14.101
  486   1HD2  LEU  60          1HD2      LEU  60  20.857  -9.366  12.548
  487   2HD2  LEU  60          2HD2      LEU  60  21.821 -10.591  11.724
  488   3HD2  LEU  60          3HD2      LEU  60  22.615  -9.347  12.691
  489    H    GLU  61           H        GLU  61  18.176  -8.994  14.341
  490    HA   GLU  61           HA       GLU  61  19.084  -8.732  17.099
  491   1HB   GLU  61          2HB       GLU  61  19.601  -6.870  15.617
  492   2HB   GLU  61          1HB       GLU  61  17.902  -6.701  15.194
  493   1HG   GLU  61          2HG       GLU  61  17.395  -6.103  17.514
  494   2HG   GLU  61          1HG       GLU  61  19.107  -6.246  17.914
  Start of MODEL    6
    1   1H    MET   1          1HT       MET   1 -11.484  21.109  10.901
    2   2H    MET   1          2HT       MET   1  -9.995  21.901  11.065
    3   3H    MET   1          3HT       MET   1 -10.584  20.927  12.324
    4    HA   MET   1           HA       MET   1  -9.869  19.937   9.633
    5   1HB   MET   1          2HB       MET   1  -7.941  20.807  10.986
    6   2HB   MET   1          1HB       MET   1  -8.344  19.629  12.226
    7   1HG   MET   1          2HG       MET   1  -7.877  17.812  10.714
    8   2HG   MET   1          1HG       MET   1  -7.614  18.943   9.389
    9   1HE   MET   1          1HE       MET   1  -3.996  17.599   9.988
   10   2HE   MET   1          2HE       MET   1  -5.297  17.843   8.821
   11   3HE   MET   1          3HE       MET   1  -5.489  16.672  10.125
   12    H    SER   2           H        SER   2 -10.428  17.844   9.265
   13    HA   SER   2           HA       SER   2 -11.254  16.165  11.508
   14   1HB   SER   2          2HB       SER   2 -13.073  16.752   9.153
   15   2HB   SER   2          1HB       SER   2 -13.396  15.582  10.433
   16    HG   SER   2           HG       SER   2 -12.823  17.902  11.583
   17    H    LEU   3           H        LEU   3 -10.863  14.027  11.176
   18    HA   LEU   3           HA       LEU   3  -9.598  13.272   8.649
   19   1HB   LEU   3          2HB       LEU   3  -8.584  12.762  10.918
   20   2HB   LEU   3          1HB       LEU   3  -9.890  11.621  11.163
   21    HG   LEU   3           HG       LEU   3  -8.196  11.314   8.723
   22   1HD1  LEU   3          1HD1      LEU   3  -6.577  11.682  10.517
   23   2HD1  LEU   3          2HD1      LEU   3  -6.561  10.006   9.973
   24   3HD1  LEU   3          3HD1      LEU   3  -7.360  10.434  11.485
   25   1HD2  LEU   3          1HD2      LEU   3  -9.464   9.350  10.633
   26   2HD2  LEU   3          2HD2      LEU   3  -8.629   8.952   9.129
   27   3HD2  LEU   3          3HD2      LEU   3 -10.139   9.865   9.086
   28    H    ASP   4           H        ASP   4 -10.388  11.638   7.325
   29    HA   ASP   4           HA       ASP   4 -13.218  10.980   7.794
   30   1HB   ASP   4          2HB       ASP   4 -12.602  12.424   5.796
   31   2HB   ASP   4          1HB       ASP   4 -11.848  10.988   5.109
   32    HA   PRO   5           HA       PRO   5 -11.238   6.860   7.981
   33   1HB   PRO   5          2HB       PRO   5 -13.393   6.190   9.809
   34   2HB   PRO   5          1HB       PRO   5 -11.657   6.231  10.116
   35   1HG   PRO   5          2HG       PRO   5 -13.394   8.007  11.211
   36   2HG   PRO   5          1HG       PRO   5 -11.703   8.406  10.845
   37   1HD   PRO   5          2HD       PRO   5 -14.182   9.043   9.281
   38   2HD   PRO   5          1HD       PRO   5 -12.775  10.072   9.632
   39    H    GLN   6           H        GLN   6 -14.100   8.089   6.797
   40    HA   GLN   6           HA       GLN   6 -15.382   5.551   6.222
   41   1HB   GLN   6          2HB       GLN   6 -16.815   7.449   6.680
   42   2HB   GLN   6          1HB       GLN   6 -16.040   8.389   5.411
   43   1HG   GLN   6          2HG       GLN   6 -16.933   6.902   3.719
   44   2HG   GLN   6          1HG       GLN   6 -17.647   5.881   4.966
   45   1HE2  GLN   6          1HE2      GLN   6 -19.694   6.153   4.123
   46   2HE2  GLN   6          2HE2      GLN   6 -20.581   7.629   4.318
   47    H    LEU   7           H        LEU   7 -13.685   8.121   4.458
   48    HA   LEU   7           HA       LEU   7 -13.785   6.789   1.942
   49   1HB   LEU   7          2HB       LEU   7 -11.875   8.910   2.925
   50   2HB   LEU   7          1HB       LEU   7 -12.061   8.412   1.255
   51    HG   LEU   7           HG       LEU   7 -14.184   9.743   2.940
   52   1HD1  LEU   7          1HD1      LEU   7 -13.835  11.657   1.469
   53   2HD1  LEU   7          2HD1      LEU   7 -12.520  10.805   0.662
   54   3HD1  LEU   7          3HD1      LEU   7 -12.369  11.256   2.359
   55   1HD2  LEU   7          1HD2      LEU   7 -14.189   8.974   0.024
   56   2HD2  LEU   7          2HD2      LEU   7 -15.444   9.897   0.854
   57   3HD2  LEU   7          3HD2      LEU   7 -15.142   8.218   1.303
   58    H    LEU   8           H        LEU   8 -11.679   6.598   4.696
   59    HA   LEU   8           HA       LEU   8  -9.652   5.076   3.293
   60   1HB   LEU   8          2HB       LEU   8 -10.030   5.678   6.229
   61   2HB   LEU   8          1HB       LEU   8  -8.651   4.821   5.564
   62    HG   LEU   8           HG       LEU   8  -9.398   7.681   4.935
   63   1HD1  LEU   8          1HD1      LEU   8  -7.421   8.253   6.253
   64   2HD1  LEU   8          2HD1      LEU   8  -7.192   6.551   6.656
   65   3HD1  LEU   8          3HD1      LEU   8  -8.621   7.411   7.232
   66   1HD2  LEU   8          1HD2      LEU   8  -6.979   6.055   4.172
   67   2HD2  LEU   8          2HD2      LEU   8  -7.225   7.767   3.838
   68   3HD2  LEU   8          3HD2      LEU   8  -8.269   6.568   3.084
   69    H    GLU   9           H        GLU   9 -11.972   4.464   5.908
   70    HA   GLU   9           HA       GLU   9 -13.000   2.622   6.686
   71   1HB   GLU   9          2HB       GLU   9 -13.494   2.587   4.063
   72   2HB   GLU   9          1HB       GLU   9 -12.568   1.094   4.168
   73   1HG   GLU   9          2HG       GLU   9 -14.110   0.154   5.721
   74   2HG   GLU   9          1HG       GLU   9 -14.946   1.694   5.906
   75    H    VAL  10           H        VAL  10 -12.544  -0.136   6.156
   76    HA   VAL  10           HA       VAL  10 -10.092  -0.368   7.725
   77    HB   VAL  10           HB       VAL  10 -12.195  -2.472   7.189
   78   1HG1  VAL  10          1HG1      VAL  10 -10.035  -3.418   7.798
   79   2HG1  VAL  10          2HG1      VAL  10 -11.198  -3.627   9.109
   80   3HG1  VAL  10          3HG1      VAL  10  -9.963  -2.372   9.218
   81   1HG2  VAL  10          1HG2      VAL  10 -13.137  -0.567   8.386
   82   2HG2  VAL  10          2HG2      VAL  10 -11.844  -0.672   9.581
   83   3HG2  VAL  10          3HG2      VAL  10 -13.016  -1.979   9.435
   84    H    LEU  11           H        LEU  11  -8.363  -0.457   6.383
   85    HA   LEU  11           HA       LEU  11  -8.364  -2.281   4.120
   86   1HB   LEU  11          2HB       LEU  11  -6.149  -0.582   5.278
   87   2HB   LEU  11          1HB       LEU  11  -6.045  -1.505   3.791
   88    HG   LEU  11           HG       LEU  11  -7.929   0.809   4.268
   89   1HD1  LEU  11          1HD1      LEU  11  -6.501   2.030   2.721
   90   2HD1  LEU  11          2HD1      LEU  11  -5.400   0.652   2.635
   91   3HD1  LEU  11          3HD1      LEU  11  -5.605   1.525   4.155
   92   1HD2  LEU  11          1HD2      LEU  11  -8.355   0.660   1.858
   93   2HD2  LEU  11          2HD2      LEU  11  -8.842  -0.815   2.695
   94   3HD2  LEU  11          3HD2      LEU  11  -7.340  -0.780   1.770
   95    H    ALA  12           H        ALA  12  -8.079  -4.396   4.496
   96    HA   ALA  12           HA       ALA  12  -6.191  -5.218   6.584
   97   1HB   ALA  12          1HB       ALA  12  -7.809  -6.824   7.483
   98   2HB   ALA  12          2HB       ALA  12  -9.033  -6.201   6.376
   99   3HB   ALA  12          3HB       ALA  12  -8.379  -5.162   7.645
  100    H    CYS  13           H        CYS  13  -5.817  -7.625   6.509
  101    HA   CYS  13           HA       CYS  13  -5.385  -8.432   3.758
  102   1HB   CYS  13          2HB       CYS  13  -4.602  -9.773   6.352
  103   2HB   CYS  13          1HB       CYS  13  -4.068 -10.261   4.746
  104    HG   CYS  13           HG       CYS  13  -3.421  -7.064   5.457
  105    HA   PRO  14           HA       PRO  14  -8.714 -11.367   3.686
  106   1HB   PRO  14          2HB       PRO  14  -7.898 -13.063   1.784
  107   2HB   PRO  14          1HB       PRO  14  -8.292 -11.381   1.413
  108   1HG   PRO  14          2HG       PRO  14  -5.623 -12.670   1.762
  109   2HG   PRO  14          1HG       PRO  14  -6.131 -11.446   0.585
  110   1HD   PRO  14          2HD       PRO  14  -4.739 -10.917   2.914
  111   2HD   PRO  14          1HD       PRO  14  -5.716  -9.733   2.025
  112    H    LYS  15           H        LYS  15  -6.094 -12.021   5.397
  113    HA   LYS  15           HA       LYS  15  -6.820 -14.847   5.785
  114   1HB   LYS  15          2HB       LYS  15  -4.567 -14.645   4.834
  115   2HB   LYS  15          1HB       LYS  15  -4.092 -13.596   6.164
  116   1HG   LYS  15          2HG       LYS  15  -4.239 -15.363   7.732
  117   2HG   LYS  15          1HG       LYS  15  -5.051 -16.414   6.574
  118   1HD   LYS  15          2HD       LYS  15  -2.223 -15.397   6.270
  119   2HD   LYS  15          1HD       LYS  15  -2.654 -16.978   6.930
  120   1HE   LYS  15          2HE       LYS  15  -3.830 -17.475   4.796
  121   2HE   LYS  15          1HE       LYS  15  -3.223 -15.952   4.150
  122   1HZ   LYS  15          1HZ       LYS  15  -1.544 -18.208   5.112
  123   2HZ   LYS  15          2HZ       LYS  15  -0.968 -16.758   4.444
  124   3HZ   LYS  15          3HZ       LYS  15  -1.859 -17.841   3.484
  125    H    ASP  16           H        ASP  16  -4.955 -12.412   7.641
  126    HA   ASP  16           HA       ASP  16  -6.299 -13.303  10.070
  127   1HB   ASP  16          2HB       ASP  16  -4.682 -11.979  11.263
  128   2HB   ASP  16          1HB       ASP  16  -3.818 -12.843   9.994
  129    H    LYS  17           H        LYS  17  -6.367 -10.765   7.779
  130    HA   LYS  17           HA       LYS  17  -7.697  -8.985   7.424
  131   1HB   LYS  17          2HB       LYS  17  -9.413 -10.824   8.102
  132   2HB   LYS  17          1HB       LYS  17  -9.553  -9.910   9.599
  133   1HG   LYS  17          2HG       LYS  17 -10.337  -7.986   8.453
  134   2HG   LYS  17          1HG       LYS  17  -9.948  -8.686   6.881
  135   1HD   LYS  17          2HD       LYS  17 -11.620 -10.479   7.351
  136   2HD   LYS  17          1HD       LYS  17 -12.083  -9.585   8.804
  137   1HE   LYS  17          2HE       LYS  17 -12.725  -7.676   7.472
  138   2HE   LYS  17          1HE       LYS  17 -12.158  -8.472   6.004
  139   1HZ   LYS  17          1HZ       LYS  17 -14.530  -8.660   6.154
  140   2HZ   LYS  17          2HZ       LYS  17 -14.433  -9.325   7.711
  141   3HZ   LYS  17          3HZ       LYS  17 -13.849 -10.198   6.378
  142    H    GLY  18           H        GLY  18  -5.545  -8.785   9.282
  143   1HA   GLY  18          2HA       GLY  18  -6.489  -6.961  11.343
  144   2HA   GLY  18          1HA       GLY  18  -4.830  -7.479  11.088
  145    HA   PRO  19           HA       PRO  19  -5.834  -3.133   9.337
  146   1HB   PRO  19          2HB       PRO  19  -4.100  -2.189  11.531
  147   2HB   PRO  19          1HB       PRO  19  -5.665  -1.575  10.990
  148   1HG   PRO  19          2HG       PRO  19  -5.422  -2.917  13.291
  149   2HG   PRO  19          1HG       PRO  19  -6.853  -3.098  12.258
  150   1HD   PRO  19          2HD       PRO  19  -4.485  -4.915  12.549
  151   2HD   PRO  19          1HD       PRO  19  -6.212  -5.323  12.437
  152    H    LEU  20           H        LEU  20  -4.603  -2.904   7.623
  153    HA   LEU  20           HA       LEU  20  -1.857  -3.689   7.533
  154   1HB   LEU  20          2HB       LEU  20  -3.703  -2.324   5.591
  155   2HB   LEU  20          1HB       LEU  20  -2.012  -2.598   5.227
  156    HG   LEU  20           HG       LEU  20  -3.860  -4.853   5.982
  157   1HD1  LEU  20          1HD1      LEU  20  -4.121  -5.313   3.608
  158   2HD1  LEU  20          2HD1      LEU  20  -3.202  -3.862   3.211
  159   3HD1  LEU  20          3HD1      LEU  20  -4.772  -3.721   4.001
  160   1HD2  LEU  20          1HD2      LEU  20  -1.452  -5.251   6.166
  161   2HD2  LEU  20          2HD2      LEU  20  -1.243  -4.738   4.492
  162   3HD2  LEU  20          3HD2      LEU  20  -2.164  -6.196   4.859
  163    H    ARG  21           H        ARG  21  -0.038  -2.442   7.422
  164    HA   ARG  21           HA       ARG  21  -0.246   0.238   8.506
  165   1HB   ARG  21          2HB       ARG  21   1.481  -1.365   9.297
  166   2HB   ARG  21          1HB       ARG  21   2.190  -1.364   7.688
  167   1HG   ARG  21          2HG       ARG  21   2.760   0.970   7.891
  168   2HG   ARG  21          1HG       ARG  21   1.947   1.055   9.456
  169   1HD   ARG  21          2HD       ARG  21   3.530  -0.560  10.375
  170   2HD   ARG  21          1HD       ARG  21   4.334  -0.669   8.810
  171    HE   ARG  21           HE       ARG  21   4.386   1.994   9.441
  172   1HH1  ARG  21          1HH1      ARG  21   5.477  -0.939  11.039
  173   2HH1  ARG  21          2HH1      ARG  21   6.826  -0.165  11.810
  174   1HH2  ARG  21          1HH2      ARG  21   6.146   3.009  10.454
  175   2HH2  ARG  21          2HH2      ARG  21   7.236   2.090  11.448
  176    H    TYR  22           H        TYR  22  -0.183   2.059   7.322
  177    HA   TYR  22           HA       TYR  22  -0.168   1.715   4.429
  178   1HB   TYR  22          2HB       TYR  22  -2.002   2.908   5.809
  179   2HB   TYR  22          1HB       TYR  22  -0.866   4.244   5.908
  180    HD1  TYR  22           1HD      TYR  22   0.024   5.164   3.618
  181    HD2  TYR  22           2HD      TYR  22  -3.460   2.759   4.042
  182    HE1  TYR  22           1HE      TYR  22  -0.814   6.002   1.462
  183    HE2  TYR  22           2HE      TYR  22  -4.302   3.588   1.891
  184    HH   TYR  22           HH       TYR  22  -4.024   5.560   0.443
  185    H    LEU  23           H        LEU  23   1.580   2.164   3.291
  186    HA   LEU  23           HA       LEU  23   3.555   4.062   4.319
  187   1HB   LEU  23          2HB       LEU  23   3.595   2.107   2.026
  188   2HB   LEU  23          1HB       LEU  23   4.830   3.333   2.222
  189    HG   LEU  23           HG       LEU  23   5.688   1.282   3.081
  190   1HD1  LEU  23          1HD1      LEU  23   6.272   3.273   4.343
  191   2HD1  LEU  23          2HD1      LEU  23   6.168   1.864   5.397
  192   3HD1  LEU  23          3HD1      LEU  23   4.861   3.047   5.376
  193   1HD2  LEU  23          1HD2      LEU  23   4.605   0.037   4.889
  194   2HD2  LEU  23          2HD2      LEU  23   3.601   0.092   3.441
  195   3HD2  LEU  23          3HD2      LEU  23   3.226   1.133   4.813
  196    H    GLU  24           H        GLU  24   3.161   6.106   3.880
  197    HA   GLU  24           HA       GLU  24   1.327   7.031   1.961
  198   1HB   GLU  24          2HB       GLU  24   3.574   8.704   3.078
  199   2HB   GLU  24          1HB       GLU  24   1.964   9.222   2.607
  200   1HG   GLU  24          2HG       GLU  24   2.658   7.532   5.000
  201   2HG   GLU  24          1HG       GLU  24   2.222   9.238   5.014
  202    H    SER  25           H        SER  25   4.733   6.395   1.825
  203    HA   SER  25           HA       SER  25   5.632   8.050  -0.175
  204   1HB   SER  25          2HB       SER  25   7.238   6.030  -0.621
  205   2HB   SER  25          1HB       SER  25   7.270   6.851   0.942
  206    HG   SER  25           HG       SER  25   6.470   5.137   1.882
  207    H    GLU  26           H        GLU  26   4.660   4.650  -0.728
  208    HA   GLU  26           HA       GLU  26   3.979   5.425  -3.494
  209   1HB   GLU  26          2HB       GLU  26   5.343   2.897  -2.566
  210   2HB   GLU  26          1HB       GLU  26   4.736   3.159  -4.196
  211   1HG   GLU  26          2HG       GLU  26   6.248   5.143  -4.347
  212   2HG   GLU  26          1HG       GLU  26   6.956   4.638  -2.810
  213    H    GLN  27           H        GLN  27   2.366   5.028  -1.006
  214    HA   GLN  27           HA       GLN  27   0.471   4.048  -0.271
  215   1HB   GLN  27          2HB       GLN  27   0.050   3.853  -3.253
  216   2HB   GLN  27          1HB       GLN  27  -1.184   3.384  -2.093
  217   1HG   GLN  27          2HG       GLN  27  -1.728   5.566  -2.728
  218   2HG   GLN  27          1HG       GLN  27  -0.983   5.722  -1.141
  219   1HE2  GLN  27          1HE2      GLN  27  -0.360   7.826  -1.411
  220   2HE2  GLN  27          2HE2      GLN  27   0.902   8.310  -2.499
  221    H    LEU  28           H        LEU  28   1.883   2.387   0.611
  222    HA   LEU  28           HA       LEU  28   1.333  -0.241  -0.599
  223   1HB   LEU  28          2HB       LEU  28   3.730   0.593   1.042
  224   2HB   LEU  28          1HB       LEU  28   3.416  -1.035   0.471
  225    HG   LEU  28           HG       LEU  28   3.913   1.359  -1.305
  226   1HD1  LEU  28          1HD1      LEU  28   5.700  -0.954  -0.569
  227   2HD1  LEU  28          2HD1      LEU  28   5.907   0.727  -0.071
  228   3HD1  LEU  28          3HD1      LEU  28   6.060   0.286  -1.773
  229   1HD2  LEU  28          1HD2      LEU  28   3.654  -1.576  -1.956
  230   2HD2  LEU  28          2HD2      LEU  28   4.066  -0.295  -3.096
  231   3HD2  LEU  28          3HD2      LEU  28   2.473  -0.324  -2.338
  232    H    LEU  29           H        LEU  29   0.800  -1.928   0.826
  233    HA   LEU  29           HA       LEU  29   0.073  -1.038   3.542
  234   1HB   LEU  29          2HB       LEU  29  -1.426  -2.908   1.703
  235   2HB   LEU  29          1HB       LEU  29  -1.835  -2.629   3.386
  236    HG   LEU  29           HG       LEU  29  -1.840  -0.489   1.258
  237   1HD1  LEU  29          1HD1      LEU  29  -4.296  -0.632   1.440
  238   2HD1  LEU  29          2HD1      LEU  29  -4.113  -2.058   2.459
  239   3HD1  LEU  29          3HD1      LEU  29  -3.571  -2.100   0.782
  240   1HD2  LEU  29          1HD2      LEU  29  -3.022   0.831   2.933
  241   2HD2  LEU  29          2HD2      LEU  29  -1.433   0.345   3.523
  242   3HD2  LEU  29          3HD2      LEU  29  -2.877  -0.490   4.092
  243    H    VAL  30           H        VAL  30   1.427  -2.011   4.919
  244    HA   VAL  30           HA       VAL  30   2.264  -4.778   4.327
  245    HB   VAL  30           HB       VAL  30   3.672  -2.755   6.080
  246   1HG1  VAL  30          1HG1      VAL  30   5.534  -4.358   6.034
  247   2HG1  VAL  30          2HG1      VAL  30   4.534  -5.486   5.122
  248   3HG1  VAL  30          3HG1      VAL  30   4.092  -5.054   6.773
  249   1HG2  VAL  30          1HG2      VAL  30   4.332  -3.677   3.283
  250   2HG2  VAL  30          2HG2      VAL  30   5.363  -2.658   4.294
  251   3HG2  VAL  30          3HG2      VAL  30   3.789  -2.065   3.757
  252    H    ASN  31           H        ASN  31   1.613  -6.331   5.654
  253    HA   ASN  31           HA       ASN  31   0.303  -5.615   8.170
  254   1HB   ASN  31          2HB       ASN  31  -0.769  -7.255   6.591
  255   2HB   ASN  31          1HB       ASN  31   0.582  -8.346   6.881
  256   1HD2  ASN  31          1HD2      ASN  31  -2.253  -8.727   7.402
  257   2HD2  ASN  31          2HD2      ASN  31  -2.399  -9.067   9.095
  258    H    GLU  32           H        GLU  32   1.453  -5.579   9.981
  259    HA   GLU  32           HA       GLU  32   4.175  -6.531   9.930
  260   1HB   GLU  32          2HB       GLU  32   3.240  -4.329  10.949
  261   2HB   GLU  32          1HB       GLU  32   2.847  -5.334  12.338
  262   1HG   GLU  32          2HG       GLU  32   5.149  -5.903  12.660
  263   2HG   GLU  32          1HG       GLU  32   5.603  -5.116  11.149
  264    H    ARG  33           H        ARG  33   1.324  -8.036  10.549
  265    HA   ARG  33           HA       ARG  33   2.346  -9.811  12.626
  266   1HB   ARG  33          2HB       ARG  33  -0.183  -9.932  10.975
  267   2HB   ARG  33          1HB       ARG  33   0.231 -11.063  12.251
  268   1HG   ARG  33          2HG       ARG  33   0.128  -9.284  13.893
  269   2HG   ARG  33          1HG       ARG  33  -0.224  -8.111  12.618
  270   1HD   ARG  33          2HD       ARG  33  -2.260  -9.309  12.059
  271   2HD   ARG  33          1HD       ARG  33  -1.908 -10.518  13.291
  272    HE   ARG  33           HE       ARG  33  -1.977  -8.339  14.784
  273   1HH1  ARG  33          1HH1      ARG  33  -4.098  -9.327  12.178
  274   2HH1  ARG  33          2HH1      ARG  33  -5.501  -8.568  12.871
  275   1HH2  ARG  33          1HH2      ARG  33  -3.798  -7.263  15.650
  276   2HH2  ARG  33          2HH2      ARG  33  -5.328  -7.356  14.819
  277    H    LEU  34           H        LEU  34   1.073 -10.235   9.338
  278    HA   LEU  34           HA       LEU  34   2.257 -12.838   9.095
  279   1HB   LEU  34          2HB       LEU  34   0.872 -11.119   7.039
  280   2HB   LEU  34          1HB       LEU  34   1.292 -12.807   6.828
  281    HG   LEU  34           HG       LEU  34  -0.681 -11.722   8.843
  282   1HD1  LEU  34          1HD1      LEU  34  -2.359 -12.839   7.462
  283   2HD1  LEU  34          2HD1      LEU  34  -1.109 -13.292   6.306
  284   3HD1  LEU  34          3HD1      LEU  34  -1.504 -11.594   6.552
  285   1HD2  LEU  34          1HD2      LEU  34   0.055 -14.571   8.172
  286   2HD2  LEU  34          2HD2      LEU  34  -1.210 -14.054   9.289
  287   3HD2  LEU  34          3HD2      LEU  34   0.482 -13.717   9.657
  288    H    ASN  35           H        ASN  35   3.408  -9.733   8.683
  289    HA   ASN  35           HA       ASN  35   5.348  -8.859   7.897
  290   1HB   ASN  35          2HB       ASN  35   6.099 -11.205   8.910
  291   2HB   ASN  35          1HB       ASN  35   6.454 -11.556   7.224
  292   1HD2  ASN  35          1HD2      ASN  35   7.217  -8.856   6.554
  293   2HD2  ASN  35          2HD2      ASN  35   8.747  -8.565   7.298
  294    H    LEU  36           H        LEU  36   3.117  -9.355   6.153
  295    HA   LEU  36           HA       LEU  36   4.473  -9.726   3.560
  296   1HB   LEU  36          2HB       LEU  36   1.604 -10.315   4.298
  297   2HB   LEU  36          1HB       LEU  36   2.259 -10.430   2.677
  298    HG   LEU  36           HG       LEU  36   3.111 -12.111   5.033
  299   1HD1  LEU  36          1HD1      LEU  36   0.853 -12.631   4.264
  300   2HD1  LEU  36          2HD1      LEU  36   1.981 -13.931   3.881
  301   3HD1  LEU  36          3HD1      LEU  36   1.455 -12.818   2.617
  302   1HD2  LEU  36          1HD2      LEU  36   4.340 -13.417   3.369
  303   2HD2  LEU  36          2HD2      LEU  36   4.929 -11.755   3.455
  304   3HD2  LEU  36          3HD2      LEU  36   3.884 -12.255   2.122
  305    H    ALA  37           H        ALA  37   3.855  -8.350   1.860
  306    HA   ALA  37           HA       ALA  37   2.422  -5.924   2.710
  307   1HB   ALA  37          1HB       ALA  37   4.838  -5.546   2.523
  308   2HB   ALA  37          2HB       ALA  37   3.924  -4.613   1.336
  309   3HB   ALA  37          3HB       ALA  37   4.780  -6.074   0.841
  310    H    TYR  38           H        TYR  38   0.966  -5.065   1.361
  311    HA   TYR  38           HA       TYR  38   0.582  -6.326  -1.277
  312   1HB   TYR  38          2HB       TYR  38  -1.484  -5.032   0.521
  313   2HB   TYR  38          1HB       TYR  38  -1.798  -5.674  -1.087
  314    HD1  TYR  38           1HD      TYR  38  -1.738  -8.115  -1.476
  315    HD2  TYR  38           2HD      TYR  38  -1.315  -6.472   2.427
  316    HE1  TYR  38           1HE      TYR  38  -2.241 -10.316  -0.499
  317    HE2  TYR  38           2HE      TYR  38  -1.814  -8.667   3.409
  318    HH   TYR  38           HH       TYR  38  -1.805 -11.522   1.636
  319    H    ARG  39           H        ARG  39   0.118  -4.923  -3.014
  320    HA   ARG  39           HA       ARG  39   1.076  -2.196  -2.549
  321   1HB   ARG  39          2HB       ARG  39   1.484  -2.156  -4.996
  322   2HB   ARG  39          1HB       ARG  39   2.380  -3.419  -4.165
  323   1HG   ARG  39          2HG       ARG  39   0.819  -5.089  -4.931
  324   2HG   ARG  39          1HG       ARG  39  -0.196  -3.849  -5.668
  325   1HD   ARG  39          2HD       ARG  39   1.589  -3.278  -7.210
  326   2HD   ARG  39          1HD       ARG  39   2.656  -4.450  -6.438
  327    HE   ARG  39           HE       ARG  39   0.959  -6.164  -7.193
  328   1HH1  ARG  39          1HH1      ARG  39   1.435  -3.150  -8.917
  329   2HH1  ARG  39          2HH1      ARG  39   0.916  -3.794 -10.440
  330   1HH2  ARG  39          1HH2      ARG  39   0.306  -7.017  -9.166
  331   2HH2  ARG  39          2HH2      ARG  39   0.298  -6.018 -10.592
  332    H    ILE  40           H        ILE  40  -0.121  -0.416  -3.063
  333    HA   ILE  40           HA       ILE  40  -2.855  -0.877  -4.000
  334    HB   ILE  40           HB       ILE  40  -1.552   1.679  -3.040
  335   1HG1  ILE  40          2HG1      ILE  40  -3.516  -0.157  -1.652
  336   2HG1  ILE  40          1HG1      ILE  40  -1.806  -0.014  -1.262
  337   1HG2  ILE  40          1HG2      ILE  40  -4.436   1.081  -3.682
  338   2HG2  ILE  40          2HG2      ILE  40  -3.356   2.134  -4.597
  339   3HG2  ILE  40          3HG2      ILE  40  -3.836   2.575  -2.956
  340   1HD1  ILE  40          1HD1      ILE  40  -2.148   2.306  -0.598
  341   2HD1  ILE  40          2HD1      ILE  40  -3.183   1.208   0.316
  342   3HD1  ILE  40          3HD1      ILE  40  -3.859   2.170  -1.000
  343    H    ASP  41           H        ASP  41  -3.189  -0.848  -6.110
  344    HA   ASP  41           HA       ASP  41  -1.205   0.472  -7.820
  345   1HB   ASP  41          2HB       ASP  41  -1.611  -1.952  -8.189
  346   2HB   ASP  41          1HB       ASP  41  -3.292  -1.590  -8.566
  347    H    ASP  42           H        ASP  42  -1.803   2.504  -8.007
  348    HA   ASP  42           HA       ASP  42  -3.001   4.370  -8.479
  349   1HB   ASP  42          2HB       ASP  42  -2.610   3.332 -10.723
  350   2HB   ASP  42          1HB       ASP  42  -4.221   2.628 -10.625
  351    H    GLY  43           H        GLY  43  -4.117   3.756  -6.340
  352   1HA   GLY  43          2HA       GLY  43  -6.092   4.411  -5.280
  353   2HA   GLY  43          1HA       GLY  43  -6.939   4.274  -6.809
  354    H    ILE  44           H        ILE  44  -5.579   1.444  -6.939
  355    HA   ILE  44           HA       ILE  44  -7.757   0.184  -5.406
  356    HB   ILE  44           HB       ILE  44  -6.352  -0.862  -7.868
  357   1HG1  ILE  44          2HG1      ILE  44  -9.140   0.246  -7.499
  358   2HG1  ILE  44          1HG1      ILE  44  -7.823   1.052  -8.342
  359   1HG2  ILE  44          1HG2      ILE  44  -8.692  -1.966  -6.319
  360   2HG2  ILE  44          2HG2      ILE  44  -7.077  -2.666  -6.413
  361   3HG2  ILE  44          3HG2      ILE  44  -8.092  -2.599  -7.853
  362   1HD1  ILE  44          1HD1      ILE  44  -9.094  -1.549  -9.170
  363   2HD1  ILE  44          2HD1      ILE  44  -7.822  -0.689 -10.037
  364   3HD1  ILE  44          3HD1      ILE  44  -9.426   0.030  -9.879
  365    HA   PRO  45           HA       PRO  45  -4.307  -1.612  -3.089
  366   1HB   PRO  45          2HB       PRO  45  -5.874  -2.619  -1.106
  367   2HB   PRO  45          1HB       PRO  45  -5.333  -0.937  -1.148
  368   1HG   PRO  45          2HG       PRO  45  -7.970  -2.102  -1.925
  369   2HG   PRO  45          1HG       PRO  45  -7.621  -0.591  -1.069
  370   1HD   PRO  45          2HD       PRO  45  -8.248  -0.704  -3.716
  371   2HD   PRO  45          1HD       PRO  45  -7.223   0.559  -3.011
  372    H    VAL  46           H        VAL  46  -3.580  -3.365  -4.136
  373    HA   VAL  46           HA       VAL  46  -5.349  -5.441  -5.045
  374    HB   VAL  46           HB       VAL  46  -2.327  -5.354  -5.108
  375   1HG1  VAL  46          1HG1      VAL  46  -4.273  -7.069  -6.652
  376   2HG1  VAL  46          2HG1      VAL  46  -3.215  -7.613  -5.352
  377   3HG1  VAL  46          3HG1      VAL  46  -2.521  -7.041  -6.868
  378   1HG2  VAL  46          1HG2      VAL  46  -2.585  -4.623  -7.436
  379   2HG2  VAL  46          2HG2      VAL  46  -3.306  -3.468  -6.312
  380   3HG2  VAL  46          3HG2      VAL  46  -4.336  -4.573  -7.223
  381    H    LEU  47           H        LEU  47  -6.205  -6.614  -3.420
  382    HA   LEU  47           HA       LEU  47  -4.400  -7.654  -1.355
  383   1HB   LEU  47          2HB       LEU  47  -7.418  -7.640  -1.443
  384   2HB   LEU  47          1HB       LEU  47  -6.438  -8.215  -0.108
  385    HG   LEU  47           HG       LEU  47  -6.509  -5.364  -1.097
  386   1HD1  LEU  47          1HD1      LEU  47  -7.740  -4.899   0.955
  387   2HD1  LEU  47          2HD1      LEU  47  -7.745  -6.615   1.354
  388   3HD1  LEU  47          3HD1      LEU  47  -8.618  -6.036  -0.064
  389   1HD2  LEU  47          1HD2      LEU  47  -5.267  -4.872   0.951
  390   2HD2  LEU  47          2HD2      LEU  47  -4.369  -5.965  -0.101
  391   3HD2  LEU  47          3HD2      LEU  47  -5.197  -6.594   1.324
  392    H    LEU  48           H        LEU  48  -3.507  -9.128  -2.969
  393    HA   LEU  48           HA       LEU  48  -5.168 -11.552  -3.216
  394   1HB   LEU  48          2HB       LEU  48  -3.072 -10.527  -5.137
  395   2HB   LEU  48          1HB       LEU  48  -3.849 -12.092  -5.256
  396    HG   LEU  48           HG       LEU  48  -5.255  -9.428  -5.484
  397   1HD1  LEU  48          1HD1      LEU  48  -4.510 -11.469  -7.578
  398   2HD1  LEU  48          2HD1      LEU  48  -3.822  -9.857  -7.399
  399   3HD1  LEU  48          3HD1      LEU  48  -5.515 -10.046  -7.848
  400   1HD2  LEU  48          1HD2      LEU  48  -6.708 -11.140  -4.553
  401   2HD2  LEU  48          2HD2      LEU  48  -6.266 -12.247  -5.853
  402   3HD2  LEU  48          3HD2      LEU  48  -7.172 -10.777  -6.218
  403    H    ILE  49           H        ILE  49  -4.258 -13.444  -2.558
  404    HA   ILE  49           HA       ILE  49  -2.095 -13.404  -0.776
  405    HB   ILE  49           HB       ILE  49  -3.296 -15.756  -2.253
  406   1HG1  ILE  49          2HG1      ILE  49  -4.896 -14.528  -0.833
  407   2HG1  ILE  49          1HG1      ILE  49  -4.557 -16.129  -0.178
  408   1HG2  ILE  49          1HG2      ILE  49  -1.526 -15.756   0.188
  409   2HG2  ILE  49          2HG2      ILE  49  -1.050 -16.275  -1.427
  410   3HG2  ILE  49          3HG2      ILE  49  -2.292 -17.166  -0.544
  411   1HD1  ILE  49          1HD1      ILE  49  -3.010 -15.116   1.438
  412   2HD1  ILE  49          2HD1      ILE  49  -4.649 -14.489   1.592
  413   3HD1  ILE  49          3HD1      ILE  49  -3.405 -13.523   0.795
  414    H    ASP  50           H        ASP  50  -2.265 -14.064  -4.207
  415    HA   ASP  50           HA       ASP  50   0.370 -15.085  -4.493
  416   1HB   ASP  50          2HB       ASP  50  -1.415 -15.496  -6.150
  417   2HB   ASP  50          1HB       ASP  50  -1.417 -13.782  -6.560
  418    H    GLU  51           H        GLU  51  -0.967 -11.882  -4.344
  419    HA   GLU  51           HA       GLU  51   1.426 -10.608  -5.366
  420   1HB   GLU  51          2HB       GLU  51  -1.127  -9.519  -4.175
  421   2HB   GLU  51          1HB       GLU  51   0.212  -8.496  -4.680
  422   1HG   GLU  51          2HG       GLU  51  -1.262 -10.395  -6.489
  423   2HG   GLU  51          1HG       GLU  51  -1.598  -8.669  -6.348
  424    H    ALA  52           H        ALA  52   0.260 -11.765  -2.393
  425    HA   ALA  52           HA       ALA  52   1.469  -9.963  -0.599
  426   1HB   ALA  52          1HB       ALA  52  -0.250 -11.558   0.097
  427   2HB   ALA  52          2HB       ALA  52   1.211 -11.720   1.073
  428   3HB   ALA  52          3HB       ALA  52   0.866 -12.893  -0.198
  429    H    THR  53           H        THR  53   3.535  -9.479  -0.656
  430    HA   THR  53           HA       THR  53   5.505 -11.658  -0.922
  431    HB   THR  53           HB       THR  53   6.075  -8.756  -1.510
  432    HG1  THR  53           1HG      THR  53   4.276  -9.836  -2.810
  433   1HG2  THR  53          1HG2      THR  53   7.858  -9.692  -2.904
  434   2HG2  THR  53          2HG2      THR  53   7.342 -11.323  -2.475
  435   3HG2  THR  53          3HG2      THR  53   7.998 -10.252  -1.238
  436    H    GLU  54           H        GLU  54   7.366 -11.530   0.475
  437    HA   GLU  54           HA       GLU  54   6.774 -10.443   3.064
  438   1HB   GLU  54          2HB       GLU  54   9.349 -11.661   2.036
  439   2HB   GLU  54          1HB       GLU  54   8.961 -11.347   3.722
  440   1HG   GLU  54          2HG       GLU  54   7.100 -12.935   3.577
  441   2HG   GLU  54          1HG       GLU  54   7.534 -13.270   1.902
  442    H    TRP  55           H        TRP  55   7.528  -8.615   4.009
  443    HA   TRP  55           HA       TRP  55   9.455  -6.967   2.548
  444   1HB   TRP  55          2HB       TRP  55   7.113  -6.402   1.807
  445   2HB   TRP  55          1HB       TRP  55   6.772  -5.912   3.460
  446    HD1  TRP  55           HD       TRP  55   7.585  -3.531   4.210
  447    HE1  TRP  55           1HE      TRP  55   8.681  -1.559   2.979
  448    HE3  TRP  55           3HE      TRP  55   8.832  -5.890  -0.146
  449    HZ2  TRP  55           2HZ      TRP  55   9.904  -1.060   0.476
  450    HZ3  TRP  55           3HZ      TRP  55   9.960  -4.598  -1.908
  451    HH2  TRP  55           HH       TRP  55  10.485  -2.234  -1.602
  452    H    THR  56           H        THR  56  10.687  -5.677   3.836
  453    HA   THR  56           HA       THR  56  11.665  -4.816   5.668
  454    HB   THR  56           HB       THR  56   8.937  -5.101   6.909
  455    HG1  THR  56           1HG      THR  56  10.064  -2.638   6.169
  456   1HG2  THR  56          1HG2      THR  56   9.707  -3.482   8.575
  457   2HG2  THR  56          2HG2      THR  56  11.317  -3.497   7.855
  458   3HG2  THR  56          3HG2      THR  56  10.683  -4.948   8.631
  459    HA   PRO  57           HA       PRO  57  12.599  -8.723   7.795
  460   1HB   PRO  57          2HB       PRO  57  15.361  -8.139   7.229
  461   2HB   PRO  57          1HB       PRO  57  14.378  -9.464   6.604
  462   1HG   PRO  57          2HG       PRO  57  15.330  -7.406   5.061
  463   2HG   PRO  57          1HG       PRO  57  13.881  -8.351   4.674
  464   1HD   PRO  57          2HD       PRO  57  14.098  -5.647   5.956
  465   2HD   PRO  57          1HD       PRO  57  12.955  -6.223   4.720
  466    H    ASN  58           H        ASN  58  13.324  -8.857   9.910
  467    HA   ASN  58           HA       ASN  58  14.059  -6.300  11.142
  468   1HB   ASN  58          2HB       ASN  58  12.070  -7.499  12.025
  469   2HB   ASN  58          1HB       ASN  58  13.109  -8.853  12.461
  470   1HD2  ASN  58          1HD2      ASN  58  12.653  -8.699  14.637
  471   2HD2  ASN  58          2HD2      ASN  58  13.228  -7.403  15.628
  472    H    ASN  59           H        ASN  59  15.950  -5.986  12.167
  473    HA   ASN  59           HA       ASN  59  17.914  -8.159  12.122
  474   1HB   ASN  59          2HB       ASN  59  18.582  -5.989  11.149
  475   2HB   ASN  59          1HB       ASN  59  18.261  -5.195  12.682
  476   1HD2  ASN  59          1HD2      ASN  59  20.701  -5.432  11.036
  477   2HD2  ASN  59          2HD2      ASN  59  21.919  -6.053  12.107
  478    H    LEU  60           H        LEU  60  17.862  -9.404  13.872
  479    HA   LEU  60           HA       LEU  60  16.852  -8.584  16.388
  480   1HB   LEU  60          2HB       LEU  60  18.520 -10.972  15.592
  481   2HB   LEU  60          1HB       LEU  60  17.922 -10.721  17.219
  482    HG   LEU  60           HG       LEU  60  16.453 -12.260  16.198
  483   1HD1  LEU  60          1HD1      LEU  60  15.320 -10.579  17.517
  484   2HD1  LEU  60          2HD1      LEU  60  14.309 -11.070  16.155
  485   3HD1  LEU  60          3HD1      LEU  60  15.176  -9.533  16.105
  486   1HD2  LEU  60          1HD2      LEU  60  15.296 -11.826  14.071
  487   2HD2  LEU  60          2HD2      LEU  60  17.045 -11.931  13.876
  488   3HD2  LEU  60          3HD2      LEU  60  16.252 -10.356  13.868
  489    H    GLU  61           H        GLU  61  17.770  -7.417  17.867
  490    HA   GLU  61           HA       GLU  61  20.089  -6.004  17.480
  491   1HB   GLU  61          2HB       GLU  61  18.718  -6.615  20.102
  492   2HB   GLU  61          1HB       GLU  61  19.849  -5.296  19.818
  493   1HG   GLU  61          2HG       GLU  61  18.330  -4.290  18.227
  494   2HG   GLU  61          1HG       GLU  61  17.207  -5.637  18.414
  Start of MODEL    7
    1   1H    MET   1          1HT       MET   1  -5.609  19.856   6.067
    2   2H    MET   1          2HT       MET   1  -5.127  18.556   5.093
    3   3H    MET   1          3HT       MET   1  -4.419  20.082   4.879
    4    HA   MET   1           HA       MET   1  -3.455  19.961   7.098
    5   1HB   MET   1          2HB       MET   1  -4.660  17.186   7.047
    6   2HB   MET   1          1HB       MET   1  -3.486  17.735   8.233
    7   1HG   MET   1          2HG       MET   1  -5.040  19.413   9.032
    8   2HG   MET   1          1HG       MET   1  -6.210  18.932   7.803
    9   1HE   MET   1          1HE       MET   1  -5.910  15.781   7.776
   10   2HE   MET   1          2HE       MET   1  -7.474  16.598   7.789
   11   3HE   MET   1          3HE       MET   1  -7.146  15.303   8.940
   12    H    SER   2           H        SER   2  -2.943  19.462   4.194
   13    HA   SER   2           HA       SER   2  -1.301  18.710   2.828
   14   1HB   SER   2          2HB       SER   2   0.211  18.326   5.428
   15   2HB   SER   2          1HB       SER   2   0.934  18.342   3.818
   16    HG   SER   2           HG       SER   2   0.167  20.429   5.412
   17    H    LEU   3           H        LEU   3  -3.291  16.874   3.893
   18    HA   LEU   3           HA       LEU   3  -1.968  14.326   3.354
   19   1HB   LEU   3          2HB       LEU   3  -1.942  14.611   5.812
   20   2HB   LEU   3          1HB       LEU   3  -3.677  14.845   5.799
   21    HG   LEU   3           HG       LEU   3  -3.934  12.521   4.939
   22   1HD1  LEU   3          1HD1      LEU   3  -0.978  12.361   5.493
   23   2HD1  LEU   3          2HD1      LEU   3  -1.744  12.280   3.906
   24   3HD1  LEU   3          3HD1      LEU   3  -2.029  11.002   5.090
   25   1HD2  LEU   3          1HD2      LEU   3  -3.432  11.436   7.075
   26   2HD2  LEU   3          2HD2      LEU   3  -4.174  13.016   7.312
   27   3HD2  LEU   3          3HD2      LEU   3  -2.437  12.815   7.541
   28    H    ASP   4           H        ASP   4  -3.552  12.648   2.774
   29    HA   ASP   4           HA       ASP   4  -6.013  13.873   1.723
   30   1HB   ASP   4          2HB       ASP   4  -4.262  13.102   0.043
   31   2HB   ASP   4          1HB       ASP   4  -4.664  11.456   0.534
   32    HA   PRO   5           HA       PRO   5  -7.550  10.723   4.684
   33   1HB   PRO   5          2HB       PRO   5  -9.865  12.503   4.848
   34   2HB   PRO   5          1HB       PRO   5  -8.775  11.968   6.130
   35   1HG   PRO   5          2HG       PRO   5  -8.799  14.514   5.225
   36   2HG   PRO   5          1HG       PRO   5  -7.321  13.725   5.805
   37   1HD   PRO   5          2HD       PRO   5  -8.251  14.173   2.990
   38   2HD   PRO   5          1HD       PRO   5  -6.626  14.369   3.685
   39    H    GLN   6           H        GLN   6  -8.383  11.637   1.616
   40    HA   GLN   6           HA       GLN   6 -10.913  10.216   1.483
   41   1HB   GLN   6          2HB       GLN   6 -10.521  12.271   0.135
   42   2HB   GLN   6          1HB       GLN   6  -9.241  11.440  -0.729
   43   1HG   GLN   6          2HG       GLN   6 -11.965  10.251  -0.730
   44   2HG   GLN   6          1HG       GLN   6 -11.660  11.672  -1.722
   45   1HE2  GLN   6          1HE2      GLN   6 -11.102   8.291  -1.321
   46   2HE2  GLN   6          2HE2      GLN   6 -10.304   8.032  -2.832
   47    H    LEU   7           H        LEU   7  -7.616   9.914   0.201
   48    HA   LEU   7           HA       LEU   7  -7.979   7.338  -0.922
   49   1HB   LEU   7          2HB       LEU   7  -5.452   8.687   0.039
   50   2HB   LEU   7          1HB       LEU   7  -5.508   7.246  -0.959
   51    HG   LEU   7           HG       LEU   7  -6.525   9.973  -1.770
   52   1HD1  LEU   7          1HD1      LEU   7  -4.086   9.881  -1.603
   53   2HD1  LEU   7          2HD1      LEU   7  -4.610   9.995  -3.282
   54   3HD1  LEU   7          3HD1      LEU   7  -4.069   8.447  -2.634
   55   1HD2  LEU   7          1HD2      LEU   7  -7.785   8.174  -2.825
   56   2HD2  LEU   7          2HD2      LEU   7  -6.283   7.405  -3.335
   57   3HD2  LEU   7          3HD2      LEU   7  -6.738   8.974  -3.997
   58    H    LEU   8           H        LEU   8  -7.268   8.457   2.284
   59    HA   LEU   8           HA       LEU   8  -6.371   5.884   3.227
   60   1HB   LEU   8          2HB       LEU   8  -7.085   8.384   4.763
   61   2HB   LEU   8          1HB       LEU   8  -6.319   6.960   5.438
   62    HG   LEU   8           HG       LEU   8  -5.117   8.783   3.353
   63   1HD1  LEU   8          1HD1      LEU   8  -4.446   8.399   6.270
   64   2HD1  LEU   8          2HD1      LEU   8  -5.252   9.805   5.569
   65   3HD1  LEU   8          3HD1      LEU   8  -3.582   9.436   5.132
   66   1HD2  LEU   8          1HD2      LEU   8  -4.395   6.465   3.083
   67   2HD2  LEU   8          2HD2      LEU   8  -3.936   6.405   4.784
   68   3HD2  LEU   8          3HD2      LEU   8  -3.081   7.481   3.678
   69    H    GLU   9           H        GLU   9  -7.864   4.347   3.220
   70    HA   GLU   9           HA       GLU   9 -10.363   4.851   4.694
   71   1HB   GLU   9          2HB       GLU   9  -9.821   3.083   2.315
   72   2HB   GLU   9          1HB       GLU   9 -11.204   2.813   3.365
   73   1HG   GLU   9          2HG       GLU   9 -10.657   5.402   1.939
   74   2HG   GLU   9          1HG       GLU   9 -11.693   4.123   1.305
   75    H    VAL  10           H        VAL  10 -11.268   2.598   5.476
   76    HA   VAL  10           HA       VAL  10  -9.331   1.494   7.260
   77    HB   VAL  10           HB       VAL  10 -12.097   0.440   6.636
   78   1HG1  VAL  10          1HG1      VAL  10 -10.293   0.006   9.015
   79   2HG1  VAL  10          2HG1      VAL  10 -10.692  -1.186   7.781
   80   3HG1  VAL  10          3HG1      VAL  10 -11.947  -0.586   8.864
   81   1HG2  VAL  10          1HG2      VAL  10 -12.206   2.765   7.348
   82   2HG2  VAL  10          2HG2      VAL  10 -11.220   2.388   8.760
   83   3HG2  VAL  10          3HG2      VAL  10 -12.834   1.696   8.603
   84    H    LEU  11           H        LEU  11  -7.727   0.393   6.312
   85    HA   LEU  11           HA       LEU  11  -8.430  -1.683   4.353
   86   1HB   LEU  11          2HB       LEU  11  -5.804  -0.254   4.768
   87   2HB   LEU  11          1HB       LEU  11  -6.116  -1.481   3.555
   88    HG   LEU  11           HG       LEU  11  -7.524   1.187   3.680
   89   1HD1  LEU  11          1HD1      LEU  11  -5.182   1.509   3.162
   90   2HD1  LEU  11          2HD1      LEU  11  -6.174   1.781   1.728
   91   3HD1  LEU  11          3HD1      LEU  11  -5.272   0.275   1.904
   92   1HD2  LEU  11          1HD2      LEU  11  -8.301   0.609   1.437
   93   2HD2  LEU  11          2HD2      LEU  11  -8.851  -0.567   2.630
   94   3HD2  LEU  11          3HD2      LEU  11  -7.504  -0.959   1.562
   95    H    ALA  12           H        ALA  12  -8.199  -3.725   4.948
   96    HA   ALA  12           HA       ALA  12  -6.348  -4.381   7.133
   97   1HB   ALA  12          1HB       ALA  12  -8.594  -4.197   8.080
   98   2HB   ALA  12          2HB       ALA  12  -8.004  -5.859   8.137
   99   3HB   ALA  12          3HB       ALA  12  -9.184  -5.385   6.913
  100    H    CYS  13           H        CYS  13  -5.642  -6.563   7.173
  101    HA   CYS  13           HA       CYS  13  -5.038  -7.671   4.668
  102   1HB   CYS  13          2HB       CYS  13  -3.636  -8.089   6.601
  103   2HB   CYS  13          1HB       CYS  13  -4.957  -8.904   7.430
  104    HG   CYS  13           HG       CYS  13  -3.215 -10.036   4.715
  105    HA   PRO  14           HA       PRO  14  -8.822  -9.723   3.621
  106   1HB   PRO  14          2HB       PRO  14  -7.733 -11.596   1.912
  107   2HB   PRO  14          1HB       PRO  14  -8.124  -9.934   1.461
  108   1HG   PRO  14          2HG       PRO  14  -5.490 -11.119   2.240
  109   2HG   PRO  14          1HG       PRO  14  -5.859  -9.935   0.972
  110   1HD   PRO  14          2HD       PRO  14  -4.790  -9.190   3.315
  111   2HD   PRO  14          1HD       PRO  14  -5.982  -8.176   2.473
  112    H    LYS  15           H        LYS  15  -6.004 -11.542   4.705
  113    HA   LYS  15           HA       LYS  15  -7.639 -13.879   5.305
  114   1HB   LYS  15          2HB       LYS  15  -5.407 -14.207   4.294
  115   2HB   LYS  15          1HB       LYS  15  -4.670 -13.441   5.695
  116   1HG   LYS  15          2HG       LYS  15  -5.670 -15.233   7.115
  117   2HG   LYS  15          1HG       LYS  15  -6.191 -16.039   5.636
  118   1HD   LYS  15          2HD       LYS  15  -3.341 -15.389   6.386
  119   2HD   LYS  15          1HD       LYS  15  -4.101 -16.974   6.513
  120   1HE   LYS  15          2HE       LYS  15  -4.519 -16.857   4.035
  121   2HE   LYS  15          1HE       LYS  15  -3.514 -15.406   4.014
  122   1HZ   LYS  15          1HZ       LYS  15  -2.244 -17.390   3.438
  123   2HZ   LYS  15          2HZ       LYS  15  -2.635 -18.096   4.925
  124   3HZ   LYS  15          3HZ       LYS  15  -1.671 -16.698   4.878
  125    H    ASP  16           H        ASP  16  -5.492 -11.628   7.032
  126    HA   ASP  16           HA       ASP  16  -6.156 -12.850   9.568
  127   1HB   ASP  16          2HB       ASP  16  -3.857 -12.212   9.137
  128   2HB   ASP  16          1HB       ASP  16  -4.339 -10.545   8.850
  129    H    LYS  17           H        LYS  17  -7.173 -10.119   7.744
  130    HA   LYS  17           HA       LYS  17  -8.634  -8.436   8.094
  131   1HB   LYS  17          2HB       LYS  17  -9.451 -10.326  10.255
  132   2HB   LYS  17          1HB       LYS  17 -10.082  -8.687  10.300
  133   1HG   LYS  17          2HG       LYS  17 -11.674 -10.036   9.185
  134   2HG   LYS  17          1HG       LYS  17 -10.900  -9.020   7.971
  135   1HD   LYS  17          2HD       LYS  17  -9.508 -10.867   7.264
  136   2HD   LYS  17          1HD       LYS  17 -10.175 -11.894   8.538
  137   1HE   LYS  17          2HE       LYS  17 -12.427 -11.573   7.501
  138   2HE   LYS  17          1HE       LYS  17 -11.632 -10.731   6.170
  139   1HZ   LYS  17          1HZ       LYS  17 -10.432 -12.698   5.615
  140   2HZ   LYS  17          2HZ       LYS  17 -12.076 -13.109   5.731
  141   3HZ   LYS  17          3HZ       LYS  17 -11.009 -13.514   6.984
  142    H    GLY  18           H        GLY  18  -5.922  -8.711   9.591
  143   1HA   GLY  18          2HA       GLY  18  -6.245  -6.819  11.741
  144   2HA   GLY  18          1HA       GLY  18  -4.728  -7.477  11.142
  145    HA   PRO  19           HA       PRO  19  -5.899  -3.053   9.496
  146   1HB   PRO  19          2HB       PRO  19  -4.190  -2.064  11.697
  147   2HB   PRO  19          1HB       PRO  19  -5.735  -1.443  11.110
  148   1HG   PRO  19          2HG       PRO  19  -5.562  -2.738  13.444
  149   2HG   PRO  19          1HG       PRO  19  -6.968  -2.933  12.378
  150   1HD   PRO  19          2HD       PRO  19  -4.639  -4.767  12.796
  151   2HD   PRO  19          1HD       PRO  19  -6.362  -5.158  12.603
  152    H    LEU  20           H        LEU  20  -4.631  -2.624   7.839
  153    HA   LEU  20           HA       LEU  20  -1.869  -3.506   7.811
  154   1HB   LEU  20          2HB       LEU  20  -3.523  -2.109   5.700
  155   2HB   LEU  20          1HB       LEU  20  -1.931  -2.799   5.450
  156    HG   LEU  20           HG       LEU  20  -4.388  -4.382   6.207
  157   1HD1  LEU  20          1HD1      LEU  20  -4.597  -3.458   3.963
  158   2HD1  LEU  20          2HD1      LEU  20  -4.336  -5.201   3.906
  159   3HD1  LEU  20          3HD1      LEU  20  -3.008  -4.099   3.541
  160   1HD2  LEU  20          1HD2      LEU  20  -3.021  -6.322   5.671
  161   2HD2  LEU  20          2HD2      LEU  20  -2.298  -5.382   6.975
  162   3HD2  LEU  20          3HD2      LEU  20  -1.641  -5.273   5.342
  163    H    ARG  21           H        ARG  21  -0.074  -2.195   7.792
  164    HA   ARG  21           HA       ARG  21  -0.492   0.569   8.567
  165   1HB   ARG  21          2HB       ARG  21   1.250  -0.844   9.664
  166   2HB   ARG  21          1HB       ARG  21   2.113  -0.912   8.132
  167   1HG   ARG  21          2HG       ARG  21   2.410   1.503   8.177
  168   2HG   ARG  21          1HG       ARG  21   1.507   1.595   9.688
  169   1HD   ARG  21          2HD       ARG  21   4.109   0.128   9.275
  170   2HD   ARG  21          1HD       ARG  21   3.930   1.698  10.054
  171    HE   ARG  21           HE       ARG  21   3.208  -0.907  11.158
  172   1HH1  ARG  21          1HH1      ARG  21   3.095   2.586  11.510
  173   2HH1  ARG  21          2HH1      ARG  21   2.903   2.515  13.240
  174   1HH2  ARG  21          1HH2      ARG  21   2.948  -0.989  13.417
  175   2HH2  ARG  21          2HH2      ARG  21   2.795   0.505  14.317
  176    H    TYR  22           H        TYR  22  -0.433   2.239   7.214
  177    HA   TYR  22           HA       TYR  22  -0.150   1.650   4.388
  178   1HB   TYR  22          2HB       TYR  22  -2.053   3.000   5.421
  179   2HB   TYR  22          1HB       TYR  22  -0.889   4.301   5.642
  180    HD1  TYR  22           1HD      TYR  22   0.342   5.123   3.492
  181    HD2  TYR  22           2HD      TYR  22  -3.247   2.837   3.438
  182    HE1  TYR  22           1HE      TYR  22  -0.121   5.911   1.210
  183    HE2  TYR  22           2HE      TYR  22  -3.711   3.615   1.154
  184    HH   TYR  22           HH       TYR  22  -1.415   5.163  -0.775
  185    H    LEU  23           H        LEU  23   1.850   1.697   3.591
  186    HA   LEU  23           HA       LEU  23   3.743   3.746   4.439
  187   1HB   LEU  23          2HB       LEU  23   3.924   1.361   2.614
  188   2HB   LEU  23          1HB       LEU  23   5.148   2.610   2.568
  189    HG   LEU  23           HG       LEU  23   5.910   0.775   3.930
  190   1HD1  LEU  23          1HD1      LEU  23   6.394   1.966   6.018
  191   2HD1  LEU  23          2HD1      LEU  23   5.185   3.178   5.594
  192   3HD1  LEU  23          3HD1      LEU  23   6.625   2.981   4.595
  193   1HD2  LEU  23          1HD2      LEU  23   4.776   0.149   6.013
  194   2HD2  LEU  23          2HD2      LEU  23   3.780  -0.173   4.595
  195   3HD2  LEU  23          3HD2      LEU  23   3.444   1.232   5.604
  196    H    GLU  24           H        GLU  24   3.241   5.685   3.677
  197    HA   GLU  24           HA       GLU  24   1.638   6.103   1.384
  198   1HB   GLU  24          2HB       GLU  24   3.364   8.124   2.822
  199   2HB   GLU  24          1HB       GLU  24   1.951   8.458   1.828
  200   1HG   GLU  24          2HG       GLU  24   0.508   7.396   3.434
  201   2HG   GLU  24          1HG       GLU  24   1.894   6.889   4.396
  202    H    SER  25           H        SER  25   5.087   6.393   1.988
  203    HA   SER  25           HA       SER  25   5.829   7.729  -0.341
  204   1HB   SER  25          2HB       SER  25   7.519   5.725   1.156
  205   2HB   SER  25          1HB       SER  25   8.067   7.130   0.237
  206    HG   SER  25           HG       SER  25   7.040   8.460   1.787
  207    H    GLU  26           H        GLU  26   5.207   4.317   0.196
  208    HA   GLU  26           HA       GLU  26   6.218   3.750  -2.510
  209   1HB   GLU  26          2HB       GLU  26   6.034   1.906  -0.129
  210   2HB   GLU  26          1HB       GLU  26   6.560   1.426  -1.736
  211   1HG   GLU  26          2HG       GLU  26   7.919   3.408   0.075
  212   2HG   GLU  26          1HG       GLU  26   8.467   1.775  -0.303
  213    H    GLN  27           H        GLN  27   3.403   4.167  -0.894
  214    HA   GLN  27           HA       GLN  27   1.226   3.581  -1.230
  215   1HB   GLN  27          2HB       GLN  27   2.311   2.560  -3.865
  216   2HB   GLN  27          1HB       GLN  27   0.604   2.710  -3.483
  217   1HG   GLN  27          2HG       GLN  27   2.563   4.994  -3.576
  218   2HG   GLN  27          1HG       GLN  27   1.461   4.545  -4.876
  219   1HE2  GLN  27          1HE2      GLN  27   1.795   6.058  -1.791
  220   2HE2  GLN  27          2HE2      GLN  27   0.195   6.714  -1.711
  221    H    LEU  28           H        LEU  28   2.699   1.833   0.331
  222    HA   LEU  28           HA       LEU  28   1.782  -0.828  -0.544
  223   1HB   LEU  28          2HB       LEU  28   4.206  -0.107   1.098
  224   2HB   LEU  28          1HB       LEU  28   3.649  -1.746   0.828
  225    HG   LEU  28           HG       LEU  28   4.631   0.152  -1.309
  226   1HD1  LEU  28          1HD1      LEU  28   6.413  -0.658   0.157
  227   2HD1  LEU  28          2HD1      LEU  28   6.536  -1.373  -1.452
  228   3HD1  LEU  28          3HD1      LEU  28   5.883  -2.317  -0.112
  229   1HD2  LEU  28          1HD2      LEU  28   3.766  -2.736  -1.474
  230   2HD2  LEU  28          2HD2      LEU  28   4.497  -1.807  -2.781
  231   3HD2  LEU  28          3HD2      LEU  28   2.911  -1.355  -2.157
  232    H    LEU  29           H        LEU  29   0.768  -2.131   0.882
  233    HA   LEU  29           HA       LEU  29   0.165  -1.034   3.557
  234   1HB   LEU  29          2HB       LEU  29  -1.336  -3.045   1.870
  235   2HB   LEU  29          1HB       LEU  29  -1.781  -2.586   3.501
  236    HG   LEU  29           HG       LEU  29  -1.706  -0.680   1.163
  237   1HD1  LEU  29          1HD1      LEU  29  -3.437  -2.382   0.864
  238   2HD1  LEU  29          2HD1      LEU  29  -4.144  -0.810   1.227
  239   3HD1  LEU  29          3HD1      LEU  29  -4.054  -2.044   2.480
  240   1HD2  LEU  29          1HD2      LEU  29  -2.924   0.806   2.669
  241   2HD2  LEU  29          2HD2      LEU  29  -1.348   0.381   3.337
  242   3HD2  LEU  29          3HD2      LEU  29  -2.807  -0.393   3.958
  243    H    VAL  30           H        VAL  30   1.421  -1.957   5.071
  244    HA   VAL  30           HA       VAL  30   2.291  -4.734   4.600
  245    HB   VAL  30           HB       VAL  30   3.641  -2.610   6.282
  246   1HG1  VAL  30          1HG1      VAL  30   4.509  -5.416   5.585
  247   2HG1  VAL  30          2HG1      VAL  30   4.030  -4.835   7.180
  248   3HG1  VAL  30          3HG1      VAL  30   5.500  -4.219   6.422
  249   1HG2  VAL  30          1HG2      VAL  30   3.803  -2.156   3.886
  250   2HG2  VAL  30          2HG2      VAL  30   4.439  -3.780   3.619
  251   3HG2  VAL  30          3HG2      VAL  30   5.369  -2.611   4.559
  252    H    ASN  31           H        ASN  31   1.542  -6.242   5.913
  253    HA   ASN  31           HA       ASN  31   0.306  -5.450   8.451
  254   1HB   ASN  31          2HB       ASN  31  -1.058  -6.886   7.012
  255   2HB   ASN  31          1HB       ASN  31   0.225  -8.089   6.957
  256   1HD2  ASN  31          1HD2      ASN  31  -1.219  -9.636   7.774
  257   2HD2  ASN  31          2HD2      ASN  31  -1.657  -9.671   9.445
  258    H    GLU  32           H        GLU  32   1.495  -5.555  10.220
  259    HA   GLU  32           HA       GLU  32   4.124  -6.668  10.161
  260   1HB   GLU  32          2HB       GLU  32   2.504  -5.519  12.441
  261   2HB   GLU  32          1HB       GLU  32   4.217  -5.918  12.528
  262   1HG   GLU  32          2HG       GLU  32   4.717  -4.272  10.827
  263   2HG   GLU  32          1HG       GLU  32   3.000  -3.924  10.634
  264    H    ARG  33           H        ARG  33   1.077  -7.962  10.898
  265    HA   ARG  33           HA       ARG  33   1.938  -9.902  12.823
  266   1HB   ARG  33          2HB       ARG  33  -0.548  -9.811  11.111
  267   2HB   ARG  33          1HB       ARG  33  -0.277 -10.921  12.447
  268   1HG   ARG  33          2HG       ARG  33  -0.206  -9.083  14.008
  269   2HG   ARG  33          1HG       ARG  33  -0.373  -7.921  12.688
  270   1HD   ARG  33          2HD       ARG  33  -2.557  -8.855  12.141
  271   2HD   ARG  33          1HD       ARG  33  -2.383 -10.037  13.436
  272    HE   ARG  33           HE       ARG  33  -2.082  -7.552  14.614
  273   1HH1  ARG  33          1HH1      ARG  33  -4.556  -9.210  12.771
  274   2HH1  ARG  33          2HH1      ARG  33  -5.869  -8.445  13.623
  275   1HH2  ARG  33          1HH2      ARG  33  -3.792  -6.524  15.691
  276   2HH2  ARG  33          2HH2      ARG  33  -5.440  -6.886  15.260
  277    H    LEU  34           H        LEU  34   1.855  -9.739   9.349
  278    HA   LEU  34           HA       LEU  34   2.576 -12.595   9.224
  279   1HB   LEU  34          2HB       LEU  34   1.062 -10.990   7.161
  280   2HB   LEU  34          1HB       LEU  34   1.551 -12.664   6.981
  281    HG   LEU  34           HG       LEU  34  -0.420 -11.601   9.002
  282   1HD1  LEU  34          1HD1      LEU  34  -0.808 -13.286   6.533
  283   2HD1  LEU  34          2HD1      LEU  34  -1.305 -11.607   6.741
  284   3HD1  LEU  34          3HD1      LEU  34  -2.060 -12.876   7.705
  285   1HD2  LEU  34          1HD2      LEU  34  -0.815 -13.920   9.586
  286   2HD2  LEU  34          2HD2      LEU  34   0.878 -13.509   9.855
  287   3HD2  LEU  34          3HD2      LEU  34   0.411 -14.443   8.434
  288    H    ASN  35           H        ASN  35   3.690  -9.502   8.762
  289    HA   ASN  35           HA       ASN  35   5.530  -8.577   7.801
  290   1HB   ASN  35          2HB       ASN  35   6.465 -10.821   8.826
  291   2HB   ASN  35          1HB       ASN  35   6.632 -11.285   7.134
  292   1HD2  ASN  35          1HD2      ASN  35   8.009 -10.007   5.783
  293   2HD2  ASN  35          2HD2      ASN  35   9.292  -9.069   6.468
  294    H    LEU  36           H        LEU  36   3.229  -9.098   6.201
  295    HA   LEU  36           HA       LEU  36   4.442  -9.556   3.553
  296   1HB   LEU  36          2HB       LEU  36   1.612 -10.120   4.456
  297   2HB   LEU  36          1HB       LEU  36   2.172 -10.253   2.801
  298    HG   LEU  36           HG       LEU  36   3.168 -11.917   5.117
  299   1HD1  LEU  36          1HD1      LEU  36   1.376 -12.643   2.803
  300   2HD1  LEU  36          2HD1      LEU  36   0.861 -12.439   4.478
  301   3HD1  LEU  36          3HD1      LEU  36   1.966 -13.744   4.046
  302   1HD2  LEU  36          1HD2      LEU  36   3.739 -12.132   2.164
  303   2HD2  LEU  36          2HD2      LEU  36   4.330 -13.214   3.425
  304   3HD2  LEU  36          3HD2      LEU  36   4.864 -11.535   3.379
  305    H    ALA  37           H        ALA  37   3.794  -8.201   1.849
  306    HA   ALA  37           HA       ALA  37   2.450  -5.733   2.731
  307   1HB   ALA  37          1HB       ALA  37   4.790  -5.965   0.843
  308   2HB   ALA  37          2HB       ALA  37   4.849  -5.366   2.502
  309   3HB   ALA  37          3HB       ALA  37   3.952  -4.477   1.270
  310    H    TYR  38           H        TYR  38   0.886  -4.965   1.475
  311    HA   TYR  38           HA       TYR  38   0.380  -6.269  -1.119
  312   1HB   TYR  38          2HB       TYR  38  -1.548  -4.698   0.611
  313   2HB   TYR  38          1HB       TYR  38  -1.947  -5.619  -0.835
  314    HD1  TYR  38           1HD      TYR  38  -1.315  -5.755   2.736
  315    HD2  TYR  38           2HD      TYR  38  -1.907  -8.103  -0.761
  316    HE1  TYR  38           1HE      TYR  38  -1.774  -7.718   4.140
  317    HE2  TYR  38           2HE      TYR  38  -2.361 -10.076   0.635
  318    HH   TYR  38           HH       TYR  38  -1.852 -10.870   2.902
  319    H    ARG  39           H        ARG  39   0.114  -4.973  -2.930
  320    HA   ARG  39           HA       ARG  39   1.139  -2.252  -2.612
  321   1HB   ARG  39          2HB       ARG  39   1.510  -2.367  -5.075
  322   2HB   ARG  39          1HB       ARG  39   2.391  -3.587  -4.168
  323   1HG   ARG  39          2HG       ARG  39   0.740  -5.264  -4.784
  324   2HG   ARG  39          1HG       ARG  39  -0.194  -4.044  -5.648
  325   1HD   ARG  39          2HD       ARG  39   1.139  -5.366  -7.194
  326   2HD   ARG  39          1HD       ARG  39   1.680  -3.689  -7.175
  327    HE   ARG  39           HE       ARG  39   3.632  -4.356  -5.998
  328   1HH1  ARG  39          1HH1      ARG  39   1.596  -7.053  -6.967
  329   2HH1  ARG  39          2HH1      ARG  39   2.881  -8.220  -6.865
  330   1HH2  ARG  39          1HH2      ARG  39   5.323  -5.899  -5.910
  331   2HH2  ARG  39          2HH2      ARG  39   4.984  -7.564  -6.275
  332    H    ILE  40           H        ILE  40   0.065  -0.458  -3.339
  333    HA   ILE  40           HA       ILE  40  -2.719  -0.870  -4.212
  334    HB   ILE  40           HB       ILE  40  -1.474   1.605  -2.996
  335   1HG1  ILE  40          2HG1      ILE  40  -3.373  -0.412  -1.773
  336   2HG1  ILE  40          1HG1      ILE  40  -1.660  -0.267  -1.393
  337   1HG2  ILE  40          1HG2      ILE  40  -3.779   2.418  -2.830
  338   2HG2  ILE  40          2HG2      ILE  40  -4.350   0.971  -3.661
  339   3HG2  ILE  40          3HG2      ILE  40  -3.314   2.121  -4.505
  340   1HD1  ILE  40          1HD1      ILE  40  -3.001   0.780   0.319
  341   2HD1  ILE  40          2HD1      ILE  40  -3.778   1.809  -0.883
  342   3HD1  ILE  40          3HD1      ILE  40  -2.056   1.996  -0.540
  343    H    ASP  41           H        ASP  41  -3.237  -0.327  -6.251
  344    HA   ASP  41           HA       ASP  41  -1.422   1.529  -7.660
  345   1HB   ASP  41          2HB       ASP  41  -1.347  -0.832  -8.500
  346   2HB   ASP  41          1HB       ASP  41  -3.047  -0.683  -8.930
  347    H    ASP  42           H        ASP  42  -2.565   3.337  -7.178
  348    HA   ASP  42           HA       ASP  42  -4.172   4.921  -7.238
  349   1HB   ASP  42          2HB       ASP  42  -3.372   4.947  -9.572
  350   2HB   ASP  42          1HB       ASP  42  -4.648   3.810 -10.007
  351    H    GLY  43           H        GLY  43  -5.353   3.673  -5.607
  352   1HA   GLY  43          2HA       GLY  43  -7.548   3.600  -4.808
  353   2HA   GLY  43          1HA       GLY  43  -8.127   3.630  -6.465
  354    H    ILE  44           H        ILE  44  -6.020   1.309  -6.803
  355    HA   ILE  44           HA       ILE  44  -7.913  -0.774  -5.948
  356    HB   ILE  44           HB       ILE  44  -5.791  -0.911  -8.102
  357   1HG1  ILE  44          2HG1      ILE  44  -8.813  -0.790  -8.299
  358   2HG1  ILE  44          1HG1      ILE  44  -7.702   0.508  -8.728
  359   1HG2  ILE  44          1HG2      ILE  44  -6.830  -3.081  -8.672
  360   2HG2  ILE  44          2HG2      ILE  44  -7.858  -2.937  -7.244
  361   3HG2  ILE  44          3HG2      ILE  44  -6.109  -3.076  -7.061
  362   1HD1  ILE  44          1HD1      ILE  44  -6.763  -0.898 -10.500
  363   2HD1  ILE  44          2HD1      ILE  44  -8.494  -0.635 -10.707
  364   3HD1  ILE  44          3HD1      ILE  44  -7.904  -2.175 -10.079
  365    HA   PRO  45           HA       PRO  45  -4.489  -1.880  -3.206
  366   1HB   PRO  45          2HB       PRO  45  -6.428  -3.137  -1.514
  367   2HB   PRO  45          1HB       PRO  45  -5.552  -1.634  -1.224
  368   1HG   PRO  45          2HG       PRO  45  -8.275  -1.805  -1.659
  369   2HG   PRO  45          1HG       PRO  45  -7.300  -0.349  -1.913
  370   1HD   PRO  45          2HD       PRO  45  -8.284  -2.343  -3.909
  371   2HD   PRO  45          1HD       PRO  45  -8.150  -0.575  -4.048
  372    H    VAL  46           H        VAL  46  -3.407  -3.560  -4.062
  373    HA   VAL  46           HA       VAL  46  -4.736  -5.935  -4.977
  374    HB   VAL  46           HB       VAL  46  -1.774  -5.429  -4.595
  375   1HG1  VAL  46          1HG1      VAL  46  -1.462  -7.255  -6.197
  376   2HG1  VAL  46          2HG1      VAL  46  -3.204  -7.530  -6.220
  377   3HG1  VAL  46          3HG1      VAL  46  -2.289  -7.805  -4.737
  378   1HG2  VAL  46          1HG2      VAL  46  -3.522  -5.088  -7.026
  379   2HG2  VAL  46          2HG2      VAL  46  -1.763  -4.964  -7.016
  380   3HG2  VAL  46          3HG2      VAL  46  -2.734  -3.803  -6.108
  381    H    LEU  47           H        LEU  47  -5.795  -6.725  -3.165
  382    HA   LEU  47           HA       LEU  47  -4.176  -7.519  -0.869
  383   1HB   LEU  47          2HB       LEU  47  -7.165  -7.587  -1.295
  384   2HB   LEU  47          1HB       LEU  47  -6.347  -8.016   0.196
  385    HG   LEU  47           HG       LEU  47  -6.336  -5.273  -1.067
  386   1HD1  LEU  47          1HD1      LEU  47  -7.789  -6.343   1.342
  387   2HD1  LEU  47          2HD1      LEU  47  -8.520  -5.848  -0.183
  388   3HD1  LEU  47          3HD1      LEU  47  -7.737  -4.651   0.852
  389   1HD2  LEU  47          1HD2      LEU  47  -5.284  -4.564   1.020
  390   2HD2  LEU  47          2HD2      LEU  47  -4.287  -5.757   0.188
  391   3HD2  LEU  47          3HD2      LEU  47  -5.256  -6.234   1.582
  392    H    LEU  48           H        LEU  48  -3.675  -8.852  -3.232
  393    HA   LEU  48           HA       LEU  48  -4.998 -11.424  -3.118
  394   1HB   LEU  48          2HB       LEU  48  -2.823 -10.263  -4.839
  395   2HB   LEU  48          1HB       LEU  48  -3.171 -11.980  -4.861
  396    HG   LEU  48           HG       LEU  48  -4.276 -10.938  -6.717
  397   1HD1  LEU  48          1HD1      LEU  48  -5.463 -12.755  -5.648
  398   2HD1  LEU  48          2HD1      LEU  48  -6.598 -11.564  -6.280
  399   3HD1  LEU  48          3HD1      LEU  48  -6.255 -11.625  -4.551
  400   1HD2  LEU  48          1HD2      LEU  48  -5.956  -9.199  -6.456
  401   2HD2  LEU  48          2HD2      LEU  48  -4.387  -8.655  -5.863
  402   3HD2  LEU  48          3HD2      LEU  48  -5.642  -9.137  -4.721
  403    H    ILE  49           H        ILE  49  -4.230 -13.211  -2.126
  404    HA   ILE  49           HA       ILE  49  -2.206 -12.745  -0.131
  405    HB   ILE  49           HB       ILE  49  -3.735 -15.286  -0.716
  406   1HG1  ILE  49          2HG1      ILE  49  -4.342 -13.066   1.248
  407   2HG1  ILE  49          1HG1      ILE  49  -5.216 -13.352  -0.252
  408   1HG2  ILE  49          1HG2      ILE  49  -2.263 -14.377   1.754
  409   2HG2  ILE  49          2HG2      ILE  49  -1.739 -15.642   0.643
  410   3HG2  ILE  49          3HG2      ILE  49  -3.200 -15.863   1.605
  411   1HD1  ILE  49          1HD1      ILE  49  -6.454 -14.208   1.638
  412   2HD1  ILE  49          2HD1      ILE  49  -5.077 -15.204   2.115
  413   3HD1  ILE  49          3HD1      ILE  49  -5.926 -15.537   0.606
  414    H    ASP  50           H        ASP  50  -2.499 -14.590  -3.104
  415    HA   ASP  50           HA       ASP  50   0.006 -15.964  -2.723
  416   1HB   ASP  50          2HB       ASP  50  -1.766 -17.059  -3.983
  417   2HB   ASP  50          1HB       ASP  50  -1.784 -15.747  -5.156
  418    H    GLU  51           H        GLU  51  -1.074 -13.029  -4.197
  419    HA   GLU  51           HA       GLU  51   1.365 -12.667  -5.718
  420   1HB   GLU  51          2HB       GLU  51  -0.911 -11.931  -6.526
  421   2HB   GLU  51          1HB       GLU  51  -0.867 -10.681  -5.293
  422   1HG   GLU  51          2HG       GLU  51   1.072  -9.683  -6.312
  423   2HG   GLU  51          1HG       GLU  51   1.152 -10.983  -7.502
  424    H    ALA  52           H        ALA  52   0.180 -11.935  -2.599
  425    HA   ALA  52           HA       ALA  52   1.544  -9.567  -1.989
  426   1HB   ALA  52          1HB       ALA  52   0.867 -11.857  -0.148
  427   2HB   ALA  52          2HB       ALA  52  -0.194 -10.513  -0.558
  428   3HB   ALA  52          3HB       ALA  52   1.286 -10.218   0.351
  429    H    THR  53           H        THR  53   3.537  -9.160  -1.050
  430    HA   THR  53           HA       THR  53   5.482 -11.369  -1.176
  431    HB   THR  53           HB       THR  53   7.166  -9.550  -1.757
  432    HG1  THR  53           1HG      THR  53   5.385  -7.895  -1.237
  433   1HG2  THR  53          1HG2      THR  53   6.355 -11.183  -3.394
  434   2HG2  THR  53          2HG2      THR  53   6.635  -9.610  -4.141
  435   3HG2  THR  53          3HG2      THR  53   4.991 -10.131  -3.766
  436    H    GLU  54           H        GLU  54   6.983 -11.462   0.502
  437    HA   GLU  54           HA       GLU  54   6.313 -10.024   2.882
  438   1HB   GLU  54          2HB       GLU  54   8.319 -11.214   3.839
  439   2HB   GLU  54          1HB       GLU  54   7.064 -12.256   3.190
  440   1HG   GLU  54          2HG       GLU  54   8.426 -12.423   1.092
  441   2HG   GLU  54          1HG       GLU  54   9.719 -11.588   1.950
  442    H    TRP  55           H        TRP  55   7.072  -8.154   3.565
  443    HA   TRP  55           HA       TRP  55   9.280  -6.937   2.050
  444   1HB   TRP  55          2HB       TRP  55   7.220  -5.753   1.645
  445   2HB   TRP  55          1HB       TRP  55   6.857  -5.689   3.365
  446    HD1  TRP  55           HD       TRP  55   7.778  -3.683   4.704
  447    HE1  TRP  55           1HE      TRP  55   9.171  -1.603   4.116
  448    HE3  TRP  55           3HE      TRP  55   9.211  -4.988  -0.022
  449    HZ2  TRP  55           2HZ      TRP  55  10.669  -0.641   1.930
  450    HZ3  TRP  55           3HZ      TRP  55  10.622  -3.428  -1.296
  451    HH2  TRP  55           HH       TRP  55  11.335  -1.300  -0.337
  452    H    THR  56           H        THR  56  11.058  -6.545   3.118
  453    HA   THR  56           HA       THR  56  12.590  -6.364   4.766
  454    HB   THR  56           HB       THR  56  10.354  -5.032   6.284
  455    HG1  THR  56           1HG      THR  56  10.660  -3.966   4.334
  456   1HG2  THR  56          1HG2      THR  56  13.354  -4.799   6.562
  457   2HG2  THR  56          2HG2      THR  56  12.267  -5.590   7.705
  458   3HG2  THR  56          3HG2      THR  56  12.163  -3.847   7.453
  459    HA   PRO  57           HA       PRO  57  11.177 -10.173   6.904
  460   1HB   PRO  57          2HB       PRO  57  14.023 -10.863   6.627
  461   2HB   PRO  57          1HB       PRO  57  12.595 -11.766   6.113
  462   1HG   PRO  57          2HG       PRO  57  14.223 -10.565   4.344
  463   2HG   PRO  57          1HG       PRO  57  12.472 -10.677   4.084
  464   1HD   PRO  57          2HD       PRO  57  14.102  -8.352   5.036
  465   2HD   PRO  57          1HD       PRO  57  12.737  -8.383   3.901
  466    H    ASN  58           H        ASN  58  10.883  -8.908   8.796
  467    HA   ASN  58           HA       ASN  58  13.052  -8.072  10.424
  468   1HB   ASN  58          2HB       ASN  58  10.752  -7.094  10.544
  469   2HB   ASN  58          1HB       ASN  58  10.195  -8.605  11.253
  470   1HD2  ASN  58          1HD2      ASN  58  13.193  -6.819  11.865
  471   2HD2  ASN  58          2HD2      ASN  58  12.870  -6.540  13.545
  472    H    ASN  59           H        ASN  59  11.070 -10.857  10.229
  473    HA   ASN  59           HA       ASN  59  12.629 -12.183  12.344
  474   1HB   ASN  59          2HB       ASN  59  10.720 -13.616  12.762
  475   2HB   ASN  59          1HB       ASN  59  10.191 -11.940  12.826
  476   1HD2  ASN  59          1HD2      ASN  59   8.685 -14.412  12.331
  477   2HD2  ASN  59          2HD2      ASN  59   7.892 -14.175  10.808
  478    H    LEU  60           H        LEU  60  13.464 -14.215  11.955
  479    HA   LEU  60           HA       LEU  60  13.448 -15.086   9.160
  480   1HB   LEU  60          2HB       LEU  60  15.440 -16.268   9.556
  481   2HB   LEU  60          1HB       LEU  60  15.646 -14.736  10.373
  482    HG   LEU  60           HG       LEU  60  14.847 -17.277  11.796
  483   1HD1  LEU  60          1HD1      LEU  60  17.028 -17.583  10.770
  484   2HD1  LEU  60          2HD1      LEU  60  17.181 -17.416  12.520
  485   3HD1  LEU  60          3HD1      LEU  60  17.585 -16.060  11.465
  486   1HD2  LEU  60          1HD2      LEU  60  15.810 -14.585  12.750
  487   2HD2  LEU  60          2HD2      LEU  60  15.759 -16.024  13.768
  488   3HD2  LEU  60          3HD2      LEU  60  14.265 -15.369  13.099
  489    H    GLU  61           H        GLU  61  13.582 -17.578   8.961
  490    HA   GLU  61           HA       GLU  61  12.517 -19.559   9.084
  491   1HB   GLU  61          2HB       GLU  61  12.338 -18.799  11.996
  492   2HB   GLU  61          1HB       GLU  61  11.770 -20.342  11.374
  493   1HG   GLU  61          2HG       GLU  61  14.586 -19.299  11.197
  494   2HG   GLU  61          1HG       GLU  61  13.998 -20.535  12.311
  Start of MODEL    8
    1   1H    MET   1          1HT       MET   1  -8.661  19.651   6.035
    2   2H    MET   1          2HT       MET   1  -7.126  19.654   6.760
    3   3H    MET   1          3HT       MET   1  -7.879  18.187   6.369
    4    HA   MET   1           HA       MET   1  -7.741  18.650   4.040
    5   1HB   MET   1          2HB       MET   1  -6.652  20.621   3.182
    6   2HB   MET   1          1HB       MET   1  -7.940  21.118   4.267
    7   1HG   MET   1          2HG       MET   1  -5.024  20.996   5.014
    8   2HG   MET   1          1HG       MET   1  -5.859  22.449   4.470
    9   1HE   MET   1          1HE       MET   1  -5.340  23.211   8.262
   10   2HE   MET   1          2HE       MET   1  -5.171  23.821   6.615
   11   3HE   MET   1          3HE       MET   1  -4.228  22.424   7.137
   12    H    SER   2           H        SER   2  -6.251  17.416   6.329
   13    HA   SER   2           HA       SER   2  -3.474  17.563   5.440
   14   1HB   SER   2          2HB       SER   2  -4.622  15.869   7.670
   15   2HB   SER   2          1HB       SER   2  -2.936  16.336   7.434
   16    HG   SER   2           HG       SER   2  -3.498  18.475   7.892
   17    H    LEU   3           H        LEU   3  -2.620  16.125   4.063
   18    HA   LEU   3           HA       LEU   3  -2.405  14.351   2.659
   19   1HB   LEU   3          2HB       LEU   3  -3.754  13.008   4.989
   20   2HB   LEU   3          1HB       LEU   3  -3.311  12.117   3.550
   21    HG   LEU   3           HG       LEU   3  -1.609  11.743   5.165
   22   1HD1  LEU   3          1HD1      LEU   3  -0.655  13.756   3.140
   23   2HD1  LEU   3          2HD1      LEU   3  -0.785  12.010   2.917
   24   3HD1  LEU   3          3HD1      LEU   3   0.382  12.669   4.064
   25   1HD2  LEU   3          1HD2      LEU   3  -1.377  14.735   5.446
   26   2HD2  LEU   3          2HD2      LEU   3  -0.331  13.545   6.219
   27   3HD2  LEU   3          3HD2      LEU   3  -2.040  13.624   6.644
   28    H    ASP   4           H        ASP   4  -3.974  12.288   1.914
   29    HA   ASP   4           HA       ASP   4  -6.534  13.533   1.164
   30   1HB   ASP   4          2HB       ASP   4  -5.026  13.092  -0.776
   31   2HB   ASP   4          1HB       ASP   4  -5.084  11.375  -0.383
   32    HA   PRO   5           HA       PRO   5  -7.585  10.191   4.100
   33   1HB   PRO   5          2HB       PRO   5 -10.078  11.785   4.200
   34   2HB   PRO   5          1HB       PRO   5  -9.054  11.214   5.522
   35   1HG   PRO   5          2HG       PRO   5  -9.072  13.786   4.838
   36   2HG   PRO   5          1HG       PRO   5  -7.562  12.979   5.302
   37   1HD   PRO   5          2HD       PRO   5  -8.584  13.650   2.564
   38   2HD   PRO   5          1HD       PRO   5  -6.945  13.826   3.228
   39    H    GLN   6           H        GLN   6  -8.890  11.205   1.136
   40    HA   GLN   6           HA       GLN   6 -11.156   9.469   1.042
   41   1HB   GLN   6          2HB       GLN   6 -10.946  11.547  -0.302
   42   2HB   GLN   6          1HB       GLN   6  -9.651  10.793  -1.221
   43   1HG   GLN   6          2HG       GLN   6 -11.199   9.098  -2.029
   44   2HG   GLN   6          1HG       GLN   6 -12.500   9.833  -1.092
   45   1HE2  GLN   6          1HE2      GLN   6 -10.397  10.174  -3.835
   46   2HE2  GLN   6          2HE2      GLN   6 -11.308  11.420  -4.620
   47    H    LEU   7           H        LEU   7  -7.758   9.186   0.292
   48    HA   LEU   7           HA       LEU   7  -8.027   6.676  -1.098
   49   1HB   LEU   7          2HB       LEU   7  -5.658   8.148   0.046
   50   2HB   LEU   7          1HB       LEU   7  -5.516   6.583  -0.730
   51    HG   LEU   7           HG       LEU   7  -6.585   9.062  -2.082
   52   1HD1  LEU   7          1HD1      LEU   7  -4.220   9.303  -1.506
   53   2HD1  LEU   7          2HD1      LEU   7  -4.452   9.140  -3.248
   54   3HD1  LEU   7          3HD1      LEU   7  -3.873   7.769  -2.302
   55   1HD2  LEU   7          1HD2      LEU   7  -6.278   7.742  -4.134
   56   2HD2  LEU   7          2HD2      LEU   7  -7.450   7.005  -3.041
   57   3HD2  LEU   7          3HD2      LEU   7  -5.817   6.349  -3.154
   58    H    LEU   8           H        LEU   8  -8.329   7.546   2.092
   59    HA   LEU   8           HA       LEU   8  -7.068   5.139   3.165
   60   1HB   LEU   8          2HB       LEU   8  -8.345   7.472   4.596
   61   2HB   LEU   8          1HB       LEU   8  -7.503   6.141   5.365
   62    HG   LEU   8           HG       LEU   8  -6.240   8.144   3.491
   63   1HD1  LEU   8          1HD1      LEU   8  -6.860   9.143   5.618
   64   2HD1  LEU   8          2HD1      LEU   8  -5.109   8.967   5.494
   65   3HD1  LEU   8          3HD1      LEU   8  -6.040   7.841   6.482
   66   1HD2  LEU   8          1HD2      LEU   8  -5.156   5.974   3.361
   67   2HD2  LEU   8          2HD2      LEU   8  -5.037   5.906   5.119
   68   3HD2  LEU   8          3HD2      LEU   8  -4.125   7.119   4.222
   69    H    GLU   9           H        GLU   9  -8.281   3.396   3.050
   70    HA   GLU   9           HA       GLU   9 -11.101   3.555   3.888
   71   1HB   GLU   9          2HB       GLU   9  -9.704   1.687   1.972
   72   2HB   GLU   9          1HB       GLU   9 -11.297   1.342   2.626
   73   1HG   GLU   9          2HG       GLU   9 -10.637   3.838   1.089
   74   2HG   GLU   9          1HG       GLU   9 -11.272   2.366   0.352
   75    H    VAL  10           H        VAL  10 -11.715   1.057   4.573
   76    HA   VAL  10           HA       VAL  10 -10.199   0.560   6.952
   77    HB   VAL  10           HB       VAL  10 -12.342  -1.154   5.678
   78   1HG1  VAL  10          1HG1      VAL  10 -12.585  -2.122   7.926
   79   2HG1  VAL  10          2HG1      VAL  10 -11.211  -1.161   8.474
   80   3HG1  VAL  10          3HG1      VAL  10 -10.981  -2.409   7.251
   81   1HG2  VAL  10          1HG2      VAL  10 -13.857  -0.115   7.305
   82   2HG2  VAL  10          2HG2      VAL  10 -13.173   1.077   6.199
   83   3HG2  VAL  10          3HG2      VAL  10 -12.550   0.938   7.843
   84    H    LEU  11           H        LEU  11  -8.225  -0.303   6.831
   85    HA   LEU  11           HA       LEU  11  -7.650  -2.154   4.625
   86   1HB   LEU  11          2HB       LEU  11  -5.718  -0.550   6.298
   87   2HB   LEU  11          1HB       LEU  11  -5.336  -1.476   4.857
   88    HG   LEU  11           HG       LEU  11  -7.183   0.909   4.874
   89   1HD1  LEU  11          1HD1      LEU  11  -4.906   1.549   5.517
   90   2HD1  LEU  11          2HD1      LEU  11  -5.344   2.169   3.926
   91   3HD1  LEU  11          3HD1      LEU  11  -4.283   0.768   4.066
   92   1HD2  LEU  11          1HD2      LEU  11  -7.564  -0.660   3.044
   93   2HD2  LEU  11          2HD2      LEU  11  -5.853  -0.600   2.622
   94   3HD2  LEU  11          3HD2      LEU  11  -6.857   0.840   2.450
   95    H    ALA  12           H        ALA  12  -7.945  -4.187   5.322
   96    HA   ALA  12           HA       ALA  12  -6.262  -5.096   7.531
   97   1HB   ALA  12          1HB       ALA  12  -8.508  -4.779   8.480
   98   2HB   ALA  12          2HB       ALA  12  -8.033  -6.477   8.465
   99   3HB   ALA  12          3HB       ALA  12  -9.168  -5.867   7.261
  100    H    CYS  13           H        CYS  13  -5.631  -7.282   7.366
  101    HA   CYS  13           HA       CYS  13  -5.279  -8.186   4.697
  102   1HB   CYS  13          2HB       CYS  13  -4.790  -9.688   7.276
  103   2HB   CYS  13          1HB       CYS  13  -4.113 -10.073   5.697
  104    HG   CYS  13           HG       CYS  13  -3.381  -7.360   7.636
  105    HA   PRO  14           HA       PRO  14  -8.907 -10.649   4.216
  106   1HB   PRO  14          2HB       PRO  14  -8.146 -12.195   2.145
  107   2HB   PRO  14          1HB       PRO  14  -8.473 -10.467   1.965
  108   1HG   PRO  14          2HG       PRO  14  -5.850 -11.883   2.227
  109   2HG   PRO  14          1HG       PRO  14  -6.303 -10.556   1.140
  110   1HD   PRO  14          2HD       PRO  14  -4.912 -10.186   3.459
  111   2HD   PRO  14          1HD       PRO  14  -5.983  -8.958   2.757
  112    H    LYS  15           H        LYS  15  -6.057 -11.901   5.470
  113    HA   LYS  15           HA       LYS  15  -7.133 -14.632   5.618
  114   1HB   LYS  15          2HB       LYS  15  -4.355 -13.655   6.282
  115   2HB   LYS  15          1HB       LYS  15  -4.897 -15.324   6.350
  116   1HG   LYS  15          2HG       LYS  15  -5.420 -15.069   3.864
  117   2HG   LYS  15          1HG       LYS  15  -4.447 -13.598   3.942
  118   1HD   LYS  15          2HD       LYS  15  -3.547 -16.384   4.673
  119   2HD   LYS  15          1HD       LYS  15  -3.085 -15.486   3.226
  120   1HE   LYS  15          2HE       LYS  15  -1.886 -13.876   4.533
  121   2HE   LYS  15          1HE       LYS  15  -2.510 -14.554   6.036
  122   1HZ   LYS  15          1HZ       LYS  15  -0.235 -15.264   5.631
  123   2HZ   LYS  15          2HZ       LYS  15  -0.679 -15.940   4.145
  124   3HZ   LYS  15          3HZ       LYS  15  -1.286 -16.591   5.589
  125    H    ASP  16           H        ASP  16  -5.103 -12.679   7.801
  126    HA   ASP  16           HA       ASP  16  -6.446 -13.882  10.090
  127   1HB   ASP  16          2HB       ASP  16  -4.632 -12.932  11.399
  128   2HB   ASP  16          1HB       ASP  16  -3.962 -13.749   9.990
  129    H    LYS  17           H        LYS  17  -6.758 -11.191   8.191
  130    HA   LYS  17           HA       LYS  17  -8.048  -9.336   8.280
  131   1HB   LYS  17          2HB       LYS  17  -9.540 -10.993   9.621
  132   2HB   LYS  17          1HB       LYS  17  -9.016 -10.080  11.026
  133   1HG   LYS  17          2HG       LYS  17 -11.140  -9.243  10.281
  134   2HG   LYS  17          1HG       LYS  17  -9.904  -8.022   9.974
  135   1HD   LYS  17          2HD       LYS  17  -9.796  -8.705   7.634
  136   2HD   LYS  17          1HD       LYS  17 -11.003  -9.958   7.935
  137   1HE   LYS  17          2HE       LYS  17 -12.617  -8.226   8.580
  138   2HE   LYS  17          1HE       LYS  17 -11.414  -6.986   8.232
  139   1HZ   LYS  17          1HZ       LYS  17 -12.978  -7.276   6.410
  140   2HZ   LYS  17          2HZ       LYS  17 -12.533  -8.901   6.250
  141   3HZ   LYS  17          3HZ       LYS  17 -11.403  -7.675   5.921
  142    H    GLY  18           H        GLY  18  -5.336  -9.647   9.586
  143   1HA   GLY  18          2HA       GLY  18  -5.227  -7.831  11.773
  144   2HA   GLY  18          1HA       GLY  18  -3.861  -8.405  10.828
  145    HA   PRO  19           HA       PRO  19  -5.451  -3.927   9.755
  146   1HB   PRO  19          2HB       PRO  19  -3.581  -2.933  11.807
  147   2HB   PRO  19          1HB       PRO  19  -5.244  -2.443  11.475
  148   1HG   PRO  19          2HG       PRO  19  -4.611  -3.868  13.652
  149   2HG   PRO  19          1HG       PRO  19  -6.140  -4.121  12.788
  150   1HD   PRO  19          2HD       PRO  19  -3.622  -5.736  12.708
  151   2HD   PRO  19          1HD       PRO  19  -5.310  -6.286  12.744
  152    H    LEU  20           H        LEU  20  -4.402  -2.991   8.142
  153    HA   LEU  20           HA       LEU  20  -1.618  -3.713   7.659
  154   1HB   LEU  20          2HB       LEU  20  -3.735  -2.427   5.941
  155   2HB   LEU  20          1HB       LEU  20  -2.078  -2.653   5.414
  156    HG   LEU  20           HG       LEU  20  -3.830  -4.941   6.286
  157   1HD1  LEU  20          1HD1      LEU  20  -4.882  -3.825   4.391
  158   2HD1  LEU  20          2HD1      LEU  20  -4.210  -5.386   3.920
  159   3HD1  LEU  20          3HD1      LEU  20  -3.362  -3.898   3.499
  160   1HD2  LEU  20          1HD2      LEU  20  -2.207  -6.271   5.051
  161   2HD2  LEU  20          2HD2      LEU  20  -1.419  -5.340   6.323
  162   3HD2  LEU  20          3HD2      LEU  20  -1.303  -4.814   4.643
  163    H    ARG  21           H        ARG  21   0.046  -2.312   7.739
  164    HA   ARG  21           HA       ARG  21  -0.459   0.397   8.633
  165   1HB   ARG  21          2HB       ARG  21   1.475  -1.019   9.479
  166   2HB   ARG  21          1HB       ARG  21   2.210  -0.828   7.891
  167   1HG   ARG  21          2HG       ARG  21   2.020   1.673   8.264
  168   2HG   ARG  21          1HG       ARG  21   1.644   1.289   9.943
  169   1HD   ARG  21          2HD       ARG  21   4.157   0.540   8.456
  170   2HD   ARG  21          1HD       ARG  21   4.007   1.808   9.668
  171    HE   ARG  21           HE       ARG  21   4.143  -1.057  10.120
  172   1HH1  ARG  21          1HH1      ARG  21   3.351   2.068  11.504
  173   2HH1  ARG  21          2HH1      ARG  21   3.767   1.586  13.128
  174   1HH2  ARG  21          1HH2      ARG  21   4.735  -1.671  12.243
  175   2HH2  ARG  21          2HH2      ARG  21   4.566  -0.524  13.542
  176    H    TYR  22           H        TYR  22  -0.422   2.172   7.383
  177    HA   TYR  22           HA       TYR  22  -0.328   1.766   4.512
  178   1HB   TYR  22          2HB       TYR  22  -2.115   3.107   5.772
  179   2HB   TYR  22          1HB       TYR  22  -0.886   4.355   5.959
  180    HD1  TYR  22           1HD      TYR  22  -0.083   5.607   3.997
  181    HD2  TYR  22           2HD      TYR  22  -3.166   2.698   3.655
  182    HE1  TYR  22           1HE      TYR  22  -0.693   6.522   1.798
  183    HE2  TYR  22           2HE      TYR  22  -3.787   3.604   1.456
  184    HH   TYR  22           HH       TYR  22  -1.841   5.731  -0.280
  185    H    LEU  23           H        LEU  23   1.590   1.877   3.538
  186    HA   LEU  23           HA       LEU  23   3.597   3.765   4.544
  187   1HB   LEU  23          2HB       LEU  23   3.739   1.333   2.794
  188   2HB   LEU  23          1HB       LEU  23   5.007   2.539   2.710
  189    HG   LEU  23           HG       LEU  23   5.708   0.766   4.163
  190   1HD1  LEU  23          1HD1      LEU  23   6.379   3.023   4.778
  191   2HD1  LEU  23          2HD1      LEU  23   6.178   2.004   6.203
  192   3HD1  LEU  23          3HD1      LEU  23   4.940   3.185   5.780
  193   1HD2  LEU  23          1HD2      LEU  23   3.219   1.303   5.773
  194   2HD2  LEU  23          2HD2      LEU  23   4.512   0.185   6.206
  195   3HD2  LEU  23          3HD2      LEU  23   3.524  -0.121   4.778
  196    H    GLU  24           H        GLU  24   3.457   5.718   3.696
  197    HA   GLU  24           HA       GLU  24   2.066   6.254   1.260
  198   1HB   GLU  24          2HB       GLU  24   3.902   8.264   2.490
  199   2HB   GLU  24          1HB       GLU  24   2.320   8.499   1.764
  200   1HG   GLU  24          2HG       GLU  24   1.759   8.812   3.932
  201   2HG   GLU  24          1HG       GLU  24   1.562   7.062   3.861
  202    H    SER  25           H        SER  25   5.223   5.300   1.934
  203    HA   SER  25           HA       SER  25   6.874   6.729   0.277
  204   1HB   SER  25          2HB       SER  25   7.082   3.737   0.594
  205   2HB   SER  25          1HB       SER  25   8.387   4.905   0.400
  206    HG   SER  25           HG       SER  25   7.291   5.774   2.500
  207    H    GLU  26           H        GLU  26   5.220   3.691  -0.622
  208    HA   GLU  26           HA       GLU  26   5.118   4.659  -3.387
  209   1HB   GLU  26          2HB       GLU  26   6.244   2.032  -2.457
  210   2HB   GLU  26          1HB       GLU  26   5.583   2.220  -4.073
  211   1HG   GLU  26          2HG       GLU  26   7.183   4.113  -4.411
  212   2HG   GLU  26          1HG       GLU  26   7.923   3.671  -2.872
  213    H    GLN  27           H        GLN  27   3.203   4.395  -1.163
  214    HA   GLN  27           HA       GLN  27   1.078   3.748  -0.734
  215   1HB   GLN  27          2HB       GLN  27   0.927   3.008  -3.665
  216   2HB   GLN  27          1HB       GLN  27  -0.418   3.380  -2.597
  217   1HG   GLN  27          2HG       GLN  27   1.700   5.283  -3.569
  218   2HG   GLN  27          1HG       GLN  27   0.005   5.247  -4.049
  219   1HE2  GLN  27          1HE2      GLN  27   1.536   7.425  -2.884
  220   2HE2  GLN  27          2HE2      GLN  27   0.725   7.859  -1.423
  221    H    LEU  28           H        LEU  28   2.131   2.013   0.498
  222    HA   LEU  28           HA       LEU  28   1.475  -0.641  -0.601
  223   1HB   LEU  28          2HB       LEU  28   3.922   0.096   1.011
  224   2HB   LEU  28          1HB       LEU  28   3.462  -1.539   0.578
  225    HG   LEU  28           HG       LEU  28   4.178   0.625  -1.409
  226   1HD1  LEU  28          1HD1      LEU  28   6.106  -0.029  -0.078
  227   2HD1  LEU  28          2HD1      LEU  28   6.245  -0.648  -1.724
  228   3HD1  LEU  28          3HD1      LEU  28   5.776  -1.728  -0.413
  229   1HD2  LEU  28          1HD2      LEU  28   3.666  -2.329  -1.747
  230   2HD2  LEU  28          2HD2      LEU  28   4.258  -1.245  -3.005
  231   3HD2  LEU  28          3HD2      LEU  28   2.644  -1.014  -2.333
  232    H    LEU  29           H        LEU  29   0.760  -2.172   0.898
  233    HA   LEU  29           HA       LEU  29   0.070  -1.081   3.550
  234   1HB   LEU  29          2HB       LEU  29  -1.383  -3.165   1.918
  235   2HB   LEU  29          1HB       LEU  29  -1.842  -2.639   3.527
  236    HG   LEU  29           HG       LEU  29  -1.831  -0.914   1.051
  237   1HD1  LEU  29          1HD1      LEU  29  -4.103  -2.085   2.648
  238   2HD1  LEU  29          2HD1      LEU  29  -3.613  -2.559   1.021
  239   3HD1  LEU  29          3HD1      LEU  29  -4.264  -0.946   1.312
  240   1HD2  LEU  29          1HD2      LEU  29  -1.297   0.365   3.043
  241   2HD2  LEU  29          2HD2      LEU  29  -2.695  -0.313   3.875
  242   3HD2  LEU  29          3HD2      LEU  29  -2.925   0.745   2.484
  243    H    VAL  30           H        VAL  30   1.393  -1.937   5.032
  244    HA   VAL  30           HA       VAL  30   2.304  -4.710   4.615
  245    HB   VAL  30           HB       VAL  30   3.698  -2.543   6.201
  246   1HG1  VAL  30          1HG1      VAL  30   4.618  -5.298   5.387
  247   2HG1  VAL  30          2HG1      VAL  30   4.191  -4.780   7.019
  248   3HG1  VAL  30          3HG1      VAL  30   5.597  -4.087   6.212
  249   1HG2  VAL  30          1HG2      VAL  30   4.333  -3.617   3.453
  250   2HG2  VAL  30          2HG2      VAL  30   5.328  -2.487   4.374
  251   3HG2  VAL  30          3HG2      VAL  30   3.721  -2.004   3.827
  252    H    ASN  31           H        ASN  31   1.464  -6.157   5.973
  253    HA   ASN  31           HA       ASN  31   0.597  -5.272   8.628
  254   1HB   ASN  31          2HB       ASN  31  -0.968  -6.722   7.435
  255   2HB   ASN  31          1HB       ASN  31   0.279  -7.949   7.242
  256   1HD2  ASN  31          1HD2      ASN  31  -1.328  -9.341   8.275
  257   2HD2  ASN  31          2HD2      ASN  31  -1.441  -9.367   9.999
  258    H    GLU  32           H        GLU  32   1.950  -5.378  10.247
  259    HA   GLU  32           HA       GLU  32   4.584  -6.409   9.746
  260   1HB   GLU  32          2HB       GLU  32   3.928  -4.242  10.963
  261   2HB   GLU  32          1HB       GLU  32   3.609  -5.271  12.352
  262   1HG   GLU  32          2HG       GLU  32   5.865  -5.942  12.493
  263   2HG   GLU  32          1HG       GLU  32   6.242  -5.242  10.919
  264    H    ARG  33           H        ARG  33   1.751  -7.596  11.232
  265    HA   ARG  33           HA       ARG  33   3.029  -9.380  13.070
  266   1HB   ARG  33          2HB       ARG  33   0.247  -9.629  11.909
  267   2HB   ARG  33          1HB       ARG  33   0.852 -10.375  13.383
  268   1HG   ARG  33          2HG       ARG  33   1.211  -8.037  14.269
  269   2HG   ARG  33          1HG       ARG  33   0.280  -7.471  12.881
  270   1HD   ARG  33          2HD       ARG  33  -1.256  -7.663  14.667
  271   2HD   ARG  33          1HD       ARG  33  -1.545  -9.053  13.623
  272    HE   ARG  33           HE       ARG  33   0.294  -9.535  15.809
  273   1HH1  ARG  33          1HH1      ARG  33  -3.044  -9.642  14.745
  274   2HH1  ARG  33          2HH1      ARG  33  -3.541 -10.754  15.981
  275   1HH2  ARG  33          1HH2      ARG  33  -0.342 -10.987  17.429
  276   2HH2  ARG  33          2HH2      ARG  33  -1.995 -11.533  17.519
  277    H    LEU  34           H        LEU  34   2.245  -9.462   9.698
  278    HA   LEU  34           HA       LEU  34   2.972 -12.315   9.564
  279   1HB   LEU  34          2HB       LEU  34   1.561 -10.598   7.515
  280   2HB   LEU  34          1HB       LEU  34   1.946 -12.297   7.325
  281    HG   LEU  34           HG       LEU  34   0.021 -11.120   9.331
  282   1HD1  LEU  34          1HD1      LEU  34  -1.671 -12.311   8.029
  283   2HD1  LEU  34          2HD1      LEU  34  -0.431 -12.818   6.883
  284   3HD1  LEU  34          3HD1      LEU  34  -0.829 -11.107   7.051
  285   1HD2  LEU  34          1HD2      LEU  34  -0.515 -13.435   9.896
  286   2HD2  LEU  34          2HD2      LEU  34   1.174 -13.064  10.252
  287   3HD2  LEU  34          3HD2      LEU  34   0.760 -13.997   8.814
  288    H    ASN  35           H        ASN  35   4.061  -9.178   8.873
  289    HA   ASN  35           HA       ASN  35   5.936  -8.326   7.921
  290   1HB   ASN  35          2HB       ASN  35   7.051 -10.259   9.074
  291   2HB   ASN  35          1HB       ASN  35   6.863 -11.191   7.595
  292   1HD2  ASN  35          1HD2      ASN  35   7.615  -7.773   7.680
  293   2HD2  ASN  35          2HD2      ASN  35   9.210  -7.918   7.047
  294    H    LEU  36           H        LEU  36   3.567  -9.116   6.402
  295    HA   LEU  36           HA       LEU  36   4.781  -9.433   3.744
  296   1HB   LEU  36          2HB       LEU  36   2.061 -10.327   4.696
  297   2HB   LEU  36          1HB       LEU  36   2.604 -10.395   3.031
  298    HG   LEU  36           HG       LEU  36   3.837 -11.913   5.331
  299   1HD1  LEU  36          1HD1      LEU  36   1.629 -12.756   4.764
  300   2HD1  LEU  36          2HD1      LEU  36   2.883 -13.887   4.247
  301   3HD1  LEU  36          3HD1      LEU  36   2.088 -12.849   3.061
  302   1HD2  LEU  36          1HD2      LEU  36   5.100 -13.073   3.576
  303   2HD2  LEU  36          2HD2      LEU  36   5.477 -11.351   3.626
  304   3HD2  LEU  36          3HD2      LEU  36   4.414 -11.986   2.369
  305    H    ALA  37           H        ALA  37   3.896  -8.216   2.040
  306    HA   ALA  37           HA       ALA  37   2.337  -5.876   2.930
  307   1HB   ALA  37          1HB       ALA  37   3.639  -4.502   1.388
  308   2HB   ALA  37          2HB       ALA  37   4.602  -5.911   0.945
  309   3HB   ALA  37          3HB       ALA  37   4.677  -5.275   2.587
  310    H    TYR  38           H        TYR  38   0.744  -5.170   1.649
  311    HA   TYR  38           HA       TYR  38   0.154  -6.711  -0.779
  312   1HB   TYR  38          2HB       TYR  38  -1.634  -5.067   1.021
  313   2HB   TYR  38          1HB       TYR  38  -2.163  -5.769  -0.505
  314    HD1  TYR  38           1HD      TYR  38  -2.408  -8.185  -0.744
  315    HD2  TYR  38           2HD      TYR  38  -1.283  -6.463   2.980
  316    HE1  TYR  38           1HE      TYR  38  -2.931 -10.301   0.386
  317    HE2  TYR  38           2HE      TYR  38  -1.807  -8.578   4.122
  318    HH   TYR  38           HH       TYR  38  -2.285 -11.481   2.463
  319    H    ARG  39           H        ARG  39  -0.730  -5.488  -2.608
  320    HA   ARG  39           HA       ARG  39   0.946  -3.112  -2.938
  321   1HB   ARG  39          2HB       ARG  39  -0.235  -5.058  -4.917
  322   2HB   ARG  39          1HB       ARG  39   0.662  -3.618  -5.381
  323   1HG   ARG  39          2HG       ARG  39   2.669  -4.467  -4.659
  324   2HG   ARG  39          1HG       ARG  39   1.912  -5.572  -3.510
  325   1HD   ARG  39          2HD       ARG  39   2.900  -6.731  -5.448
  326   2HD   ARG  39          1HD       ARG  39   1.165  -6.996  -5.303
  327    HE   ARG  39           HE       ARG  39   1.469  -4.855  -7.027
  328   1HH1  ARG  39          1HH1      ARG  39   2.531  -8.196  -6.913
  329   2HH1  ARG  39          2HH1      ARG  39   2.471  -8.405  -8.639
  330   1HH2  ARG  39          1HH2      ARG  39   1.383  -5.132  -9.291
  331   2HH2  ARG  39          2HH2      ARG  39   1.787  -6.668  -9.993
  332    H    ILE  40           H        ILE  40   0.159  -1.176  -3.559
  333    HA   ILE  40           HA       ILE  40  -2.705  -1.014  -4.243
  334    HB   ILE  40           HB       ILE  40  -0.988   1.136  -2.981
  335   1HG1  ILE  40          2HG1      ILE  40  -3.273  -0.463  -1.803
  336   2HG1  ILE  40          1HG1      ILE  40  -1.571  -0.667  -1.403
  337   1HG2  ILE  40          1HG2      ILE  40  -3.057   2.425  -2.813
  338   2HG2  ILE  40          2HG2      ILE  40  -3.931   1.140  -3.652
  339   3HG2  ILE  40          3HG2      ILE  40  -2.673   2.047  -4.494
  340   1HD1  ILE  40          1HD1      ILE  40  -3.226   1.793  -0.901
  341   2HD1  ILE  40          2HD1      ILE  40  -1.519   1.603  -0.501
  342   3HD1  ILE  40          3HD1      ILE  40  -2.729   0.605   0.304
  343    H    ASP  41           H        ASP  41  -2.929  -0.721  -6.347
  344    HA   ASP  41           HA       ASP  41  -0.829   0.783  -7.761
  345   1HB   ASP  41          2HB       ASP  41  -1.065  -1.571  -8.478
  346   2HB   ASP  41          1HB       ASP  41  -2.749  -1.263  -8.895
  347    H    ASP  42           H        ASP  42  -1.605   2.809  -7.559
  348    HA   ASP  42           HA       ASP  42  -2.830   4.664  -7.974
  349   1HB   ASP  42          2HB       ASP  42  -2.120   4.016 -10.261
  350   2HB   ASP  42          1HB       ASP  42  -3.632   3.138 -10.458
  351    H    GLY  43           H        GLY  43  -4.182   4.044  -6.117
  352   1HA   GLY  43          2HA       GLY  43  -6.296   4.307  -5.223
  353   2HA   GLY  43          1HA       GLY  43  -6.936   4.399  -6.853
  354    H    ILE  44           H        ILE  44  -5.269   1.627  -6.959
  355    HA   ILE  44           HA       ILE  44  -7.619   0.064  -6.124
  356    HB   ILE  44           HB       ILE  44  -5.483  -0.714  -8.122
  357   1HG1  ILE  44          2HG1      ILE  44  -8.359   0.099  -8.594
  358   2HG1  ILE  44          1HG1      ILE  44  -6.966   1.124  -8.905
  359   1HG2  ILE  44          1HG2      ILE  44  -6.982  -2.580  -8.656
  360   2HG2  ILE  44          2HG2      ILE  44  -8.067  -2.067  -7.365
  361   3HG2  ILE  44          3HG2      ILE  44  -6.443  -2.633  -6.977
  362   1HD1  ILE  44          1HD1      ILE  44  -7.600  -1.477 -10.269
  363   2HD1  ILE  44          2HD1      ILE  44  -6.162  -0.502 -10.559
  364   3HD1  ILE  44          3HD1      ILE  44  -7.758   0.139 -10.956
  365    HA   PRO  45           HA       PRO  45  -4.622  -1.562  -3.122
  366   1HB   PRO  45          2HB       PRO  45  -6.919  -2.221  -1.503
  367   2HB   PRO  45          1HB       PRO  45  -5.663  -1.023  -1.183
  368   1HG   PRO  45          2HG       PRO  45  -8.272  -0.394  -1.740
  369   2HG   PRO  45          1HG       PRO  45  -6.904   0.688  -2.052
  370   1HD   PRO  45          2HD       PRO  45  -8.394  -1.083  -3.952
  371   2HD   PRO  45          1HD       PRO  45  -7.774   0.563  -4.197
  372    H    VAL  46           H        VAL  46  -3.947  -3.452  -3.940
  373    HA   VAL  46           HA       VAL  46  -5.845  -5.518  -4.683
  374    HB   VAL  46           HB       VAL  46  -2.823  -5.628  -4.783
  375   1HG1  VAL  46          1HG1      VAL  46  -3.849  -7.814  -4.901
  376   2HG1  VAL  46          2HG1      VAL  46  -3.211  -7.374  -6.485
  377   3HG1  VAL  46          3HG1      VAL  46  -4.943  -7.264  -6.172
  378   1HG2  VAL  46          1HG2      VAL  46  -4.773  -4.787  -6.922
  379   2HG2  VAL  46          2HG2      VAL  46  -3.044  -5.038  -7.158
  380   3HG2  VAL  46          3HG2      VAL  46  -3.609  -3.746  -6.100
  381    H    LEU  47           H        LEU  47  -6.705  -6.215  -2.745
  382    HA   LEU  47           HA       LEU  47  -4.857  -7.299  -0.758
  383   1HB   LEU  47          2HB       LEU  47  -7.860  -6.997  -0.631
  384   2HB   LEU  47          1HB       LEU  47  -6.827  -7.527   0.683
  385    HG   LEU  47           HG       LEU  47  -6.787  -4.785  -0.584
  386   1HD1  LEU  47          1HD1      LEU  47  -8.783  -5.161   0.758
  387   2HD1  LEU  47          2HD1      LEU  47  -7.689  -4.035   1.564
  388   3HD1  LEU  47          3HD1      LEU  47  -7.787  -5.710   2.106
  389   1HD2  LEU  47          1HD2      LEU  47  -4.575  -5.462   0.203
  390   2HD2  LEU  47          2HD2      LEU  47  -5.254  -5.879   1.775
  391   3HD2  LEU  47          3HD2      LEU  47  -5.255  -4.202   1.233
  392    H    LEU  48           H        LEU  48  -4.213  -9.021  -2.193
  393    HA   LEU  48           HA       LEU  48  -6.175 -11.221  -2.232
  394   1HB   LEU  48          2HB       LEU  48  -3.945 -10.683  -4.199
  395   2HB   LEU  48          1HB       LEU  48  -4.977 -12.098  -4.213
  396    HG   LEU  48           HG       LEU  48  -5.876  -9.255  -4.687
  397   1HD1  LEU  48          1HD1      LEU  48  -6.284 -10.032  -6.975
  398   2HD1  LEU  48          2HD1      LEU  48  -5.587 -11.598  -6.563
  399   3HD1  LEU  48          3HD1      LEU  48  -4.582 -10.151  -6.537
  400   1HD2  LEU  48          1HD2      LEU  48  -7.604 -10.597  -3.579
  401   2HD2  LEU  48          2HD2      LEU  48  -7.436 -11.838  -4.821
  402   3HD2  LEU  48          3HD2      LEU  48  -8.034 -10.238  -5.251
  403    H    ILE  49           H        ILE  49  -5.461 -13.239  -1.605
  404    HA   ILE  49           HA       ILE  49  -3.561 -13.277   0.451
  405    HB   ILE  49           HB       ILE  49  -4.682 -15.620  -1.103
  406   1HG1  ILE  49          2HG1      ILE  49  -5.616 -14.364   1.493
  407   2HG1  ILE  49          1HG1      ILE  49  -6.394 -14.151  -0.070
  408   1HG2  ILE  49          1HG2      ILE  49  -2.694 -16.241   0.145
  409   2HG2  ILE  49          2HG2      ILE  49  -4.134 -16.951   0.878
  410   3HG2  ILE  49          3HG2      ILE  49  -3.376 -15.535   1.608
  411   1HD1  ILE  49          1HD1      ILE  49  -6.858 -16.555  -0.149
  412   2HD1  ILE  49          2HD1      ILE  49  -7.580 -15.778   1.261
  413   3HD1  ILE  49          3HD1      ILE  49  -6.111 -16.737   1.439
  414    H    ASP  50           H        ASP  50  -3.354 -14.593  -2.845
  415    HA   ASP  50           HA       ASP  50  -0.733 -15.628  -2.559
  416   1HB   ASP  50          2HB       ASP  50  -2.126 -16.533  -4.266
  417   2HB   ASP  50          1HB       ASP  50  -2.415 -14.947  -4.969
  418    H    GLU  51           H        GLU  51  -1.935 -12.472  -3.475
  419    HA   GLU  51           HA       GLU  51   0.461 -11.729  -4.876
  420   1HB   GLU  51          2HB       GLU  51  -2.050 -10.916  -5.153
  421   2HB   GLU  51          1HB       GLU  51  -1.525  -9.682  -4.015
  422   1HG   GLU  51          2HG       GLU  51  -1.283  -8.876  -6.274
  423   2HG   GLU  51          1HG       GLU  51   0.305  -9.081  -5.536
  424    H    ALA  52           H        ALA  52  -0.096 -12.057  -1.679
  425    HA   ALA  52           HA       ALA  52   1.021  -9.686  -0.588
  426   1HB   ALA  52          1HB       ALA  52  -0.329 -11.240   0.742
  427   2HB   ALA  52          2HB       ALA  52   1.256 -10.970   1.470
  428   3HB   ALA  52          3HB       ALA  52   0.931 -12.461   0.586
  429    H    THR  53           H        THR  53   3.038  -9.006  -0.758
  430    HA   THR  53           HA       THR  53   5.115 -10.961  -1.450
  431    HB   THR  53           HB       THR  53   4.907  -9.108  -3.031
  432    HG1  THR  53           1HG      THR  53   7.220  -8.235  -2.531
  433   1HG2  THR  53          1HG2      THR  53   5.613  -7.324  -0.702
  434   2HG2  THR  53          2HG2      THR  53   4.051  -7.389  -1.517
  435   3HG2  THR  53          3HG2      THR  53   5.473  -6.818  -2.386
  436    H    GLU  54           H        GLU  54   7.267 -10.573  -0.523
  437    HA   GLU  54           HA       GLU  54   7.006 -10.136   2.345
  438   1HB   GLU  54          2HB       GLU  54   8.183 -12.140   1.601
  439   2HB   GLU  54          1HB       GLU  54   9.305 -11.162   0.669
  440   1HG   GLU  54          2HG       GLU  54  10.210 -10.206   2.692
  441   2HG   GLU  54          1HG       GLU  54   9.036 -11.094   3.664
  442    H    TRP  55           H        TRP  55   7.560  -8.297   3.284
  443    HA   TRP  55           HA       TRP  55   9.459  -6.511   1.940
  444   1HB   TRP  55          2HB       TRP  55   7.176  -5.773   1.348
  445   2HB   TRP  55          1HB       TRP  55   6.775  -5.664   3.059
  446    HD1  TRP  55           HD       TRP  55   7.571  -3.511   4.371
  447    HE1  TRP  55           1HE      TRP  55   8.621  -1.280   3.626
  448    HE3  TRP  55           3HE      TRP  55   8.820  -4.763  -0.427
  449    HZ2  TRP  55           2HZ      TRP  55   9.803  -0.195   1.307
  450    HZ3  TRP  55           3HZ      TRP  55   9.902  -3.069  -1.843
  451    HH2  TRP  55           HH       TRP  55  10.384  -0.833  -0.994
  452    H    THR  56           H        THR  56  10.925  -5.690   3.309
  453    HA   THR  56           HA       THR  56  10.233  -5.463   6.131
  454    HB   THR  56           HB       THR  56  11.265  -7.699   5.859
  455    HG1  THR  56           1HG      THR  56  13.005  -5.937   7.266
  456   1HG2  THR  56          1HG2      THR  56  13.717  -6.162   5.002
  457   2HG2  THR  56          2HG2      THR  56  12.762  -7.242   3.987
  458   3HG2  THR  56          3HG2      THR  56  13.660  -7.885   5.364
  459    HA   PRO  57           HA       PRO  57  12.556  -1.687   5.590
  460   1HB   PRO  57          2HB       PRO  57  12.553  -1.542   8.517
  461   2HB   PRO  57          1HB       PRO  57  11.791  -0.461   7.346
  462   1HG   PRO  57          2HG       PRO  57  10.354  -2.098   8.936
  463   2HG   PRO  57          1HG       PRO  57   9.840  -1.679   7.291
  464   1HD   PRO  57          2HD       PRO  57  11.174  -4.173   8.284
  465   2HD   PRO  57          1HD       PRO  57   9.842  -3.992   7.120
  466    H    ASN  58           H        ASN  58  14.564  -0.718   6.607
  467    HA   ASN  58           HA       ASN  58  16.785  -0.841   7.066
  468   1HB   ASN  58          2HB       ASN  58  16.101  -1.690   9.248
  469   2HB   ASN  58          1HB       ASN  58  15.972  -3.320   8.601
  470   1HD2  ASN  58          1HD2      ASN  58  18.532  -1.039   7.845
  471   2HD2  ASN  58          2HD2      ASN  58  19.795  -1.917   8.630
  472    H    ASN  59           H        ASN  59  17.652  -1.131   5.067
  473    HA   ASN  59           HA       ASN  59  17.626  -3.758   3.835
  474   1HB   ASN  59          2HB       ASN  59  17.301  -1.749   2.443
  475   2HB   ASN  59          1HB       ASN  59  18.911  -1.188   2.886
  476   1HD2  ASN  59          1HD2      ASN  59  19.683  -1.187   0.809
  477   2HD2  ASN  59          2HD2      ASN  59  19.976  -2.635  -0.095
  478    H    LEU  60           H        LEU  60  18.908  -5.066   5.064
  479    HA   LEU  60           HA       LEU  60  21.602  -4.302   5.746
  480   1HB   LEU  60          2HB       LEU  60  20.147  -6.942   5.937
  481   2HB   LEU  60          1HB       LEU  60  21.778  -6.669   6.523
  482    HG   LEU  60           HG       LEU  60  19.308  -5.256   7.537
  483   1HD1  LEU  60          1HD1      LEU  60  20.974  -7.425   8.803
  484   2HD1  LEU  60          2HD1      LEU  60  19.346  -7.618   8.154
  485   3HD1  LEU  60          3HD1      LEU  60  19.620  -6.583   9.556
  486   1HD2  LEU  60          1HD2      LEU  60  20.780  -4.404   9.290
  487   2HD2  LEU  60          2HD2      LEU  60  21.321  -3.880   7.694
  488   3HD2  LEU  60          3HD2      LEU  60  22.160  -5.192   8.521
  489    H    GLU  61           H        GLU  61  23.456  -5.690   5.079
  490    HA   GLU  61           HA       GLU  61  23.558  -5.648   2.229
  491   1HB   GLU  61          2HB       GLU  61  25.588  -6.623   4.240
  492   2HB   GLU  61          1HB       GLU  61  25.892  -6.418   2.520
  493   1HG   GLU  61          2HG       GLU  61  25.402  -4.020   2.741
  494   2HG   GLU  61          1HG       GLU  61  25.162  -4.248   4.473
  Start of MODEL    9
    1   1H    MET   1          1HT       MET   1  -4.296  18.271  11.599
    2   2H    MET   1          2HT       MET   1  -4.210  16.650  12.085
    3   3H    MET   1          3HT       MET   1  -4.184  17.881  13.243
    4    HA   MET   1           HA       MET   1  -6.339  16.721  13.070
    5   1HB   MET   1          2HB       MET   1  -6.072  19.048  13.939
    6   2HB   MET   1          1HB       MET   1  -6.382  19.653  12.320
    7   1HG   MET   1          2HG       MET   1  -8.618  18.713  12.368
    8   2HG   MET   1          1HG       MET   1  -8.308  18.026  13.961
    9   1HE   MET   1          1HE       MET   1 -10.475  19.162  15.001
   10   2HE   MET   1          2HE       MET   1 -10.848  19.756  13.383
   11   3HE   MET   1          3HE       MET   1 -10.880  20.860  14.757
   12    H    SER   2           H        SER   2  -8.213  16.331  11.874
   13    HA   SER   2           HA       SER   2  -9.645  16.198  10.125
   14   1HB   SER   2          2HB       SER   2  -7.800  18.101   8.671
   15   2HB   SER   2          1HB       SER   2  -9.451  17.684   8.206
   16    HG   SER   2           HG       SER   2 -10.192  18.671  10.108
   17    H    LEU   3           H        LEU   3  -9.950  14.730   8.568
   18    HA   LEU   3           HA       LEU   3  -7.945  13.879   6.734
   19   1HB   LEU   3          2HB       LEU   3  -7.227  12.775   8.889
   20   2HB   LEU   3          1HB       LEU   3  -8.738  11.891   8.869
   21    HG   LEU   3           HG       LEU   3  -8.072  10.850   6.717
   22   1HD1  LEU   3          1HD1      LEU   3  -5.750  11.029   5.983
   23   2HD1  LEU   3          2HD1      LEU   3  -5.450  12.241   7.231
   24   3HD1  LEU   3          3HD1      LEU   3  -6.576  12.588   5.916
   25   1HD2  LEU   3          1HD2      LEU   3  -6.358   9.373   7.674
   26   2HD2  LEU   3          2HD2      LEU   3  -7.680   9.677   8.802
   27   3HD2  LEU   3          3HD2      LEU   3  -6.139  10.509   9.004
   28    H    ASP   4           H        ASP   4  -8.806  11.902   5.477
   29    HA   ASP   4           HA       ASP   4 -11.750  11.899   5.493
   30   1HB   ASP   4          2HB       ASP   4 -10.843  13.181   3.552
   31   2HB   ASP   4          1HB       ASP   4 -10.019  11.720   3.016
   32    HA   PRO   5           HA       PRO   5 -10.318   7.599   6.186
   33   1HB   PRO   5          2HB       PRO   5 -12.489   6.845   7.627
   34   2HB   PRO   5          1HB       PRO   5 -11.122   7.719   8.330
   35   1HG   PRO   5          2HG       PRO   5 -13.769   8.770   7.406
   36   2HG   PRO   5          1HG       PRO   5 -12.870   9.157   8.885
   37   1HD   PRO   5          2HD       PRO   5 -12.854  10.776   6.719
   38   2HD   PRO   5          1HD       PRO   5 -11.450  10.612   7.793
   39    H    GLN   6           H        GLN   6 -12.857   8.946   4.427
   40    HA   GLN   6           HA       GLN   6 -14.460   6.701   3.848
   41   1HB   GLN   6          2HB       GLN   6 -13.929   9.184   2.204
   42   2HB   GLN   6          1HB       GLN   6 -15.194   8.012   1.866
   43   1HG   GLN   6          2HG       GLN   6 -14.967   9.686   4.355
   44   2HG   GLN   6          1HG       GLN   6 -16.061   9.983   3.004
   45   1HE2  GLN   6          1HE2      GLN   6 -17.825   8.609   2.692
   46   2HE2  GLN   6          2HE2      GLN   6 -18.401   7.563   3.947
   47    H    LEU   7           H        LEU   7 -11.589   8.033   2.280
   48    HA   LEU   7           HA       LEU   7 -11.654   6.200   0.082
   49   1HB   LEU   7          2HB       LEU   7  -9.428   7.959   1.115
   50   2HB   LEU   7          1HB       LEU   7  -9.397   7.087  -0.405
   51    HG   LEU   7           HG       LEU   7 -11.362   9.274   0.283
   52   1HD1  LEU   7          1HD1      LEU   7 -10.091  10.611  -1.338
   53   2HD1  LEU   7          2HD1      LEU   7  -8.913   9.305  -1.476
   54   3HD1  LEU   7          3HD1      LEU   7  -9.110  10.155   0.056
   55   1HD2  LEU   7          1HD2      LEU   7 -10.823   7.818  -2.305
   56   2HD2  LEU   7          2HD2      LEU   7 -11.937   9.170  -2.093
   57   3HD2  LEU   7          3HD2      LEU   7 -12.254   7.630  -1.290
   58    H    LEU   8           H        LEU   8 -10.634   5.948   3.304
   59    HA   LEU   8           HA       LEU   8  -8.417   4.168   2.747
   60   1HB   LEU   8          2HB       LEU   8  -9.540   5.163   5.359
   61   2HB   LEU   8          1HB       LEU   8  -8.106   4.168   5.202
   62    HG   LEU   8           HG       LEU   8  -8.430   6.968   4.113
   63   1HD1  LEU   8          1HD1      LEU   8  -6.828   5.905   6.430
   64   2HD1  LEU   8          2HD1      LEU   8  -8.256   6.935   6.528
   65   3HD1  LEU   8          3HD1      LEU   8  -6.770   7.556   5.813
   66   1HD2  LEU   8          1HD2      LEU   8  -6.985   5.573   2.716
   67   2HD2  LEU   8          2HD2      LEU   8  -6.030   5.143   4.134
   68   3HD2  LEU   8          3HD2      LEU   8  -6.064   6.811   3.566
   69    H    GLU   9           H        GLU   9 -11.593   3.975   4.341
   70    HA   GLU   9           HA       GLU   9 -12.871   2.219   5.009
   71   1HB   GLU   9          2HB       GLU   9 -11.310   0.995   2.760
   72   2HB   GLU   9          1HB       GLU   9 -12.371  -0.013   3.735
   73   1HG   GLU   9          2HG       GLU   9 -13.275   2.485   2.327
   74   2HG   GLU   9          1HG       GLU   9 -13.381   0.868   1.631
   75    H    VAL  10           H        VAL  10 -12.310  -0.488   5.399
   76    HA   VAL  10           HA       VAL  10 -10.330  -0.321   7.559
   77    HB   VAL  10           HB       VAL  10 -12.422  -2.448   7.038
   78   1HG1  VAL  10          1HG1      VAL  10 -10.480  -3.364   8.181
   79   2HG1  VAL  10          2HG1      VAL  10 -11.851  -3.257   9.286
   80   3HG1  VAL  10          3HG1      VAL  10 -10.553  -2.068   9.376
   81   1HG2  VAL  10          1HG2      VAL  10 -13.529  -1.502   9.029
   82   2HG2  VAL  10          2HG2      VAL  10 -13.441  -0.353   7.694
   83   3HG2  VAL  10          3HG2      VAL  10 -12.332  -0.210   9.056
   84    H    LEU  11           H        LEU  11  -8.359  -0.817   6.886
   85    HA   LEU  11           HA       LEU  11  -7.973  -2.753   4.746
   86   1HB   LEU  11          2HB       LEU  11  -5.980  -1.048   6.245
   87   2HB   LEU  11          1HB       LEU  11  -5.612  -2.057   4.859
   88    HG   LEU  11           HG       LEU  11  -7.472   0.322   4.826
   89   1HD1  LEU  11          1HD1      LEU  11  -4.662   0.024   3.773
   90   2HD1  LEU  11          2HD1      LEU  11  -5.152   0.988   5.167
   91   3HD1  LEU  11          3HD1      LEU  11  -5.708   1.427   3.551
   92   1HD2  LEU  11          1HD2      LEU  11  -7.414   0.055   2.402
   93   2HD2  LEU  11          2HD2      LEU  11  -8.067  -1.387   3.182
   94   3HD2  LEU  11          3HD2      LEU  11  -6.408  -1.382   2.578
   95    H    ALA  12           H        ALA  12  -8.110  -4.798   5.403
   96    HA   ALA  12           HA       ALA  12  -6.402  -5.627   7.641
   97   1HB   ALA  12          1HB       ALA  12  -8.093  -7.208   8.389
   98   2HB   ALA  12          2HB       ALA  12  -9.183  -6.673   7.110
   99   3HB   ALA  12          3HB       ALA  12  -8.735  -5.565   8.407
  100    H    CYS  13           H        CYS  13  -5.545  -7.707   7.492
  101    HA   CYS  13           HA       CYS  13  -4.835  -8.527   4.885
  102   1HB   CYS  13          2HB       CYS  13  -3.396  -8.811   6.877
  103   2HB   CYS  13          1HB       CYS  13  -4.531  -9.991   7.516
  104    HG   CYS  13           HG       CYS  13  -2.909 -10.469   4.537
  105    HA   PRO  14           HA       PRO  14  -8.330 -11.056   3.869
  106   1HB   PRO  14          2HB       PRO  14  -6.499 -12.446   2.021
  107   2HB   PRO  14          1HB       PRO  14  -7.964 -11.522   1.673
  108   1HG   PRO  14          2HG       PRO  14  -5.544 -10.564   1.070
  109   2HG   PRO  14          1HG       PRO  14  -6.844  -9.504   1.648
  110   1HD   PRO  14          2HD       PRO  14  -4.508 -10.630   3.152
  111   2HD   PRO  14          1HD       PRO  14  -5.188  -8.989   3.189
  112    H    LYS  15           H        LYS  15  -5.882 -12.107   5.727
  113    HA   LYS  15           HA       LYS  15  -6.598 -14.935   5.548
  114   1HB   LYS  15          2HB       LYS  15  -4.383 -13.461   6.909
  115   2HB   LYS  15          1HB       LYS  15  -4.893 -15.008   7.567
  116   1HG   LYS  15          2HG       LYS  15  -3.154 -15.586   6.165
  117   2HG   LYS  15          1HG       LYS  15  -4.574 -15.885   5.163
  118   1HD   LYS  15          2HD       LYS  15  -4.251 -13.632   4.160
  119   2HD   LYS  15          1HD       LYS  15  -2.751 -13.487   5.075
  120   1HE   LYS  15          2HE       LYS  15  -3.395 -15.528   2.950
  121   2HE   LYS  15          1HE       LYS  15  -2.237 -14.206   2.841
  122   1HZ   LYS  15          1HZ       LYS  15  -1.086 -16.255   3.248
  123   2HZ   LYS  15          2HZ       LYS  15  -2.035 -16.580   4.619
  124   3HZ   LYS  15          3HZ       LYS  15  -0.954 -15.281   4.629
  125    H    ASP  16           H        ASP  16  -5.982 -12.917   8.420
  126    HA   ASP  16           HA       ASP  16  -8.642 -13.623   9.403
  127   1HB   ASP  16          2HB       ASP  16  -7.102 -15.417  10.158
  128   2HB   ASP  16          1HB       ASP  16  -6.114 -14.206  10.966
  129    H    LYS  17           H        LYS  17  -8.066 -11.136   8.578
  130    HA   LYS  17           HA       LYS  17  -8.657  -9.057   9.288
  131   1HB   LYS  17          2HB       LYS  17  -9.043 -10.538  11.870
  132   2HB   LYS  17          1HB       LYS  17  -9.374  -8.819  11.707
  133   1HG   LYS  17          2HG       LYS  17 -11.096  -9.205  10.131
  134   2HG   LYS  17          1HG       LYS  17 -10.626 -10.894   9.934
  135   1HD   LYS  17          2HD       LYS  17 -12.649 -10.586  11.324
  136   2HD   LYS  17          1HD       LYS  17 -11.339 -11.410  12.168
  137   1HE   LYS  17          2HE       LYS  17 -12.304  -9.823  13.664
  138   2HE   LYS  17          1HE       LYS  17 -10.713  -9.235  13.191
  139   1HZ   LYS  17          1HZ       LYS  17 -12.221  -7.426  13.130
  140   2HZ   LYS  17          2HZ       LYS  17 -13.347  -8.292  12.210
  141   3HZ   LYS  17          3HZ       LYS  17 -11.871  -7.820  11.520
  142    H    GLY  18           H        GLY  18  -5.820 -10.086   9.490
  143   1HA   GLY  18          2HA       GLY  18  -4.576  -8.674  11.631
  144   2HA   GLY  18          1HA       GLY  18  -3.776  -9.266  10.179
  145    HA   PRO  19           HA       PRO  19  -5.381  -4.587  10.017
  146   1HB   PRO  19          2HB       PRO  19  -3.280  -3.823  11.964
  147   2HB   PRO  19          1HB       PRO  19  -4.933  -3.223  11.797
  148   1HG   PRO  19          2HG       PRO  19  -4.272  -4.857  13.793
  149   2HG   PRO  19          1HG       PRO  19  -5.838  -4.999  12.976
  150   1HD   PRO  19          2HD       PRO  19  -3.376  -6.671  12.665
  151   2HD   PRO  19          1HD       PRO  19  -5.080  -7.172  12.705
  152    H    LEU  20           H        LEU  20  -4.577  -3.806   8.200
  153    HA   LEU  20           HA       LEU  20  -1.742  -4.147   7.584
  154   1HB   LEU  20          2HB       LEU  20  -4.011  -3.099   5.887
  155   2HB   LEU  20          1HB       LEU  20  -2.370  -3.366   5.332
  156    HG   LEU  20           HG       LEU  20  -4.282  -5.509   6.270
  157   1HD1  LEU  20          1HD1      LEU  20  -4.299  -6.208   3.940
  158   2HD1  LEU  20          2HD1      LEU  20  -3.239  -4.868   3.515
  159   3HD1  LEU  20          3HD1      LEU  20  -4.872  -4.547   4.095
  160   1HD2  LEU  20          1HD2      LEU  20  -1.484  -5.712   5.160
  161   2HD2  LEU  20          2HD2      LEU  20  -2.560  -7.071   5.479
  162   3HD2  LEU  20          3HD2      LEU  20  -1.978  -6.075   6.812
  163    H    ARG  21           H        ARG  21  -0.312  -2.475   7.390
  164    HA   ARG  21           HA       ARG  21  -1.322   0.162   8.207
  165   1HB   ARG  21          2HB       ARG  21   0.396  -0.982   9.654
  166   2HB   ARG  21          1HB       ARG  21   1.527  -0.838   8.318
  167   1HG   ARG  21          2HG       ARG  21   1.424   1.563   8.424
  168   2HG   ARG  21          1HG       ARG  21   0.166   1.487   9.657
  169   1HD   ARG  21          2HD       ARG  21   1.779   0.300  11.136
  170   2HD   ARG  21          1HD       ARG  21   3.026   0.570   9.918
  171    HE   ARG  21           HE       ARG  21   1.862   3.034  10.512
  172   1HH1  ARG  21          1HH1      ARG  21   3.814   0.597  12.125
  173   2HH1  ARG  21          2HH1      ARG  21   4.563   1.745  13.194
  174   1HH2  ARG  21          1HH2      ARG  21   2.836   4.523  11.920
  175   2HH2  ARG  21          2HH2      ARG  21   4.025   3.973  13.065
  176    H    TYR  22           H        TYR  22  -1.238   1.792   6.812
  177    HA   TYR  22           HA       TYR  22  -0.148   1.323   4.174
  178   1HB   TYR  22          2HB       TYR  22  -2.297   2.323   4.145
  179   2HB   TYR  22          1HB       TYR  22  -1.851   3.510   5.367
  180    HD1  TYR  22           1HD      TYR  22  -1.149   5.628   4.731
  181    HD2  TYR  22           2HD      TYR  22  -1.098   2.503   1.845
  182    HE1  TYR  22           1HE      TYR  22  -0.584   7.260   2.985
  183    HE2  TYR  22           2HE      TYR  22  -0.528   4.128   0.086
  184    HH   TYR  22           HH       TYR  22  -0.934   6.797  -0.171
  185    H    LEU  23           H        LEU  23   1.848   1.829   3.666
  186    HA   LEU  23           HA       LEU  23   3.269   3.863   5.192
  187   1HB   LEU  23          2HB       LEU  23   4.128   1.830   3.156
  188   2HB   LEU  23          1HB       LEU  23   5.178   3.160   3.597
  189    HG   LEU  23           HG       LEU  23   5.016   2.379   5.989
  190   1HD1  LEU  23          1HD1      LEU  23   4.330   0.071   6.386
  191   2HD1  LEU  23          2HD1      LEU  23   3.783  -0.058   4.714
  192   3HD1  LEU  23          3HD1      LEU  23   2.982   1.058   5.820
  193   1HD2  LEU  23          1HD2      LEU  23   6.623   0.563   5.684
  194   2HD2  LEU  23          2HD2      LEU  23   6.965   1.926   4.618
  195   3HD2  LEU  23          3HD2      LEU  23   6.196   0.474   3.974
  196    H    GLU  24           H        GLU  24   3.127   5.883   4.597
  197    HA   GLU  24           HA       GLU  24   1.920   6.696   2.166
  198   1HB   GLU  24          2HB       GLU  24   3.512   8.429   4.056
  199   2HB   GLU  24          1HB       GLU  24   2.257   8.945   2.939
  200   1HG   GLU  24          2HG       GLU  24   0.624   7.615   4.247
  201   2HG   GLU  24          1HG       GLU  24   1.905   7.265   5.405
  202    H    SER  25           H        SER  25   5.046   5.753   2.844
  203    HA   SER  25           HA       SER  25   6.502   7.558   1.195
  204   1HB   SER  25          2HB       SER  25   8.268   5.671   1.477
  205   2HB   SER  25          1HB       SER  25   7.750   6.570   2.905
  206    HG   SER  25           HG       SER  25   7.769   4.073   2.839
  207    H    GLU  26           H        GLU  26   5.634   4.113   0.784
  208    HA   GLU  26           HA       GLU  26   6.257   4.412  -2.080
  209   1HB   GLU  26          2HB       GLU  26   6.300   1.912  -0.379
  210   2HB   GLU  26          1HB       GLU  26   6.764   2.013  -2.076
  211   1HG   GLU  26          2HG       GLU  26   8.621   3.441  -1.526
  212   2HG   GLU  26          1HG       GLU  26   8.118   3.499   0.162
  213    H    GLN  27           H        GLN  27   3.683   4.506  -0.220
  214    HA   GLN  27           HA       GLN  27   1.459   4.082  -0.427
  215   1HB   GLN  27          2HB       GLN  27   2.300   3.826  -3.314
  216   2HB   GLN  27          1HB       GLN  27   0.627   3.667  -2.808
  217   1HG   GLN  27          2HG       GLN  27   0.794   5.868  -3.504
  218   2HG   GLN  27          1HG       GLN  27   0.913   5.974  -1.751
  219   1HE2  GLN  27          1HE2      GLN  27   2.820   6.627  -0.820
  220   2HE2  GLN  27          2HE2      GLN  27   4.127   7.306  -1.724
  221    H    LEU  28           H        LEU  28   2.864   1.985   0.557
  222    HA   LEU  28           HA       LEU  28   1.589  -0.347  -0.709
  223   1HB   LEU  28          2HB       LEU  28   4.182  -0.183   0.827
  224   2HB   LEU  28          1HB       LEU  28   3.410  -1.691   0.373
  225    HG   LEU  28           HG       LEU  28   4.419   0.395  -1.567
  226   1HD1  LEU  28          1HD1      LEU  28   6.241  -0.728  -0.382
  227   2HD1  LEU  28          2HD1      LEU  28   6.176  -1.221  -2.074
  228   3HD1  LEU  28          3HD1      LEU  28   5.562  -2.297  -0.819
  229   1HD2  LEU  28          1HD2      LEU  28   3.350  -2.386  -2.043
  230   2HD2  LEU  28          2HD2      LEU  28   3.993  -1.292  -3.269
  231   3HD2  LEU  28          3HD2      LEU  28   2.507  -0.881  -2.413
  232    H    LEU  29           H        LEU  29   0.863  -2.021   0.707
  233    HA   LEU  29           HA       LEU  29   0.131  -1.016   3.383
  234   1HB   LEU  29          2HB       LEU  29  -1.218  -3.167   1.739
  235   2HB   LEU  29          1HB       LEU  29  -1.761  -2.556   3.289
  236    HG   LEU  29           HG       LEU  29  -1.667  -0.978   0.718
  237   1HD1  LEU  29          1HD1      LEU  29  -3.984  -2.121   2.265
  238   2HD1  LEU  29          2HD1      LEU  29  -3.399  -2.675   0.696
  239   3HD1  LEU  29          3HD1      LEU  29  -4.108  -1.067   0.857
  240   1HD2  LEU  29          1HD2      LEU  29  -1.286   0.447   2.649
  241   2HD2  LEU  29          2HD2      LEU  29  -2.698  -0.239   3.456
  242   3HD2  LEU  29          3HD2      LEU  29  -2.899   0.724   1.990
  243    H    VAL  30           H        VAL  30   1.423  -1.878   4.893
  244    HA   VAL  30           HA       VAL  30   2.456  -4.593   4.399
  245    HB   VAL  30           HB       VAL  30   3.704  -2.400   6.075
  246   1HG1  VAL  30          1HG1      VAL  30   4.740  -5.149   5.380
  247   2HG1  VAL  30          2HG1      VAL  30   4.175  -4.625   6.967
  248   3HG1  VAL  30          3HG1      VAL  30   5.622  -3.902   6.265
  249   1HG2  VAL  30          1HG2      VAL  30   3.860  -1.932   3.692
  250   2HG2  VAL  30          2HG2      VAL  30   4.516  -3.542   3.403
  251   3HG2  VAL  30          3HG2      VAL  30   5.443  -2.367   4.340
  252    H    ASN  31           H        ASN  31   1.793  -6.146   5.682
  253    HA   ASN  31           HA       ASN  31   0.229  -5.608   8.040
  254   1HB   ASN  31          2HB       ASN  31  -0.189  -7.565   6.536
  255   2HB   ASN  31          1HB       ASN  31   1.357  -8.240   7.038
  256   1HD2  ASN  31          1HD2      ASN  31  -1.359  -9.286   7.289
  257   2HD2  ASN  31          2HD2      ASN  31  -1.592  -9.600   8.971
  258    H    GLU  32           H        GLU  32   1.094  -5.133   9.948
  259    HA   GLU  32           HA       GLU  32   3.948  -5.246  10.261
  260   1HB   GLU  32          2HB       GLU  32   2.349  -3.355  10.951
  261   2HB   GLU  32          1HB       GLU  32   1.973  -4.350  12.349
  262   1HG   GLU  32          2HG       GLU  32   4.192  -4.211  13.158
  263   2HG   GLU  32          1HG       GLU  32   4.770  -3.514  11.645
  264    H    ARG  33           H        ARG  33   1.611  -7.494  10.750
  265    HA   ARG  33           HA       ARG  33   2.968  -8.729  13.046
  266   1HB   ARG  33          2HB       ARG  33   0.388  -9.485  11.668
  267   2HB   ARG  33          1HB       ARG  33   1.071 -10.311  13.057
  268   1HG   ARG  33          2HG       ARG  33   0.766  -8.320  14.418
  269   2HG   ARG  33          1HG       ARG  33   0.128  -7.450  13.016
  270   1HD   ARG  33          2HD       ARG  33  -1.686  -9.081  12.836
  271   2HD   ARG  33          1HD       ARG  33  -1.051  -9.944  14.231
  272    HE   ARG  33           HE       ARG  33  -1.603  -7.226  14.875
  273   1HH1  ARG  33          1HH1      ARG  33  -3.127 -10.329  14.290
  274   2HH1  ARG  33          2HH1      ARG  33  -4.505  -9.980  15.294
  275   1HH2  ARG  33          1HH2      ARG  33  -3.435  -6.761  16.173
  276   2HH2  ARG  33          2HH2      ARG  33  -4.680  -7.964  16.364
  277    H    LEU  34           H        LEU  34   1.663  -9.660   9.861
  278    HA   LEU  34           HA       LEU  34   3.166 -12.127   9.895
  279   1HB   LEU  34          2HB       LEU  34   1.380 -10.956   7.762
  280   2HB   LEU  34          1HB       LEU  34   2.030 -12.584   7.763
  281    HG   LEU  34           HG       LEU  34   0.076 -11.470   9.781
  282   1HD1  LEU  34          1HD1      LEU  34  -0.302 -13.466   7.554
  283   2HD1  LEU  34          2HD1      LEU  34  -0.942 -11.825   7.602
  284   3HD1  LEU  34          3HD1      LEU  34  -1.510 -13.026   8.760
  285   1HD2  LEU  34          1HD2      LEU  34  -0.074 -13.793  10.571
  286   2HD2  LEU  34          2HD2      LEU  34   1.534 -13.111  10.805
  287   3HD2  LEU  34          3HD2      LEU  34   1.238 -14.236   9.480
  288    H    ASN  35           H        ASN  35   3.835  -9.004   8.998
  289    HA   ASN  35           HA       ASN  35   5.498  -7.982   7.852
  290   1HB   ASN  35          2HB       ASN  35   6.837  -9.681   9.193
  291   2HB   ASN  35          1HB       ASN  35   6.880 -10.664   7.732
  292   1HD2  ASN  35          1HD2      ASN  35   9.111 -10.498   7.510
  293   2HD2  ASN  35          2HD2      ASN  35   9.884  -9.028   7.025
  294    H    LEU  36           H        LEU  36   3.364  -8.714   6.319
  295    HA   LEU  36           HA       LEU  36   4.607  -9.473   3.759
  296   1HB   LEU  36          2HB       LEU  36   1.745  -9.835   4.653
  297   2HB   LEU  36          1HB       LEU  36   2.340 -10.186   3.042
  298    HG   LEU  36           HG       LEU  36   3.192 -11.593   5.573
  299   1HD1  LEU  36          1HD1      LEU  36   2.013 -13.518   4.598
  300   2HD1  LEU  36          2HD1      LEU  36   1.439 -12.483   3.289
  301   3HD1  LEU  36          3HD1      LEU  36   0.927 -12.172   4.948
  302   1HD2  LEU  36          1HD2      LEU  36   4.351 -13.133   4.070
  303   2HD2  LEU  36          2HD2      LEU  36   4.993 -11.497   3.927
  304   3HD2  LEU  36          3HD2      LEU  36   3.904 -12.131   2.690
  305    H    ALA  37           H        ALA  37   4.056  -8.221   1.942
  306    HA   ALA  37           HA       ALA  37   2.778  -5.650   2.618
  307   1HB   ALA  37          1HB       ALA  37   4.320  -4.544   1.112
  308   2HB   ALA  37          2HB       ALA  37   5.059  -6.090   0.699
  309   3HB   ALA  37          3HB       ALA  37   5.215  -5.448   2.334
  310    H    TYR  38           H        TYR  38   1.125  -5.075   1.441
  311    HA   TYR  38           HA       TYR  38   0.554  -6.488  -1.073
  312   1HB   TYR  38          2HB       TYR  38  -1.269  -4.887   0.746
  313   2HB   TYR  38          1HB       TYR  38  -1.771  -5.658  -0.754
  314    HD1  TYR  38           1HD      TYR  38  -0.573  -6.300   2.688
  315    HD2  TYR  38           2HD      TYR  38  -2.304  -7.972  -0.818
  316    HE1  TYR  38           1HE      TYR  38  -1.066  -8.367   3.925
  317    HE2  TYR  38           2HE      TYR  38  -2.804 -10.044   0.407
  318    HH   TYR  38           HH       TYR  38  -1.922 -11.255   2.407
  319    H    ARG  39           H        ARG  39  -0.179  -5.223  -2.887
  320    HA   ARG  39           HA       ARG  39   1.212  -2.641  -2.941
  321   1HB   ARG  39          2HB       ARG  39   0.279  -4.340  -5.263
  322   2HB   ARG  39          1HB       ARG  39   1.301  -2.912  -5.356
  323   1HG   ARG  39          2HG       ARG  39   3.056  -4.083  -4.125
  324   2HG   ARG  39          1HG       ARG  39   2.026  -5.515  -4.030
  325   1HD   ARG  39          2HD       ARG  39   3.597  -5.790  -5.837
  326   2HD   ARG  39          1HD       ARG  39   1.975  -5.597  -6.499
  327    HE   ARG  39           HE       ARG  39   3.437  -3.125  -6.321
  328   1HH1  ARG  39          1HH1      ARG  39   2.733  -5.934  -8.313
  329   2HH1  ARG  39          2HH1      ARG  39   3.304  -5.185  -9.779
  330   1HH2  ARG  39          1HH2      ARG  39   4.143  -2.143  -8.248
  331   2HH2  ARG  39          2HH2      ARG  39   4.101  -3.034  -9.739
  332    H    ILE  40           H        ILE  40   0.255  -0.925  -4.322
  333    HA   ILE  40           HA       ILE  40  -2.687  -1.042  -4.366
  334    HB   ILE  40           HB       ILE  40  -0.928   1.355  -3.820
  335   1HG1  ILE  40          2HG1      ILE  40  -2.991  -0.053  -2.106
  336   2HG1  ILE  40          1HG1      ILE  40  -1.244  -0.136  -1.893
  337   1HG2  ILE  40          1HG2      ILE  40  -3.927   1.222  -4.114
  338   2HG2  ILE  40          2HG2      ILE  40  -2.804   1.993  -5.236
  339   3HG2  ILE  40          3HG2      ILE  40  -3.005   2.636  -3.605
  340   1HD1  ILE  40          1HD1      ILE  40  -2.961   2.324  -1.589
  341   2HD1  ILE  40          2HD1      ILE  40  -1.208   2.275  -1.424
  342   3HD1  ILE  40          3HD1      ILE  40  -2.222   1.389  -0.287
  343    H    ASP  41           H        ASP  41  -3.587  -0.789  -6.295
  344    HA   ASP  41           HA       ASP  41  -1.842   0.079  -8.498
  345   1HB   ASP  41          2HB       ASP  41  -2.495  -2.205  -8.841
  346   2HB   ASP  41          1HB       ASP  41  -4.180  -1.837  -8.485
  347    H    ASP  42           H        ASP  42  -2.215   2.157  -8.761
  348    HA   ASP  42           HA       ASP  42  -3.244   4.119  -9.240
  349   1HB   ASP  42          2HB       ASP  42  -3.660   2.824 -11.313
  350   2HB   ASP  42          1HB       ASP  42  -5.210   2.308 -10.659
  351    H    GLY  43           H        GLY  43  -3.749   3.735  -6.759
  352   1HA   GLY  43          2HA       GLY  43  -5.145   4.750  -5.203
  353   2HA   GLY  43          1HA       GLY  43  -6.362   4.923  -6.454
  354    H    ILE  44           H        ILE  44  -5.734   1.816  -6.797
  355    HA   ILE  44           HA       ILE  44  -7.735   1.043  -4.778
  356    HB   ILE  44           HB       ILE  44  -7.104  -0.271  -7.428
  357   1HG1  ILE  44          2HG1      ILE  44  -9.541   1.295  -6.545
  358   2HG1  ILE  44          1HG1      ILE  44  -8.291   1.889  -7.634
  359   1HG2  ILE  44          1HG2      ILE  44  -9.054  -1.685  -6.971
  360   2HG2  ILE  44          2HG2      ILE  44  -9.215  -0.941  -5.381
  361   3HG2  ILE  44          3HG2      ILE  44  -7.787  -1.903  -5.763
  362   1HD1  ILE  44          1HD1      ILE  44 -10.213   1.194  -8.899
  363   2HD1  ILE  44          2HD1      ILE  44 -10.176  -0.400  -8.144
  364   3HD1  ILE  44          3HD1      ILE  44  -8.871   0.095  -9.222
  365    HA   PRO  45           HA       PRO  45  -4.297  -1.231  -2.975
  366   1HB   PRO  45          2HB       PRO  45  -5.824  -2.377  -1.008
  367   2HB   PRO  45          1HB       PRO  45  -5.111  -0.767  -0.892
  368   1HG   PRO  45          2HG       PRO  45  -7.899  -1.560  -1.621
  369   2HG   PRO  45          1HG       PRO  45  -7.343  -0.217  -0.605
  370   1HD   PRO  45          2HD       PRO  45  -8.135   0.156  -3.153
  371   2HD   PRO  45          1HD       PRO  45  -6.826   1.114  -2.428
  372    H    VAL  46           H        VAL  46  -3.577  -3.124  -3.673
  373    HA   VAL  46           HA       VAL  46  -5.440  -5.073  -4.780
  374    HB   VAL  46           HB       VAL  46  -2.411  -5.085  -4.800
  375   1HG1  VAL  46          1HG1      VAL  46  -2.650  -6.752  -6.583
  376   2HG1  VAL  46          2HG1      VAL  46  -4.400  -6.740  -6.355
  377   3HG1  VAL  46          3HG1      VAL  46  -3.345  -7.317  -5.061
  378   1HG2  VAL  46          1HG2      VAL  46  -3.261  -3.172  -6.020
  379   2HG2  VAL  46          2HG2      VAL  46  -4.374  -4.207  -6.919
  380   3HG2  VAL  46          3HG2      VAL  46  -2.632  -4.376  -7.142
  381    H    LEU  47           H        LEU  47  -6.347  -6.222  -3.181
  382    HA   LEU  47           HA       LEU  47  -4.670  -7.166  -0.972
  383   1HB   LEU  47          2HB       LEU  47  -7.668  -7.221  -1.329
  384   2HB   LEU  47          1HB       LEU  47  -6.812  -7.766   0.100
  385    HG   LEU  47           HG       LEU  47  -6.894  -4.929  -0.933
  386   1HD1  LEU  47          1HD1      LEU  47  -8.157  -6.207   1.489
  387   2HD1  LEU  47          2HD1      LEU  47  -9.001  -5.620   0.055
  388   3HD1  LEU  47          3HD1      LEU  47  -8.164  -4.484   1.112
  389   1HD2  LEU  47          1HD2      LEU  47  -5.577  -6.072   1.529
  390   2HD2  LEU  47          2HD2      LEU  47  -5.721  -4.356   1.139
  391   3HD2  LEU  47          3HD2      LEU  47  -4.753  -5.415   0.113
  392    H    LEU  48           H        LEU  48  -4.249  -8.331  -3.464
  393    HA   LEU  48           HA       LEU  48  -5.545 -10.915  -3.461
  394   1HB   LEU  48          2HB       LEU  48  -3.516  -9.565  -5.195
  395   2HB   LEU  48          1HB       LEU  48  -3.673 -11.308  -5.262
  396    HG   LEU  48           HG       LEU  48  -4.944 -10.243  -7.046
  397   1HD1  LEU  48          1HD1      LEU  48  -5.768 -12.343  -6.139
  398   2HD1  LEU  48          2HD1      LEU  48  -7.105 -11.312  -6.650
  399   3HD1  LEU  48          3HD1      LEU  48  -6.711 -11.466  -4.937
  400   1HD2  LEU  48          1HD2      LEU  48  -5.435  -8.111  -5.987
  401   2HD2  LEU  48          2HD2      LEU  48  -6.501  -8.913  -4.836
  402   3HD2  LEU  48          3HD2      LEU  48  -6.919  -8.881  -6.549
  403    H    ILE  49           H        ILE  49  -4.877 -12.607  -2.391
  404    HA   ILE  49           HA       ILE  49  -2.974 -12.456  -0.383
  405    HB   ILE  49           HB       ILE  49  -4.185 -14.880  -1.707
  406   1HG1  ILE  49          2HG1      ILE  49  -4.816 -13.457   0.891
  407   2HG1  ILE  49          1HG1      ILE  49  -5.761 -13.343  -0.590
  408   1HG2  ILE  49          1HG2      ILE  49  -2.662 -14.768   0.897
  409   2HG2  ILE  49          2HG2      ILE  49  -2.074 -15.492  -0.600
  410   3HG2  ILE  49          3HG2      ILE  49  -3.476 -16.179   0.221
  411   1HD1  ILE  49          1HD1      ILE  49  -6.282 -15.727  -0.435
  412   2HD1  ILE  49          2HD1      ILE  49  -6.804 -14.843   1.001
  413   3HD1  ILE  49          3HD1      ILE  49  -5.340 -15.829   1.054
  414    H    ASP  50           H        ASP  50  -2.608 -13.881  -3.625
  415    HA   ASP  50           HA       ASP  50  -0.031 -14.973  -2.975
  416   1HB   ASP  50          2HB       ASP  50  -1.517 -16.099  -4.574
  417   2HB   ASP  50          1HB       ASP  50  -1.404 -14.715  -5.656
  418    H    GLU  51           H        GLU  51  -1.182 -11.998  -4.319
  419    HA   GLU  51           HA       GLU  51   1.243 -11.240  -5.621
  420   1HB   GLU  51          2HB       GLU  51  -1.138  -9.626  -4.700
  421   2HB   GLU  51          1HB       GLU  51   0.222  -8.930  -5.569
  422   1HG   GLU  51          2HG       GLU  51  -1.582 -11.112  -6.592
  423   2HG   GLU  51          1HG       GLU  51  -1.657  -9.409  -7.043
  424    H    ALA  52           H        ALA  52   0.163 -11.209  -2.365
  425    HA   ALA  52           HA       ALA  52   1.808  -9.119  -1.380
  426   1HB   ALA  52          1HB       ALA  52  -0.129  -9.941  -0.145
  427   2HB   ALA  52          2HB       ALA  52   1.339 -10.049   0.825
  428   3HB   ALA  52          3HB       ALA  52   0.666 -11.497   0.078
  429    H    THR  53           H        THR  53   3.878  -9.099  -0.801
  430    HA   THR  53           HA       THR  53   5.370 -11.643  -0.907
  431    HB   THR  53           HB       THR  53   6.608  -8.952  -1.444
  432    HG1  THR  53           1HG      THR  53   4.784 -10.260  -2.996
  433   1HG2  THR  53          1HG2      THR  53   8.124 -10.834  -1.071
  434   2HG2  THR  53          2HG2      THR  53   8.204 -10.294  -2.749
  435   3HG2  THR  53          3HG2      THR  53   7.310 -11.757  -2.332
  436    H    GLU  54           H        GLU  54   7.116 -11.881   0.613
  437    HA   GLU  54           HA       GLU  54   6.723 -10.695   3.158
  438   1HB   GLU  54          2HB       GLU  54   9.216 -12.066   2.115
  439   2HB   GLU  54          1HB       GLU  54   8.826 -11.770   3.800
  440   1HG   GLU  54          2HG       GLU  54   8.359 -14.031   3.446
  441   2HG   GLU  54          1HG       GLU  54   6.790 -13.233   3.441
  442    H    TRP  55           H        TRP  55   7.679  -8.898   4.089
  443    HA   TRP  55           HA       TRP  55   9.134  -7.213   2.170
  444   1HB   TRP  55          2HB       TRP  55   6.884  -6.502   3.177
  445   2HB   TRP  55          1HB       TRP  55   7.774  -6.239   4.672
  446    HD1  TRP  55           HD       TRP  55   8.495  -3.811   4.967
  447    HE1  TRP  55           1HE      TRP  55   9.075  -1.844   3.405
  448    HE3  TRP  55           3HE      TRP  55   7.991  -6.176   0.464
  449    HZ2  TRP  55           2HZ      TRP  55   9.310  -1.373   0.630
  450    HZ3  TRP  55           3HZ      TRP  55   8.415  -4.900  -1.594
  451    HH2  TRP  55           HH       TRP  55   9.060  -2.546  -1.514
  452    H    THR  56           H        THR  56  11.157  -6.683   2.508
  453    HA   THR  56           HA       THR  56  13.169  -6.306   3.447
  454    HB   THR  56           HB       THR  56  11.659  -6.131   6.041
  455    HG1  THR  56           1HG      THR  56  11.870  -4.445   3.861
  456   1HG2  THR  56          1HG2      THR  56  14.074  -6.373   6.367
  457   2HG2  THR  56          2HG2      THR  56  13.538  -4.746   6.792
  458   3HG2  THR  56          3HG2      THR  56  14.356  -5.031   5.256
  459    HA   PRO  57           HA       PRO  57  13.996 -10.614   4.751
  460   1HB   PRO  57          2HB       PRO  57  16.417 -10.197   3.158
  461   2HB   PRO  57          1HB       PRO  57  15.167 -11.430   2.980
  462   1HG   PRO  57          2HG       PRO  57  15.490  -9.428   1.193
  463   2HG   PRO  57          1HG       PRO  57  13.906 -10.138   1.555
  464   1HD   PRO  57          2HD       PRO  57  15.110  -7.579   2.547
  465   2HD   PRO  57          1HD       PRO  57  13.448  -7.907   2.009
  466    H    ASN  58           H        ASN  58  15.137 -11.022   6.572
  467    HA   ASN  58           HA       ASN  58  17.138  -9.012   7.379
  468   1HB   ASN  58          2HB       ASN  58  14.950  -8.822   8.585
  469   2HB   ASN  58          1HB       ASN  58  15.206 -10.446   9.213
  470   1HD2  ASN  58          1HD2      ASN  58  15.174  -9.662  11.328
  471   2HD2  ASN  58          2HD2      ASN  58  16.515  -8.796  12.002
  472    H    ASN  59           H        ASN  59  19.092  -9.861   7.587
  473    HA   ASN  59           HA       ASN  59  19.568 -12.666   7.612
  474   1HB   ASN  59          2HB       ASN  59  21.178 -11.095   6.651
  475   2HB   ASN  59          1HB       ASN  59  21.431 -10.364   8.230
  476   1HD2  ASN  59          1HD2      ASN  59  23.616 -10.809   8.252
  477   2HD2  ASN  59          2HD2      ASN  59  24.233 -12.418   8.447
  478    H    LEU  60           H        LEU  60  19.157 -13.934   9.293
  479    HA   LEU  60           HA       LEU  60  19.259 -12.810  11.991
  480   1HB   LEU  60          2HB       LEU  60  18.113 -15.425  11.011
  481   2HB   LEU  60          1HB       LEU  60  18.003 -14.816  12.650
  482    HG   LEU  60           HG       LEU  60  16.758 -13.520  10.224
  483   1HD1  LEU  60          1HD1      LEU  60  14.641 -14.258  11.168
  484   2HD1  LEU  60          2HD1      LEU  60  15.491 -15.059  12.490
  485   3HD1  LEU  60          3HD1      LEU  60  15.689 -15.638  10.835
  486   1HD2  LEU  60          1HD2      LEU  60  17.399 -11.912  11.954
  487   2HD2  LEU  60          2HD2      LEU  60  16.514 -12.852  13.156
  488   3HD2  LEU  60          3HD2      LEU  60  15.646 -12.070  11.833
  489    H    GLU  61           H        GLU  61  20.593 -13.554  13.565
  490    HA   GLU  61           HA       GLU  61  22.282 -15.873  12.921
  491   1HB   GLU  61          2HB       GLU  61  24.155 -14.867  14.067
  492   2HB   GLU  61          1HB       GLU  61  23.588 -13.754  12.836
  493   1HG   GLU  61          2HG       GLU  61  22.938 -13.551  15.767
  494   2HG   GLU  61          1HG       GLU  61  24.228 -12.665  14.959
  Start of MODEL   10
    1   1H    MET   1          1HT       MET   1  -4.112  14.986   3.646
    2   2H    MET   1          2HT       MET   1  -3.236  14.333   4.944
    3   3H    MET   1          3HT       MET   1  -2.468  15.359   3.835
    4    HA   MET   1           HA       MET   1  -2.900  16.523   5.864
    5   1HB   MET   1          2HB       MET   1  -4.112  18.440   4.958
    6   2HB   MET   1          1HB       MET   1  -3.017  17.780   3.754
    7   1HG   MET   1          2HG       MET   1  -4.887  18.181   2.503
    8   2HG   MET   1          1HG       MET   1  -5.115  16.489   2.932
    9   1HE   MET   1          1HE       MET   1  -8.783  17.801   2.937
   10   2HE   MET   1          2HE       MET   1  -7.696  16.532   2.379
   11   3HE   MET   1          3HE       MET   1  -7.478  18.192   1.817
   12    H    SER   2           H        SER   2  -4.243  17.112   7.516
   13    HA   SER   2           HA       SER   2  -5.927  16.963   9.017
   14   1HB   SER   2          2HB       SER   2  -7.223  17.918   7.057
   15   2HB   SER   2          1HB       SER   2  -7.743  16.271   6.700
   16    HG   SER   2           HG       SER   2  -8.265  17.811   9.028
   17    H    LEU   3           H        LEU   3  -7.880  15.369   9.656
   18    HA   LEU   3           HA       LEU   3  -6.928  12.623   9.197
   19   1HB   LEU   3          2HB       LEU   3  -7.836  13.916  11.754
   20   2HB   LEU   3          1HB       LEU   3  -7.910  12.179  11.539
   21    HG   LEU   3           HG       LEU   3  -5.914  12.596  12.722
   22   1HD1  LEU   3          1HD1      LEU   3  -4.154  11.881  11.179
   23   2HD1  LEU   3          2HD1      LEU   3  -5.204  12.264   9.813
   24   3HD1  LEU   3          3HD1      LEU   3  -5.654  10.982  10.938
   25   1HD2  LEU   3          1HD2      LEU   3  -5.750  14.994  12.337
   26   2HD2  LEU   3          2HD2      LEU   3  -5.236  14.703  10.675
   27   3HD2  LEU   3          3HD2      LEU   3  -4.210  14.199  12.019
   28    H    ASP   4           H        ASP   4  -8.372  11.874   7.781
   29    HA   ASP   4           HA       ASP   4 -11.207  11.990   8.561
   30   1HB   ASP   4          2HB       ASP   4 -10.656  13.478   6.593
   31   2HB   ASP   4          1HB       ASP   4 -10.238  12.018   5.699
   32    HA   PRO   5           HA       PRO   5  -9.856   7.618   8.484
   33   1HB   PRO   5          2HB       PRO   5 -12.263   7.324  10.163
   34   2HB   PRO   5          1HB       PRO   5 -10.597   6.839  10.488
   35   1HG   PRO   5          2HG       PRO   5 -11.705   8.914  11.758
   36   2HG   PRO   5          1HG       PRO   5  -9.998   8.926  11.276
   37   1HD   PRO   5          2HD       PRO   5 -12.344  10.257   9.969
   38   2HD   PRO   5          1HD       PRO   5 -10.705  10.884  10.252
   39    H    GLN   6           H        GLN   6 -12.609   9.173   7.270
   40    HA   GLN   6           HA       GLN   6 -14.205   6.915   6.587
   41   1HB   GLN   6          2HB       GLN   6 -15.109   9.204   6.674
   42   2HB   GLN   6          1HB       GLN   6 -14.088   9.661   5.319
   43   1HG   GLN   6          2HG       GLN   6 -15.299   7.769   4.057
   44   2HG   GLN   6          1HG       GLN   6 -16.492   7.883   5.351
   45   1HE2  GLN   6          1HE2      GLN   6 -17.674   9.822   5.589
   46   2HE2  GLN   6          2HE2      GLN   6 -17.807  10.962   4.293
   47    H    LEU   7           H        LEU   7 -11.864   8.889   4.782
   48    HA   LEU   7           HA       LEU   7 -12.025   7.300   2.412
   49   1HB   LEU   7          2HB       LEU   7 -10.141   9.432   3.364
   50   2HB   LEU   7          1HB       LEU   7  -9.798   8.526   1.905
   51    HG   LEU   7           HG       LEU   7 -11.999   9.301   0.989
   52   1HD1  LEU   7          1HD1      LEU   7 -13.123   9.827   3.077
   53   2HD1  LEU   7          2HD1      LEU   7 -13.059  11.242   2.028
   54   3HD1  LEU   7          3HD1      LEU   7 -11.956  11.109   3.397
   55   1HD2  LEU   7          1HD2      LEU   7 -11.199  11.555   0.471
   56   2HD2  LEU   7          2HD2      LEU   7  -9.912  10.357   0.350
   57   3HD2  LEU   7          3HD2      LEU   7  -9.997  11.420   1.756
   58    H    LEU   8           H        LEU   8 -10.315   7.044   5.363
   59    HA   LEU   8           HA       LEU   8  -8.204   5.368   4.344
   60   1HB   LEU   8          2HB       LEU   8  -9.063   5.944   7.184
   61   2HB   LEU   8          1HB       LEU   8  -7.609   5.080   6.723
   62    HG   LEU   8           HG       LEU   8  -8.198   7.971   6.075
   63   1HD1  LEU   8          1HD1      LEU   8  -6.420   8.455   7.691
   64   2HD1  LEU   8          2HD1      LEU   8  -6.314   6.738   8.084
   65   3HD1  LEU   8          3HD1      LEU   8  -7.788   7.636   8.446
   66   1HD2  LEU   8          1HD2      LEU   8  -6.810   6.910   4.374
   67   2HD2  LEU   8          2HD2      LEU   8  -5.717   6.309   5.621
   68   3HD2  LEU   8          3HD2      LEU   8  -5.861   8.045   5.336
   69    H    GLU   9           H        GLU   9 -11.259   4.961   6.026
   70    HA   GLU   9           HA       GLU   9 -12.573   3.176   6.463
   71   1HB   GLU   9          2HB       GLU   9 -11.044   1.918   4.176
   72   2HB   GLU   9          1HB       GLU   9 -12.551   1.313   4.847
   73   1HG   GLU   9          2HG       GLU   9 -13.621   3.469   4.199
   74   2HG   GLU   9          1HG       GLU   9 -12.121   3.902   3.378
   75    H    VAL  10           H        VAL  10 -12.194   0.456   6.421
   76    HA   VAL  10           HA       VAL  10 -10.020   0.081   8.370
   77    HB   VAL  10           HB       VAL  10 -12.467  -1.650   7.961
   78   1HG1  VAL  10          1HG1      VAL  10 -10.551  -2.883   8.824
   79   2HG1  VAL  10          2HG1      VAL  10 -11.798  -2.713  10.060
   80   3HG1  VAL  10          3HG1      VAL  10 -10.357  -1.698  10.113
   81   1HG2  VAL  10          1HG2      VAL  10 -13.258  -0.727  10.097
   82   2HG2  VAL  10          2HG2      VAL  10 -13.104   0.520   8.859
   83   3HG2  VAL  10          3HG2      VAL  10 -11.881   0.374  10.119
   84    H    LEU  11           H        LEU  11  -8.279  -0.629   7.301
   85    HA   LEU  11           HA       LEU  11  -8.644  -2.624   5.177
   86   1HB   LEU  11          2HB       LEU  11  -6.276  -0.849   5.787
   87   2HB   LEU  11          1HB       LEU  11  -6.359  -2.005   4.470
   88    HG   LEU  11           HG       LEU  11  -8.117   0.435   4.770
   89   1HD1  LEU  11          1HD1      LEU  11  -6.876   1.303   2.856
   90   2HD1  LEU  11          2HD1      LEU  11  -5.836  -0.122   2.878
   91   3HD1  LEU  11          3HD1      LEU  11  -5.810   1.011   4.231
   92   1HD2  LEU  11          1HD2      LEU  11  -8.863  -0.103   2.500
   93   2HD2  LEU  11          2HD2      LEU  11  -9.269  -1.384   3.641
   94   3HD2  LEU  11          3HD2      LEU  11  -7.906  -1.585   2.541
   95    H    ALA  12           H        ALA  12  -8.200  -4.660   5.659
   96    HA   ALA  12           HA       ALA  12  -6.184  -5.237   7.706
   97   1HB   ALA  12          1HB       ALA  12  -8.914  -6.515   7.607
   98   2HB   ALA  12          2HB       ALA  12  -8.396  -5.301   8.778
   99   3HB   ALA  12          3HB       ALA  12  -7.625  -6.888   8.752
  100    H    CYS  13           H        CYS  13  -5.240  -7.300   7.569
  101    HA   CYS  13           HA       CYS  13  -4.913  -8.259   4.899
  102   1HB   CYS  13          2HB       CYS  13  -3.457  -9.991   6.135
  103   2HB   CYS  13          1HB       CYS  13  -2.972  -8.298   6.231
  104    HG   CYS  13           HG       CYS  13  -3.042 -10.168   8.702
  105    HA   PRO  14           HA       PRO  14  -8.038 -11.397   4.931
  106   1HB   PRO  14          2HB       PRO  14  -7.109 -12.962   2.925
  107   2HB   PRO  14          1HB       PRO  14  -7.851 -11.383   2.647
  108   1HG   PRO  14          2HG       PRO  14  -4.952 -12.122   2.752
  109   2HG   PRO  14          1HG       PRO  14  -5.792 -11.062   1.605
  110   1HD   PRO  14          2HD       PRO  14  -4.353 -10.104   3.691
  111   2HD   PRO  14          1HD       PRO  14  -5.790  -9.275   3.058
  112    H    LYS  15           H        LYS  15  -4.811 -12.007   5.832
  113    HA   LYS  15           HA       LYS  15  -5.148 -14.861   6.173
  114   1HB   LYS  15          2HB       LYS  15  -2.915 -12.992   6.945
  115   2HB   LYS  15          1HB       LYS  15  -2.905 -14.705   7.325
  116   1HG   LYS  15          2HG       LYS  15  -2.970 -13.494   4.569
  117   2HG   LYS  15          1HG       LYS  15  -1.573 -14.228   5.356
  118   1HD   LYS  15          2HD       LYS  15  -2.970 -16.342   5.531
  119   2HD   LYS  15          1HD       LYS  15  -4.101 -15.563   4.424
  120   1HE   LYS  15          2HE       LYS  15  -2.720 -16.846   3.039
  121   2HE   LYS  15          1HE       LYS  15  -2.083 -15.207   2.898
  122   1HZ   LYS  15          1HZ       LYS  15  -0.336 -16.887   3.169
  123   2HZ   LYS  15          2HZ       LYS  15  -0.979 -17.312   4.684
  124   3HZ   LYS  15          3HZ       LYS  15  -0.334 -15.765   4.446
  125    H    ASP  16           H        ASP  16  -3.867 -12.640   8.611
  126    HA   ASP  16           HA       ASP  16  -5.314 -14.151  10.644
  127   1HB   ASP  16          2HB       ASP  16  -3.797 -13.145  12.234
  128   2HB   ASP  16          1HB       ASP  16  -2.866 -13.743  10.866
  129    H    LYS  17           H        LYS  17  -5.786 -11.425   8.855
  130    HA   LYS  17           HA       LYS  17  -7.207  -9.678   8.913
  131   1HB   LYS  17          2HB       LYS  17  -8.800 -11.521   9.584
  132   2HB   LYS  17          1HB       LYS  17  -8.549 -11.030  11.255
  133   1HG   LYS  17          2HG       LYS  17 -10.566 -10.030  10.483
  134   2HG   LYS  17          1HG       LYS  17  -9.356  -8.755  10.636
  135   1HD   LYS  17          2HD       LYS  17 -10.508  -8.391   8.579
  136   2HD   LYS  17          1HD       LYS  17  -8.907  -9.019   8.178
  137   1HE   LYS  17          2HE       LYS  17 -10.545 -10.121   6.790
  138   2HE   LYS  17          1HE       LYS  17  -9.902 -11.284   7.949
  139   1HZ   LYS  17          1HZ       LYS  17 -11.873 -10.957   9.317
  140   2HZ   LYS  17          2HZ       LYS  17 -12.304 -11.468   7.758
  141   3HZ   LYS  17          3HZ       LYS  17 -12.491  -9.842   8.195
  142    H    GLY  18           H        GLY  18  -5.244  -8.567   9.657
  143   1HA   GLY  18          2HA       GLY  18  -5.823  -7.215  12.212
  144   2HA   GLY  18          1HA       GLY  18  -4.179  -7.654  11.761
  145    HA   PRO  19           HA       PRO  19  -5.704  -3.407  10.053
  146   1HB   PRO  19          2HB       PRO  19  -3.874  -2.308  12.098
  147   2HB   PRO  19          1HB       PRO  19  -5.493  -1.775  11.633
  148   1HG   PRO  19          2HG       PRO  19  -5.069  -3.034  13.949
  149   2HG   PRO  19          1HG       PRO  19  -6.541  -3.319  13.000
  150   1HD   PRO  19          2HD       PRO  19  -4.083  -5.013  13.245
  151   2HD   PRO  19          1HD       PRO  19  -5.791  -5.503  13.193
  152    H    LEU  20           H        LEU  20  -4.607  -2.863   8.304
  153    HA   LEU  20           HA       LEU  20  -1.859  -3.674   7.983
  154   1HB   LEU  20          2HB       LEU  20  -3.729  -2.202   6.123
  155   2HB   LEU  20          1HB       LEU  20  -2.129  -2.774   5.687
  156    HG   LEU  20           HG       LEU  20  -4.439  -4.539   6.516
  157   1HD1  LEU  20          1HD1      LEU  20  -4.470  -5.220   4.165
  158   2HD1  LEU  20          2HD1      LEU  20  -3.236  -4.015   3.802
  159   3HD1  LEU  20          3HD1      LEU  20  -4.830  -3.503   4.353
  160   1HD2  LEU  20          1HD2      LEU  20  -3.026  -6.382   5.833
  161   2HD2  LEU  20          2HD2      LEU  20  -2.217  -5.442   7.090
  162   3HD2  LEU  20          3HD2      LEU  20  -1.732  -5.265   5.403
  163    H    ARG  21           H        ARG  21  -0.085  -2.375   7.709
  164    HA   ARG  21           HA       ARG  21  -0.313   0.355   8.689
  165   1HB   ARG  21          2HB       ARG  21   1.489  -1.006   9.598
  166   2HB   ARG  21          1HB       ARG  21   2.092  -1.344   7.981
  167   1HG   ARG  21          2HG       ARG  21   2.593   1.056   7.700
  168   2HG   ARG  21          1HG       ARG  21   2.056   1.333   9.358
  169   1HD   ARG  21          2HD       ARG  21   3.811  -0.084  10.212
  170   2HD   ARG  21          1HD       ARG  21   4.299  -0.526   8.576
  171    HE   ARG  21           HE       ARG  21   4.379   2.306   9.202
  172   1HH1  ARG  21          1HH1      ARG  21   6.177  -0.697   9.066
  173   2HH1  ARG  21          2HH1      ARG  21   7.717   0.080   8.929
  174   1HH2  ARG  21          1HH2      ARG  21   6.388   3.333   9.025
  175   2HH2  ARG  21          2HH2      ARG  21   7.844   2.383   8.876
  176    H    TYR  22           H        TYR  22  -0.551   2.001   7.346
  177    HA   TYR  22           HA       TYR  22  -0.278   1.500   4.489
  178   1HB   TYR  22          2HB       TYR  22  -2.377   2.440   5.199
  179   2HB   TYR  22          1HB       TYR  22  -1.564   3.751   6.043
  180    HD1  TYR  22           1HD      TYR  22  -1.209   2.362   2.576
  181    HD2  TYR  22           2HD      TYR  22  -2.057   5.746   5.013
  182    HE1  TYR  22           1HE      TYR  22  -1.379   3.766   0.562
  183    HE2  TYR  22           2HE      TYR  22  -2.231   7.153   3.007
  184    HH   TYR  22           HH       TYR  22  -2.371   5.847  -0.153
  185    H    LEU  23           H        LEU  23   1.601   1.884   3.602
  186    HA   LEU  23           HA       LEU  23   3.350   3.995   4.542
  187   1HB   LEU  23          2HB       LEU  23   4.274   1.863   3.703
  188   2HB   LEU  23          1HB       LEU  23   3.570   2.182   2.130
  189    HG   LEU  23           HG       LEU  23   5.015   4.189   1.927
  190   1HD1  LEU  23          1HD1      LEU  23   6.231   3.162   4.485
  191   2HD1  LEU  23          2HD1      LEU  23   5.364   4.684   4.271
  192   3HD1  LEU  23          3HD1      LEU  23   6.913   4.430   3.468
  193   1HD2  LEU  23          1HD2      LEU  23   6.454   1.595   2.443
  194   2HD2  LEU  23          2HD2      LEU  23   7.100   2.964   1.540
  195   3HD2  LEU  23          3HD2      LEU  23   5.697   2.086   0.928
  196    H    GLU  24           H        GLU  24   2.676   5.993   4.108
  197    HA   GLU  24           HA       GLU  24   0.887   6.595   1.962
  198   1HB   GLU  24          2HB       GLU  24   2.430   8.523   3.706
  199   2HB   GLU  24          1HB       GLU  24   0.950   8.851   2.814
  200   1HG   GLU  24          2HG       GLU  24  -0.279   7.317   4.237
  201   2HG   GLU  24          1HG       GLU  24   1.201   6.915   5.106
  202    H    SER  25           H        SER  25   4.299   6.679   2.421
  203    HA   SER  25           HA       SER  25   5.042   8.604   0.537
  204   1HB   SER  25          2HB       SER  25   6.643   6.142   1.237
  205   2HB   SER  25          1HB       SER  25   7.247   7.731   0.764
  206    HG   SER  25           HG       SER  25   7.255   8.191   2.807
  207    H    GLU  26           H        GLU  26   4.652   5.068   0.145
  208    HA   GLU  26           HA       GLU  26   4.955   5.492  -2.754
  209   1HB   GLU  26          2HB       GLU  26   6.131   3.241  -1.119
  210   2HB   GLU  26          1HB       GLU  26   6.194   3.358  -2.872
  211   1HG   GLU  26          2HG       GLU  26   7.446   5.480  -2.640
  212   2HG   GLU  26          1HG       GLU  26   7.459   5.238  -0.894
  213    H    GLN  27           H        GLN  27   2.632   4.941  -0.802
  214    HA   GLN  27           HA       GLN  27   0.628   3.870  -0.851
  215   1HB   GLN  27          2HB       GLN  27   1.418   3.409  -3.732
  216   2HB   GLN  27          1HB       GLN  27  -0.188   3.127  -3.079
  217   1HG   GLN  27          2HG       GLN  27   1.195   5.798  -3.061
  218   2HG   GLN  27          1HG       GLN  27   0.065   5.270  -4.307
  219   1HE2  GLN  27          1HE2      GLN  27  -0.098   7.516  -2.436
  220   2HE2  GLN  27          2HE2      GLN  27  -1.579   7.292  -1.568
  221    H    LEU  28           H        LEU  28   1.743   2.275   0.589
  222    HA   LEU  28           HA       LEU  28   1.459  -0.402  -0.569
  223   1HB   LEU  28          2HB       LEU  28   3.795   0.547   1.090
  224   2HB   LEU  28          1HB       LEU  28   3.436  -1.145   0.803
  225    HG   LEU  28           HG       LEU  28   4.112   0.874  -1.340
  226   1HD1  LEU  28          1HD1      LEU  28   6.033   0.401   0.069
  227   2HD1  LEU  28          2HD1      LEU  28   6.225  -0.369  -1.508
  228   3HD1  LEU  28          3HD1      LEU  28   5.756  -1.332  -0.107
  229   1HD2  LEU  28          1HD2      LEU  28   4.283  -1.089  -2.796
  230   2HD2  LEU  28          2HD2      LEU  28   2.652  -0.900  -2.151
  231   3HD2  LEU  28          3HD2      LEU  28   3.734  -2.117  -1.472
  232    H    LEU  29           H        LEU  29   0.539  -1.886   0.778
  233    HA   LEU  29           HA       LEU  29  -0.114  -0.983   3.507
  234   1HB   LEU  29          2HB       LEU  29  -1.536  -2.980   1.734
  235   2HB   LEU  29          1HB       LEU  29  -1.961  -2.652   3.403
  236    HG   LEU  29           HG       LEU  29  -2.071  -0.616   1.177
  237   1HD1  LEU  29          1HD1      LEU  29  -3.714  -2.439   0.920
  238   2HD1  LEU  29          2HD1      LEU  29  -4.472  -0.888   1.281
  239   3HD1  LEU  29          3HD1      LEU  29  -4.307  -2.104   2.548
  240   1HD2  LEU  29          1HD2      LEU  29  -3.335   0.705   2.829
  241   2HD2  LEU  29          2HD2      LEU  29  -1.680   0.389   3.356
  242   3HD2  LEU  29          3HD2      LEU  29  -3.017  -0.536   4.043
  243    H    VAL  30           H        VAL  30   1.246  -1.873   4.932
  244    HA   VAL  30           HA       VAL  30   2.239  -4.599   4.365
  245    HB   VAL  30           HB       VAL  30   3.666  -2.454   5.954
  246   1HG1  VAL  30          1HG1      VAL  30   4.237  -4.744   6.606
  247   2HG1  VAL  30          2HG1      VAL  30   5.592  -3.941   5.812
  248   3HG1  VAL  30          3HG1      VAL  30   4.627  -5.124   4.930
  249   1HG2  VAL  30          1HG2      VAL  30   4.219  -3.389   3.138
  250   2HG2  VAL  30          2HG2      VAL  30   5.157  -2.207   4.052
  251   3HG2  VAL  30          3HG2      VAL  30   3.498  -1.840   3.579
  252    H    ASN  31           H        ASN  31   1.944  -6.140   5.894
  253    HA   ASN  31           HA       ASN  31   0.966  -5.209   8.520
  254   1HB   ASN  31          2HB       ASN  31  -0.684  -6.579   7.332
  255   2HB   ASN  31          1HB       ASN  31   0.498  -7.874   7.170
  256   1HD2  ASN  31          1HD2      ASN  31  -0.856  -9.297   8.277
  257   2HD2  ASN  31          2HD2      ASN  31  -1.076  -9.211   9.987
  258    H    GLU  32           H        GLU  32   2.431  -5.317  10.055
  259    HA   GLU  32           HA       GLU  32   4.883  -6.748   9.732
  260   1HB   GLU  32          2HB       GLU  32   3.785  -5.402  12.204
  261   2HB   GLU  32          1HB       GLU  32   5.452  -5.885  11.938
  262   1HG   GLU  32          2HG       GLU  32   5.622  -4.280  10.100
  263   2HG   GLU  32          1HG       GLU  32   3.952  -3.791  10.382
  264    H    ARG  33           H        ARG  33   1.819  -7.545  10.954
  265    HA   ARG  33           HA       ARG  33   2.586  -9.501  12.874
  266   1HB   ARG  33          2HB       ARG  33   0.003  -9.280  11.312
  267   2HB   ARG  33          1HB       ARG  33   0.249 -10.203  12.788
  268   1HG   ARG  33          2HG       ARG  33   0.532  -8.225  14.076
  269   2HG   ARG  33          1HG       ARG  33   0.608  -7.222  12.628
  270   1HD   ARG  33          2HD       ARG  33  -1.565  -6.975  13.649
  271   2HD   ARG  33          1HD       ARG  33  -1.736  -7.840  12.123
  272    HE   ARG  33           HE       ARG  33  -2.207  -9.820  13.307
  273   1HH1  ARG  33          1HH1      ARG  33  -1.864  -6.998  15.374
  274   2HH1  ARG  33          2HH1      ARG  33  -2.496  -7.798  16.786
  275   1HH2  ARG  33          1HH2      ARG  33  -3.072 -10.856  15.170
  276   2HH2  ARG  33          2HH2      ARG  33  -3.197  -9.976  16.661
  277    H    LEU  34           H        LEU  34   2.494  -9.445   9.450
  278    HA   LEU  34           HA       LEU  34   2.864 -12.372   9.354
  279   1HB   LEU  34          2HB       LEU  34   1.683 -10.599   7.213
  280   2HB   LEU  34          1HB       LEU  34   1.921 -12.331   7.092
  281    HG   LEU  34           HG       LEU  34   0.081 -11.016   9.088
  282   1HD1  LEU  34          1HD1      LEU  34  -0.566 -12.369   6.474
  283   2HD1  LEU  34          2HD1      LEU  34  -0.642 -10.634   6.773
  284   3HD1  LEU  34          3HD1      LEU  34  -1.728 -11.726   7.635
  285   1HD2  LEU  34          1HD2      LEU  34   0.908 -13.215   9.773
  286   2HD2  LEU  34          2HD2      LEU  34   0.404 -13.890   8.223
  287   3HD2  LEU  34          3HD2      LEU  34  -0.805 -13.282   9.353
  288    H    ASN  35           H        ASN  35   4.197  -9.320   8.741
  289    HA   ASN  35           HA       ASN  35   6.042  -8.534   7.690
  290   1HB   ASN  35          2HB       ASN  35   6.771 -11.467   7.680
  291   2HB   ASN  35          1HB       ASN  35   7.833 -10.222   7.021
  292   1HD2  ASN  35          1HD2      ASN  35   8.844  -8.787   8.402
  293   2HD2  ASN  35          2HD2      ASN  35   8.908  -9.040  10.112
  294    H    LEU  36           H        LEU  36   3.615  -9.205   6.272
  295    HA   LEU  36           HA       LEU  36   4.702  -9.588   3.561
  296   1HB   LEU  36          2HB       LEU  36   1.960 -10.306   4.609
  297   2HB   LEU  36          1HB       LEU  36   2.449 -10.412   2.928
  298    HG   LEU  36           HG       LEU  36   3.638 -12.018   5.195
  299   1HD1  LEU  36          1HD1      LEU  36   1.337 -12.669   4.667
  300   2HD1  LEU  36          2HD1      LEU  36   2.493 -13.909   4.179
  301   3HD1  LEU  36          3HD1      LEU  36   1.781 -12.841   2.968
  302   1HD2  LEU  36          1HD2      LEU  36   4.095 -12.170   2.215
  303   2HD2  LEU  36          2HD2      LEU  36   4.763 -13.269   3.421
  304   3HD2  LEU  36          3HD2      LEU  36   5.249 -11.575   3.407
  305    H    ALA  37           H        ALA  37   3.943  -8.231   1.948
  306    HA   ALA  37           HA       ALA  37   2.390  -5.903   2.871
  307   1HB   ALA  37          1HB       ALA  37   4.754  -5.345   2.533
  308   2HB   ALA  37          2HB       ALA  37   3.713  -4.507   1.381
  309   3HB   ALA  37          3HB       ALA  37   4.644  -5.916   0.868
  310    H    TYR  38           H        TYR  38   0.815  -5.163   1.587
  311    HA   TYR  38           HA       TYR  38   0.234  -6.682  -0.861
  312   1HB   TYR  38          2HB       TYR  38  -1.668  -5.077   0.867
  313   2HB   TYR  38          1HB       TYR  38  -2.106  -6.059  -0.529
  314    HD1  TYR  38           1HD      TYR  38  -1.378  -6.054   3.016
  315    HD2  TYR  38           2HD      TYR  38  -1.881  -8.548  -0.396
  316    HE1  TYR  38           1HE      TYR  38  -1.662  -8.001   4.488
  317    HE2  TYR  38           2HE      TYR  38  -2.166 -10.503   1.071
  318    HH   TYR  38           HH       TYR  38  -1.524 -11.180   3.377
  319    H    ARG  39           H        ARG  39  -0.389  -5.518  -2.721
  320    HA   ARG  39           HA       ARG  39   1.054  -2.992  -2.835
  321   1HB   ARG  39          2HB       ARG  39  -0.079  -4.677  -5.074
  322   2HB   ARG  39          1HB       ARG  39   1.012  -3.308  -5.252
  323   1HG   ARG  39          2HG       ARG  39   2.796  -4.498  -4.226
  324   2HG   ARG  39          1HG       ARG  39   1.717  -5.813  -3.747
  325   1HD   ARG  39          2HD       ARG  39   1.300  -6.303  -6.121
  326   2HD   ARG  39          1HD       ARG  39   2.428  -5.025  -6.570
  327    HE   ARG  39           HE       ARG  39   4.150  -6.376  -5.375
  328   1HH1  ARG  39          1HH1      ARG  39   1.265  -7.913  -6.652
  329   2HH1  ARG  39          2HH1      ARG  39   2.039  -9.455  -6.858
  330   1HH2  ARG  39          1HH2      ARG  39   5.151  -8.392  -5.629
  331   2HH2  ARG  39          2HH2      ARG  39   4.232  -9.746  -6.229
  332    H    ILE  40           H        ILE  40   0.146  -1.048  -3.252
  333    HA   ILE  40           HA       ILE  40  -2.687  -0.972  -4.025
  334    HB   ILE  40           HB       ILE  40  -0.878   1.291  -3.139
  335   1HG1  ILE  40          2HG1      ILE  40  -3.121  -0.109  -1.664
  336   2HG1  ILE  40          1HG1      ILE  40  -1.404  -0.298  -1.328
  337   1HG2  ILE  40          1HG2      ILE  40  -2.614   2.045  -4.672
  338   2HG2  ILE  40          2HG2      ILE  40  -2.941   2.623  -3.039
  339   3HG2  ILE  40          3HG2      ILE  40  -3.845   1.256  -3.688
  340   1HD1  ILE  40          1HD1      ILE  40  -2.990   2.244  -1.036
  341   2HD1  ILE  40          2HD1      ILE  40  -1.270   2.057  -0.701
  342   3HD1  ILE  40          3HD1      ILE  40  -2.455   1.192   0.275
  343    H    ASP  41           H        ASP  41  -3.004  -0.921  -6.160
  344    HA   ASP  41           HA       ASP  41  -0.789   0.108  -7.815
  345   1HB   ASP  41          2HB       ASP  41  -1.039  -2.367  -7.863
  346   2HB   ASP  41          1HB       ASP  41  -2.668  -2.162  -8.497
  347    H    ASP  42           H        ASP  42  -1.405   2.016  -8.463
  348    HA   ASP  42           HA       ASP  42  -2.543   3.701  -9.449
  349   1HB   ASP  42          2HB       ASP  42  -2.361   2.122 -11.372
  350   2HB   ASP  42          1HB       ASP  42  -3.957   1.502 -10.966
  351    H    GLY  43           H        GLY  43  -3.494   3.759  -7.175
  352   1HA   GLY  43          2HA       GLY  43  -5.300   4.676  -6.074
  353   2HA   GLY  43          1HA       GLY  43  -6.236   4.499  -7.546
  354    H    ILE  44           H        ILE  44  -5.196   1.472  -7.153
  355    HA   ILE  44           HA       ILE  44  -7.453   0.791  -5.386
  356    HB   ILE  44           HB       ILE  44  -6.578  -0.681  -7.879
  357   1HG1  ILE  44          2HG1      ILE  44  -9.128   0.821  -7.236
  358   2HG1  ILE  44          1HG1      ILE  44  -7.856   1.379  -8.315
  359   1HG2  ILE  44          1HG2      ILE  44  -8.783  -1.335  -5.926
  360   2HG2  ILE  44          2HG2      ILE  44  -7.287  -2.243  -6.149
  361   3HG2  ILE  44          3HG2      ILE  44  -8.477  -2.170  -7.448
  362   1HD1  ILE  44          1HD1      ILE  44  -9.721   0.500  -9.572
  363   2HD1  ILE  44          2HD1      ILE  44  -9.596  -1.041  -8.720
  364   3HD1  ILE  44          3HD1      ILE  44  -8.298  -0.519  -9.795
  365    HA   PRO  45           HA       PRO  45  -4.199  -1.454  -3.209
  366   1HB   PRO  45          2HB       PRO  45  -6.318  -1.930  -1.251
  367   2HB   PRO  45          1HB       PRO  45  -4.800  -1.048  -1.056
  368   1HG   PRO  45          2HG       PRO  45  -7.209   0.186  -1.068
  369   2HG   PRO  45          1HG       PRO  45  -5.734   0.964  -1.673
  370   1HD   PRO  45          2HD       PRO  45  -7.953  -0.349  -3.204
  371   2HD   PRO  45          1HD       PRO  45  -7.074   1.155  -3.560
  372    H    VAL  46           H        VAL  46  -3.798  -3.483  -3.854
  373    HA   VAL  46           HA       VAL  46  -6.058  -5.220  -4.498
  374    HB   VAL  46           HB       VAL  46  -3.128  -5.705  -5.037
  375   1HG1  VAL  46          1HG1      VAL  46  -3.945  -7.297  -6.701
  376   2HG1  VAL  46          2HG1      VAL  46  -5.607  -6.939  -6.227
  377   3HG1  VAL  46          3HG1      VAL  46  -4.509  -7.710  -5.080
  378   1HG2  VAL  46          1HG2      VAL  46  -3.561  -4.933  -7.319
  379   2HG2  VAL  46          2HG2      VAL  46  -3.840  -3.651  -6.140
  380   3HG2  VAL  46          3HG2      VAL  46  -5.209  -4.499  -6.860
  381    H    LEU  47           H        LEU  47  -6.758  -6.013  -2.567
  382    HA   LEU  47           HA       LEU  47  -4.850  -7.236  -0.737
  383   1HB   LEU  47          2HB       LEU  47  -7.855  -6.963  -0.540
  384   2HB   LEU  47          1HB       LEU  47  -6.806  -7.586   0.718
  385    HG   LEU  47           HG       LEU  47  -6.790  -4.760  -0.348
  386   1HD1  LEU  47          1HD1      LEU  47  -7.707  -5.877   2.300
  387   2HD1  LEU  47          2HD1      LEU  47  -8.748  -5.262   1.016
  388   3HD1  LEU  47          3HD1      LEU  47  -7.649  -4.171   1.860
  389   1HD2  LEU  47          1HD2      LEU  47  -4.561  -5.488   0.322
  390   2HD2  LEU  47          2HD2      LEU  47  -5.191  -6.025   1.879
  391   3HD2  LEU  47          3HD2      LEU  47  -5.207  -4.310   1.465
  392    H    LEU  48           H        LEU  48  -4.150  -8.972  -1.971
  393    HA   LEU  48           HA       LEU  48  -6.057 -11.199  -2.069
  394   1HB   LEU  48          2HB       LEU  48  -4.059 -10.458  -4.217
  395   2HB   LEU  48          1HB       LEU  48  -4.910 -11.988  -4.153
  396    HG   LEU  48           HG       LEU  48  -6.199  -9.281  -4.502
  397   1HD1  LEU  48          1HD1      LEU  48  -5.806 -11.535  -6.466
  398   2HD1  LEU  48          2HD1      LEU  48  -4.914 -10.014  -6.458
  399   3HD1  LEU  48          3HD1      LEU  48  -6.649 -10.017  -6.774
  400   1HD2  LEU  48          1HD2      LEU  48  -8.241 -10.559  -4.945
  401   2HD2  LEU  48          2HD2      LEU  48  -7.652 -10.825  -3.305
  402   3HD2  LEU  48          3HD2      LEU  48  -7.390 -12.051  -4.544
  403    H    ILE  49           H        ILE  49  -4.927 -13.322  -2.133
  404    HA   ILE  49           HA       ILE  49  -2.837 -13.332  -0.155
  405    HB   ILE  49           HB       ILE  49  -4.075 -15.628  -1.684
  406   1HG1  ILE  49          2HG1      ILE  49  -4.619 -14.583   1.103
  407   2HG1  ILE  49          1HG1      ILE  49  -5.682 -14.400  -0.287
  408   1HG2  ILE  49          1HG2      ILE  49  -2.339 -15.670   0.787
  409   2HG2  ILE  49          2HG2      ILE  49  -1.852 -16.182  -0.830
  410   3HG2  ILE  49          3HG2      ILE  49  -3.109 -17.069   0.034
  411   1HD1  ILE  49          1HD1      ILE  49  -5.965 -16.825  -0.387
  412   2HD1  ILE  49          2HD1      ILE  49  -6.458 -16.171   1.175
  413   3HD1  ILE  49          3HD1      ILE  49  -4.911 -17.002   1.014
  414    H    ASP  50           H        ASP  50  -3.135 -13.977  -3.595
  415    HA   ASP  50           HA       ASP  50  -0.469 -14.981  -3.894
  416   1HB   ASP  50          2HB       ASP  50  -2.535 -14.090  -5.914
  417   2HB   ASP  50          1HB       ASP  50  -0.955 -14.730  -6.360
  418    H    GLU  51           H        GLU  51  -1.846 -11.866  -3.729
  419    HA   GLU  51           HA       GLU  51   0.332 -10.568  -5.143
  420   1HB   GLU  51          2HB       GLU  51  -2.109  -9.526  -3.717
  421   2HB   GLU  51          1HB       GLU  51  -0.863  -8.462  -4.355
  422   1HG   GLU  51          2HG       GLU  51  -2.454 -10.432  -5.978
  423   2HG   GLU  51          1HG       GLU  51  -2.782  -8.702  -5.865
  424    H    ALA  52           H        ALA  52  -0.117 -11.822  -2.110
  425    HA   ALA  52           HA       ALA  52   1.046  -9.834  -0.468
  426   1HB   ALA  52          1HB       ALA  52   0.979 -12.820  -0.061
  427   2HB   ALA  52          2HB       ALA  52  -0.273 -11.685   0.445
  428   3HB   ALA  52          3HB       ALA  52   1.331 -11.611   1.175
  429    H    THR  53           H        THR  53   3.036  -9.090  -0.592
  430    HA   THR  53           HA       THR  53   5.169 -10.846  -1.611
  431    HB   THR  53           HB       THR  53   5.387  -7.862  -1.273
  432    HG1  THR  53           1HG      THR  53   3.567  -8.909  -2.751
  433   1HG2  THR  53          1HG2      THR  53   7.439  -9.142  -1.714
  434   2HG2  THR  53          2HG2      THR  53   7.038  -8.073  -3.058
  435   3HG2  THR  53          3HG2      THR  53   6.707  -9.802  -3.174
  436    H    GLU  54           H        GLU  54   7.139 -10.976  -0.449
  437    HA   GLU  54           HA       GLU  54   6.905 -10.719   2.398
  438   1HB   GLU  54          2HB       GLU  54   9.381 -11.325   0.762
  439   2HB   GLU  54          1HB       GLU  54   9.147 -11.648   2.475
  440   1HG   GLU  54          2HG       GLU  54   7.446 -13.290   1.965
  441   2HG   GLU  54          1HG       GLU  54   7.582 -12.929   0.245
  442    H    TRP  55           H        TRP  55   7.437  -8.984   3.600
  443    HA   TRP  55           HA       TRP  55   9.177  -6.947   2.398
  444   1HB   TRP  55          2HB       TRP  55   6.767  -6.374   2.008
  445   2HB   TRP  55          1HB       TRP  55   6.550  -6.312   3.753
  446    HD1  TRP  55           HD       TRP  55   7.436  -4.167   5.019
  447    HE1  TRP  55           1HE      TRP  55   8.294  -1.873   4.212
  448    HE3  TRP  55           3HE      TRP  55   8.115  -5.260   0.068
  449    HZ2  TRP  55           2HZ      TRP  55   9.138  -0.694   1.790
  450    HZ3  TRP  55           3HZ      TRP  55   8.951  -3.491  -1.425
  451    HH2  TRP  55           HH       TRP  55   9.450  -1.258  -0.580
  452    H    THR  56           H        THR  56  10.710  -6.360   3.729
  453    HA   THR  56           HA       THR  56  11.956  -6.008   5.568
  454    HB   THR  56           HB       THR  56   9.279  -5.653   6.903
  455    HG1  THR  56           1HG      THR  56   9.380  -3.939   5.642
  456   1HG2  THR  56          1HG2      THR  56  10.503  -4.411   8.635
  457   2HG2  THR  56          2HG2      THR  56  12.028  -4.845   7.862
  458   3HG2  THR  56          3HG2      THR  56  11.013  -6.100   8.575
  459    HA   PRO  57           HA       PRO  57  11.723 -10.192   7.323
  460   1HB   PRO  57          2HB       PRO  57  14.123 -11.036   6.513
  461   2HB   PRO  57          1HB       PRO  57  12.738 -11.032   5.417
  462   1HG   PRO  57          2HG       PRO  57  15.040  -9.144   5.565
  463   2HG   PRO  57          1HG       PRO  57  14.164  -9.742   4.145
  464   1HD   PRO  57          2HD       PRO  57  13.770  -7.272   5.400
  465   2HD   PRO  57          1HD       PRO  57  12.664  -8.043   4.247
  466    H    ASN  58           H        ASN  58  13.013 -11.065   9.071
  467    HA   ASN  58           HA       ASN  58  14.061  -9.144  10.848
  468   1HB   ASN  58          2HB       ASN  58  14.362 -12.159  10.825
  469   2HB   ASN  58          1HB       ASN  58  14.870 -11.123  12.156
  470   1HD2  ASN  58          1HD2      ASN  58  13.358 -10.237  13.514
  471   2HD2  ASN  58          2HD2      ASN  58  11.688 -10.714  13.486
  472    H    ASN  59           H        ASN  59  16.178  -8.627  11.404
  473    HA   ASN  59           HA       ASN  59  18.067  -8.882   9.230
  474   1HB   ASN  59          2HB       ASN  59  17.625  -6.781  10.605
  475   2HB   ASN  59          1HB       ASN  59  18.525  -7.551  11.905
  476   1HD2  ASN  59          1HD2      ASN  59  18.709  -6.187   8.708
  477   2HD2  ASN  59          2HD2      ASN  59  20.426  -5.975   8.678
  478    H    LEU  60           H        LEU  60  17.651 -11.357  10.115
  479    HA   LEU  60           HA       LEU  60  18.467 -13.238  11.081
  480   1HB   LEU  60          2HB       LEU  60  20.134 -12.630   9.298
  481   2HB   LEU  60          1HB       LEU  60  21.122 -11.902  10.550
  482    HG   LEU  60           HG       LEU  60  21.265 -14.108  11.668
  483   1HD1  LEU  60          1HD1      LEU  60  20.607 -16.113  10.406
  484   2HD1  LEU  60          2HD1      LEU  60  19.853 -15.081   9.191
  485   3HD1  LEU  60          3HD1      LEU  60  19.223 -15.109  10.838
  486   1HD2  LEU  60          1HD2      LEU  60  23.027 -13.330  10.142
  487   2HD2  LEU  60          2HD2      LEU  60  22.185 -14.094   8.794
  488   3HD2  LEU  60          3HD2      LEU  60  22.847 -15.083  10.095
  489    H    GLU  61           H        GLU  61  17.550 -12.104  13.098
  490    HA   GLU  61           HA       GLU  61  19.431 -10.960  14.930
  491   1HB   GLU  61          2HB       GLU  61  16.526 -11.701  15.294
  492   2HB   GLU  61          1HB       GLU  61  17.480 -10.738  16.417
  493   1HG   GLU  61          2HG       GLU  61  17.748  -9.000  14.772
  494   2HG   GLU  61          1HG       GLU  61  16.930  -9.980  13.556
  Start of MODEL   11
    1   1H    MET   1          1HT       MET   1  -3.031  18.738   1.908
    2   2H    MET   1          2HT       MET   1  -3.739  17.503   0.985
    3   3H    MET   1          3HT       MET   1  -2.059  17.663   1.030
    4    HA   MET   1           HA       MET   1  -2.735  15.832   2.413
    5   1HB   MET   1          2HB       MET   1  -1.861  18.239   4.031
    6   2HB   MET   1          1HB       MET   1  -1.716  16.564   4.544
    7   1HG   MET   1          2HG       MET   1  -0.351  17.788   2.156
    8   2HG   MET   1          1HG       MET   1   0.400  17.478   3.720
    9   1HE   MET   1          1HE       MET   1   1.511  16.444   0.865
   10   2HE   MET   1          2HE       MET   1   2.044  14.828   1.325
   11   3HE   MET   1          3HE       MET   1   2.333  16.193   2.403
   12    H    SER   2           H        SER   2  -4.585  14.989   3.119
   13    HA   SER   2           HA       SER   2  -6.328  16.615   4.835
   14   1HB   SER   2          2HB       SER   2  -7.510  14.983   2.594
   15   2HB   SER   2          1HB       SER   2  -8.246  16.297   3.511
   16    HG   SER   2           HG       SER   2  -6.798  17.740   2.459
   17    H    LEU   3           H        LEU   3  -7.430  15.419   6.379
   18    HA   LEU   3           HA       LEU   3  -6.788  12.594   6.589
   19   1HB   LEU   3          2HB       LEU   3  -7.012  14.351   8.515
   20   2HB   LEU   3          1HB       LEU   3  -8.730  14.050   8.360
   21    HG   LEU   3           HG       LEU   3  -7.684  12.754  10.184
   22   1HD1  LEU   3          1HD1      LEU   3  -8.724  11.051   7.927
   23   2HD1  LEU   3          2HD1      LEU   3  -9.700  11.888   9.136
   24   3HD1  LEU   3          3HD1      LEU   3  -8.628  10.573   9.623
   25   1HD2  LEU   3          1HD2      LEU   3  -5.479  12.444   9.178
   26   2HD2  LEU   3          2HD2      LEU   3  -6.180  11.369   7.966
   27   3HD2  LEU   3          3HD2      LEU   3  -6.184  10.902   9.667
   28    H    ASP   4           H        ASP   4  -7.829  11.567   4.948
   29    HA   ASP   4           HA       ASP   4 -10.728  12.001   4.703
   30   1HB   ASP   4          2HB       ASP   4  -9.352  12.933   2.812
   31   2HB   ASP   4          1HB       ASP   4  -8.880  11.281   2.427
   32    HA   PRO   5           HA       PRO   5 -10.275   7.610   5.986
   33   1HB   PRO   5          2HB       PRO   5 -13.193   8.060   6.329
   34   2HB   PRO   5          1HB       PRO   5 -12.026   7.333   7.437
   35   1HG   PRO   5          2HG       PRO   5 -12.961   9.787   7.872
   36   2HG   PRO   5          1HG       PRO   5 -11.259   9.390   8.192
   37   1HD   PRO   5          2HD       PRO   5 -12.463  10.873   5.892
   38   2HD   PRO   5          1HD       PRO   5 -10.947  11.181   6.764
   39    H    GLN   6           H        GLN   6 -12.336   9.165   3.642
   40    HA   GLN   6           HA       GLN   6 -13.574   6.869   2.553
   41   1HB   GLN   6          2HB       GLN   6 -13.063   9.643   1.530
   42   2HB   GLN   6          1HB       GLN   6 -13.694   8.415   0.447
   43   1HG   GLN   6          2HG       GLN   6 -15.437   9.844   1.413
   44   2HG   GLN   6          1HG       GLN   6 -15.650   8.142   1.814
   45   1HE2  GLN   6          1HE2      GLN   6 -15.459   7.478   3.928
   46   2HE2  GLN   6          2HE2      GLN   6 -15.404   8.592   5.251
   47    H    LEU   7           H        LEU   7 -10.669   8.671   1.599
   48    HA   LEU   7           HA       LEU   7 -10.006   6.762  -0.459
   49   1HB   LEU   7          2HB       LEU   7  -8.455   9.083   0.687
   50   2HB   LEU   7          1HB       LEU   7  -7.935   8.120  -0.683
   51    HG   LEU   7           HG       LEU   7 -10.447   9.797  -0.599
   52   1HD1  LEU   7          1HD1      LEU   7  -9.265  11.271  -2.146
   53   2HD1  LEU   7          2HD1      LEU   7  -7.815  10.279  -1.985
   54   3HD1  LEU   7          3HD1      LEU   7  -8.431  11.169  -0.594
   55   1HD2  LEU   7          1HD2      LEU   7 -10.576   9.334  -2.985
   56   2HD2  LEU   7          2HD2      LEU   7 -10.624   7.833  -2.060
   57   3HD2  LEU   7          3HD2      LEU   7  -9.140   8.319  -2.880
   58    H    LEU   8           H        LEU   8  -9.850   6.514   2.777
   59    HA   LEU   8           HA       LEU   8  -7.264   5.122   2.773
   60   1HB   LEU   8          2HB       LEU   8  -8.895   6.182   5.078
   61   2HB   LEU   8          1HB       LEU   8  -7.413   5.262   5.253
   62    HG   LEU   8           HG       LEU   8  -7.657   7.962   3.926
   63   1HD1  LEU   8          1HD1      LEU   8  -6.425   7.166   6.560
   64   2HD1  LEU   8          2HD1      LEU   8  -7.935   8.052   6.353
   65   3HD1  LEU   8          3HD1      LEU   8  -6.409   8.781   5.852
   66   1HD2  LEU   8          1HD2      LEU   8  -5.213   6.290   4.515
   67   2HD2  LEU   8          2HD2      LEU   8  -5.224   7.918   3.835
   68   3HD2  LEU   8          3HD2      LEU   8  -5.908   6.576   2.917
   69    H    GLU   9           H        GLU   9 -10.613   4.791   3.925
   70    HA   GLU   9           HA       GLU   9 -11.925   2.986   4.356
   71   1HB   GLU   9          2HB       GLU   9  -9.827   1.606   2.685
   72   2HB   GLU   9          1HB       GLU   9 -11.197   0.746   3.368
   73   1HG   GLU   9          2HG       GLU   9 -11.477   3.134   1.571
   74   2HG   GLU   9          1HG       GLU   9 -11.443   1.471   0.986
   75    H    VAL  10           H        VAL  10 -11.897   0.771   5.494
   76    HA   VAL  10           HA       VAL  10  -9.940   0.864   7.650
   77    HB   VAL  10           HB       VAL  10 -12.292  -1.004   7.282
   78   1HG1  VAL  10          1HG1      VAL  10 -10.549  -0.493   9.695
   79   2HG1  VAL  10          2HG1      VAL  10 -10.526  -1.945   8.694
   80   3HG1  VAL  10          3HG1      VAL  10 -11.962  -1.549   9.639
   81   1HG2  VAL  10          1HG2      VAL  10 -12.015   1.460   9.006
   82   2HG2  VAL  10          2HG2      VAL  10 -13.401   0.373   8.964
   83   3HG2  VAL  10          3HG2      VAL  10 -12.990   1.326   7.542
   84    H    LEU  11           H        LEU  11  -8.049   0.132   6.929
   85    HA   LEU  11           HA       LEU  11  -7.835  -1.910   4.937
   86   1HB   LEU  11          2HB       LEU  11  -5.714  -0.582   6.624
   87   2HB   LEU  11          1HB       LEU  11  -5.422  -1.576   5.208
   88    HG   LEU  11           HG       LEU  11  -6.972   1.013   5.149
   89   1HD1  LEU  11          1HD1      LEU  11  -4.954   1.950   4.086
   90   2HD1  LEU  11          2HD1      LEU  11  -4.087   0.461   4.467
   91   3HD1  LEU  11          3HD1      LEU  11  -4.691   1.489   5.767
   92   1HD2  LEU  11          1HD2      LEU  11  -5.814  -0.680   2.934
   93   2HD2  LEU  11          2HD2      LEU  11  -6.681   0.842   2.737
   94   3HD2  LEU  11          3HD2      LEU  11  -7.521  -0.576   3.361
   95    H    ALA  12           H        ALA  12  -8.212  -3.953   5.425
   96    HA   ALA  12           HA       ALA  12  -6.917  -5.078   7.820
   97   1HB   ALA  12          1HB       ALA  12  -8.773  -6.635   8.063
   98   2HB   ALA  12          2HB       ALA  12  -9.575  -5.920   6.664
   99   3HB   ALA  12          3HB       ALA  12  -9.351  -4.970   8.131
  100    H    CYS  13           H        CYS  13  -6.044  -7.146   7.589
  101    HA   CYS  13           HA       CYS  13  -5.066  -7.721   4.960
  102   1HB   CYS  13          2HB       CYS  13  -4.753  -9.425   7.431
  103   2HB   CYS  13          1HB       CYS  13  -3.701  -9.369   6.021
  104    HG   CYS  13           HG       CYS  13  -4.101  -6.613   7.990
  105    HA   PRO  14           HA       PRO  14  -8.094 -10.821   3.822
  106   1HB   PRO  14          2HB       PRO  14  -5.990 -12.019   2.159
  107   2HB   PRO  14          1HB       PRO  14  -7.522 -11.289   1.671
  108   1HG   PRO  14          2HG       PRO  14  -5.156 -10.098   1.187
  109   2HG   PRO  14          1HG       PRO  14  -6.623  -9.170   1.542
  110   1HD   PRO  14          2HD       PRO  14  -4.325  -9.846   3.341
  111   2HD   PRO  14          1HD       PRO  14  -5.230  -8.325   3.189
  112    H    LYS  15           H        LYS  15  -4.900 -11.531   4.975
  113    HA   LYS  15           HA       LYS  15  -5.487 -14.345   5.458
  114   1HB   LYS  15          2HB       LYS  15  -2.999 -12.729   6.043
  115   2HB   LYS  15          1HB       LYS  15  -3.149 -14.469   6.224
  116   1HG   LYS  15          2HG       LYS  15  -3.564 -13.093   3.590
  117   2HG   LYS  15          1HG       LYS  15  -1.974 -13.611   4.150
  118   1HD   LYS  15          2HD       LYS  15  -4.375 -15.410   3.808
  119   2HD   LYS  15          1HD       LYS  15  -3.036 -15.270   2.668
  120   1HE   LYS  15          2HE       LYS  15  -1.520 -15.932   4.594
  121   2HE   LYS  15          1HE       LYS  15  -2.989 -16.351   5.474
  122   1HZ   LYS  15          1HZ       LYS  15  -2.039 -17.542   2.926
  123   2HZ   LYS  15          2HZ       LYS  15  -3.551 -17.871   3.627
  124   3HZ   LYS  15          3HZ       LYS  15  -2.129 -18.303   4.441
  125    H    ASP  16           H        ASP  16  -4.115 -11.718   7.420
  126    HA   ASP  16           HA       ASP  16  -4.828 -13.136   9.852
  127   1HB   ASP  16          2HB       ASP  16  -2.566 -12.143   9.499
  128   2HB   ASP  16          1HB       ASP  16  -3.303 -10.547   9.482
  129    H    LYS  17           H        LYS  17  -6.027 -10.593   7.942
  130    HA   LYS  17           HA       LYS  17  -7.609  -9.009   8.142
  131   1HB   LYS  17          2HB       LYS  17  -8.528 -10.834  10.354
  132   2HB   LYS  17          1HB       LYS  17  -9.426  -9.405   9.856
  133   1HG   LYS  17          2HG       LYS  17  -9.244 -10.460   7.483
  134   2HG   LYS  17          1HG       LYS  17  -8.952 -11.952   8.385
  135   1HD   LYS  17          2HD       LYS  17 -11.046 -11.761   9.513
  136   2HD   LYS  17          1HD       LYS  17 -11.309 -10.137   8.871
  137   1HE   LYS  17          2HE       LYS  17 -11.239 -11.210   6.567
  138   2HE   LYS  17          1HE       LYS  17 -11.363 -12.761   7.401
  139   1HZ   LYS  17          1HZ       LYS  17 -13.531 -11.932   6.697
  140   2HZ   LYS  17          2HZ       LYS  17 -13.313 -10.527   7.617
  141   3HZ   LYS  17          3HZ       LYS  17 -13.439 -12.032   8.388
  142    H    GLY  18           H        GLY  18  -5.088  -8.962   9.894
  143   1HA   GLY  18          2HA       GLY  18  -5.837  -7.163  12.009
  144   2HA   GLY  18          1HA       GLY  18  -4.199  -7.552  11.499
  145    HA   PRO  19           HA       PRO  19  -5.724  -3.279   9.953
  146   1HB   PRO  19          2HB       PRO  19  -3.833  -2.210  11.946
  147   2HB   PRO  19          1HB       PRO  19  -5.492  -1.718  11.594
  148   1HG   PRO  19          2HG       PRO  19  -4.867  -3.034  13.842
  149   2HG   PRO  19          1HG       PRO  19  -6.403  -3.304  13.000
  150   1HD   PRO  19          2HD       PRO  19  -3.917  -4.977  12.990
  151   2HD   PRO  19          1HD       PRO  19  -5.617  -5.486  13.068
  152    H    LEU  20           H        LEU  20  -4.676  -2.828   8.153
  153    HA   LEU  20           HA       LEU  20  -1.921  -3.554   7.774
  154   1HB   LEU  20          2HB       LEU  20  -3.934  -2.150   6.025
  155   2HB   LEU  20          1HB       LEU  20  -2.277  -2.429   5.525
  156    HG   LEU  20           HG       LEU  20  -4.143  -4.661   6.319
  157   1HD1  LEU  20          1HD1      LEU  20  -4.480  -5.058   3.948
  158   2HD1  LEU  20          2HD1      LEU  20  -3.508  -3.639   3.551
  159   3HD1  LEU  20          3HD1      LEU  20  -5.052  -3.446   4.387
  160   1HD2  LEU  20          1HD2      LEU  20  -1.546  -4.614   4.784
  161   2HD2  LEU  20          2HD2      LEU  20  -2.522  -6.041   5.121
  162   3HD2  LEU  20          3HD2      LEU  20  -1.755  -5.167   6.445
  163    H    ARG  21           H        ARG  21  -0.154  -2.277   7.807
  164    HA   ARG  21           HA       ARG  21  -0.501   0.479   8.678
  165   1HB   ARG  21          2HB       ARG  21   1.191  -1.004   9.776
  166   2HB   ARG  21          1HB       ARG  21   2.074  -1.063   8.254
  167   1HG   ARG  21          2HG       ARG  21   2.501   1.294   8.345
  168   2HG   ARG  21          1HG       ARG  21   1.477   1.464   9.771
  169   1HD   ARG  21          2HD       ARG  21   3.021  -0.030  11.003
  170   2HD   ARG  21          1HD       ARG  21   4.072  -0.060   9.584
  171    HE   ARG  21           HE       ARG  21   3.711   2.595  10.136
  172   1HH1  ARG  21          1HH1      ARG  21   4.947  -0.157  11.943
  173   2HH1  ARG  21          2HH1      ARG  21   6.028   0.824  12.896
  174   1HH2  ARG  21          1HH2      ARG  21   5.070   3.858  11.427
  175   2HH2  ARG  21          2HH2      ARG  21   6.072   3.100  12.632
  176    H    TYR  22           H        TYR  22  -0.527   2.102   7.299
  177    HA   TYR  22           HA       TYR  22   0.021   1.578   4.505
  178   1HB   TYR  22          2HB       TYR  22  -2.035   2.755   5.076
  179   2HB   TYR  22          1HB       TYR  22  -1.116   4.015   5.895
  180    HD1  TYR  22           1HD      TYR  22  -0.338   5.886   4.711
  181    HD2  TYR  22           2HD      TYR  22  -1.700   2.477   2.557
  182    HE1  TYR  22           1HE      TYR  22  -0.202   7.160   2.615
  183    HE2  TYR  22           2HE      TYR  22  -1.564   3.744   0.459
  184    HH   TYR  22           HH       TYR  22  -1.634   6.146  -0.244
  185    H    LEU  23           H        LEU  23   1.823   2.096   3.503
  186    HA   LEU  23           HA       LEU  23   3.636   4.060   4.716
  187   1HB   LEU  23          2HB       LEU  23   4.051   1.907   2.659
  188   2HB   LEU  23          1HB       LEU  23   5.218   3.194   2.877
  189    HG   LEU  23           HG       LEU  23   5.435   2.472   5.280
  190   1HD1  LEU  23          1HD1      LEU  23   3.890   0.072   4.321
  191   2HD1  LEU  23          2HD1      LEU  23   3.316   1.268   5.481
  192   3HD1  LEU  23          3HD1      LEU  23   4.690   0.237   5.882
  193   1HD2  LEU  23          1HD2      LEU  23   6.859   0.556   4.756
  194   2HD2  LEU  23          2HD2      LEU  23   7.074   1.859   3.589
  195   3HD2  LEU  23          3HD2      LEU  23   6.118   0.443   3.159
  196    H    GLU  24           H        GLU  24   3.579   6.043   3.999
  197    HA   GLU  24           HA       GLU  24   1.897   6.832   1.857
  198   1HB   GLU  24          2HB       GLU  24   3.998   8.656   2.963
  199   2HB   GLU  24          1HB       GLU  24   2.354   9.027   2.473
  200   1HG   GLU  24          2HG       GLU  24   2.140   9.200   4.727
  201   2HG   GLU  24          1HG       GLU  24   1.749   7.492   4.523
  202    H    SER  25           H        SER  25   5.309   6.168   2.087
  203    HA   SER  25           HA       SER  25   6.251   7.724  -0.022
  204   1HB   SER  25          2HB       SER  25   7.288   5.094   1.048
  205   2HB   SER  25          1HB       SER  25   8.181   6.152  -0.047
  206    HG   SER  25           HG       SER  25   8.222   7.737   1.512
  207    H    GLU  26           H        GLU  26   5.058   4.361  -0.118
  208    HA   GLU  26           HA       GLU  26   5.230   4.514  -3.060
  209   1HB   GLU  26          2HB       GLU  26   5.952   2.252  -1.214
  210   2HB   GLU  26          1HB       GLU  26   5.628   1.993  -2.921
  211   1HG   GLU  26          2HG       GLU  26   7.719   3.893  -1.899
  212   2HG   GLU  26          1HG       GLU  26   8.036   2.207  -2.300
  213    H    GLN  27           H        GLN  27   2.981   4.643  -0.836
  214    HA   GLN  27           HA       GLN  27   0.842   3.927  -0.525
  215   1HB   GLN  27          2HB       GLN  27   1.182   3.427  -3.473
  216   2HB   GLN  27          1HB       GLN  27  -0.301   2.973  -2.654
  217   1HG   GLN  27          2HG       GLN  27  -0.503   5.127  -3.755
  218   2HG   GLN  27          1HG       GLN  27  -0.678   5.281  -2.008
  219   1HE2  GLN  27          1HE2      GLN  27   0.805   6.439  -0.860
  220   2HE2  GLN  27          2HE2      GLN  27   2.058   7.383  -1.596
  221    H    LEU  28           H        LEU  28   2.214   2.273   0.734
  222    HA   LEU  28           HA       LEU  28   1.711  -0.431  -0.320
  223   1HB   LEU  28          2HB       LEU  28   3.907   0.501   1.530
  224   2HB   LEU  28          1HB       LEU  28   3.621  -1.167   1.080
  225    HG   LEU  28           HG       LEU  28   4.437   1.049  -0.801
  226   1HD1  LEU  28          1HD1      LEU  28   5.982  -1.288   0.315
  227   2HD1  LEU  28          2HD1      LEU  28   6.229   0.415   0.704
  228   3HD1  LEU  28          3HD1      LEU  28   6.556  -0.175  -0.926
  229   1HD2  LEU  28          1HD2      LEU  28   4.074  -1.904  -1.284
  230   2HD2  LEU  28          2HD2      LEU  28   4.718  -0.738  -2.441
  231   3HD2  LEU  28          3HD2      LEU  28   3.043  -0.616  -1.905
  232    H    LEU  29           H        LEU  29   0.683  -1.861   0.933
  233    HA   LEU  29           HA       LEU  29  -0.092  -1.002   3.641
  234   1HB   LEU  29          2HB       LEU  29  -1.403  -3.104   1.911
  235   2HB   LEU  29          1HB       LEU  29  -2.008  -2.459   3.425
  236    HG   LEU  29           HG       LEU  29  -1.757  -0.921   0.836
  237   1HD1  LEU  29          1HD1      LEU  29  -4.185  -1.944   2.303
  238   2HD1  LEU  29          2HD1      LEU  29  -3.544  -2.588   0.792
  239   3HD1  LEU  29          3HD1      LEU  29  -4.197  -0.953   0.845
  240   1HD2  LEU  29          1HD2      LEU  29  -2.936   0.858   1.998
  241   2HD2  LEU  29          2HD2      LEU  29  -1.420   0.484   2.826
  242   3HD2  LEU  29          3HD2      LEU  29  -2.953  -0.097   3.480
  243    H    VAL  30           H        VAL  30   1.234  -1.916   5.074
  244    HA   VAL  30           HA       VAL  30   2.203  -4.641   4.520
  245    HB   VAL  30           HB       VAL  30   3.528  -2.493   6.189
  246   1HG1  VAL  30          1HG1      VAL  30   5.430  -4.033   6.301
  247   2HG1  VAL  30          2HG1      VAL  30   4.502  -5.246   5.422
  248   3HG1  VAL  30          3HG1      VAL  30   3.990  -4.739   7.032
  249   1HG2  VAL  30          1HG2      VAL  30   5.225  -2.457   4.412
  250   2HG2  VAL  30          2HG2      VAL  30   3.639  -1.973   3.819
  251   3HG2  VAL  30          3HG2      VAL  30   4.254  -3.589   3.472
  252    H    ASN  31           H        ASN  31   1.484  -6.178   5.826
  253    HA   ASN  31           HA       ASN  31   0.206  -5.479   8.332
  254   1HB   ASN  31          2HB       ASN  31  -0.779  -7.274   6.983
  255   2HB   ASN  31          1HB       ASN  31   0.724  -8.189   7.072
  256   1HD2  ASN  31          1HD2      ASN  31  -0.432  -9.924   8.024
  257   2HD2  ASN  31          2HD2      ASN  31  -0.915  -9.873   9.683
  258    H    GLU  32           H        GLU  32   1.306  -5.223  10.117
  259    HA   GLU  32           HA       GLU  32   4.126  -5.740  10.154
  260   1HB   GLU  32          2HB       GLU  32   2.804  -3.736  11.116
  261   2HB   GLU  32          1HB       GLU  32   2.472  -4.791  12.482
  262   1HG   GLU  32          2HG       GLU  32   4.688  -4.838  13.144
  263   2HG   GLU  32          1HG       GLU  32   5.278  -4.326  11.563
  264    H    ARG  33           H        ARG  33   1.399  -7.521  10.958
  265    HA   ARG  33           HA       ARG  33   2.586  -9.048  13.105
  266   1HB   ARG  33          2HB       ARG  33   0.068  -9.557  11.502
  267   2HB   ARG  33          1HB       ARG  33   0.544 -10.410  12.963
  268   1HG   ARG  33          2HG       ARG  33   0.311  -8.395  14.269
  269   2HG   ARG  33          1HG       ARG  33  -0.040  -7.459  12.812
  270   1HD   ARG  33          2HD       ARG  33  -2.056  -8.785  12.441
  271   2HD   ARG  33          1HD       ARG  33  -1.703  -9.744  13.874
  272    HE   ARG  33           HE       ARG  33  -1.826  -7.069  14.655
  273   1HH1  ARG  33          1HH1      ARG  33  -3.965  -9.491  13.280
  274   2HH1  ARG  33          2HH1      ARG  33  -5.378  -8.887  14.102
  275   1HH2  ARG  33          1HH2      ARG  33  -3.703  -6.216  15.666
  276   2HH2  ARG  33          2HH2      ARG  33  -5.233  -7.017  15.450
  277    H    LEU  34           H        LEU  34   2.041  -9.435   9.629
  278    HA   LEU  34           HA       LEU  34   3.262 -12.108   9.771
  279   1HB   LEU  34          2HB       LEU  34   1.464 -10.873   7.695
  280   2HB   LEU  34          1HB       LEU  34   2.276 -12.412   7.477
  281    HG   LEU  34           HG       LEU  34   0.237 -11.794   9.619
  282   1HD1  LEU  34          1HD1      LEU  34  -1.205 -13.309   8.372
  283   2HD1  LEU  34          2HD1      LEU  34   0.040 -13.497   7.138
  284   3HD1  LEU  34          3HD1      LEU  34  -0.735 -11.931   7.379
  285   1HD2  LEU  34          1HD2      LEU  34   1.626 -14.374   8.911
  286   2HD2  LEU  34          2HD2      LEU  34   0.339 -14.184  10.102
  287   3HD2  LEU  34          3HD2      LEU  34   1.904 -13.412  10.363
  288    H    ASN  35           H        ASN  35   3.857  -8.936   8.729
  289    HA   ASN  35           HA       ASN  35   5.614  -7.944   7.687
  290   1HB   ASN  35          2HB       ASN  35   6.848 -10.705   7.801
  291   2HB   ASN  35          1HB       ASN  35   7.699  -9.250   7.301
  292   1HD2  ASN  35          1HD2      ASN  35   6.387  -7.561   9.271
  293   2HD2  ASN  35          2HD2      ASN  35   7.078  -7.969  10.799
  294    H    LEU  36           H        LEU  36   3.421  -8.864   6.209
  295    HA   LEU  36           HA       LEU  36   4.674  -9.423   3.599
  296   1HB   LEU  36          2HB       LEU  36   1.866 -10.079   4.516
  297   2HB   LEU  36          1HB       LEU  36   2.494 -10.358   2.905
  298    HG   LEU  36           HG       LEU  36   3.486 -11.705   5.422
  299   1HD1  LEU  36          1HD1      LEU  36   1.819 -12.769   3.146
  300   2HD1  LEU  36          2HD1      LEU  36   1.259 -12.461   4.790
  301   3HD1  LEU  36          3HD1      LEU  36   2.458 -13.718   4.489
  302   1HD2  LEU  36          1HD2      LEU  36   4.792 -13.104   3.908
  303   2HD2  LEU  36          2HD2      LEU  36   5.245 -11.406   3.747
  304   3HD2  LEU  36          3HD2      LEU  36   4.220 -12.164   2.530
  305    H    ALA  37           H        ALA  37   3.897  -8.199   1.808
  306    HA   ALA  37           HA       ALA  37   2.537  -5.727   2.657
  307   1HB   ALA  37          1HB       ALA  37   4.940  -5.360   2.382
  308   2HB   ALA  37          2HB       ALA  37   3.993  -4.453   1.203
  309   3HB   ALA  37          3HB       ALA  37   4.829  -5.929   0.716
  310    H    TYR  38           H        TYR  38   1.007  -4.926   1.405
  311    HA   TYR  38           HA       TYR  38   0.555  -6.104  -1.264
  312   1HB   TYR  38          2HB       TYR  38  -1.546  -4.824   0.506
  313   2HB   TYR  38          1HB       TYR  38  -1.811  -5.729  -0.980
  314    HD1  TYR  38           1HD      TYR  38  -1.698  -8.182  -0.978
  315    HD2  TYR  38           2HD      TYR  38  -1.162  -5.950   2.606
  316    HE1  TYR  38           1HE      TYR  38  -2.047 -10.227   0.344
  317    HE2  TYR  38           2HE      TYR  38  -1.503  -7.989   3.935
  318    HH   TYR  38           HH       TYR  38  -1.511 -11.100   2.564
  319    H    ARG  39           H        ARG  39   0.260  -4.601  -2.963
  320    HA   ARG  39           HA       ARG  39   0.909  -1.834  -2.220
  321   1HB   ARG  39          2HB       ARG  39   0.739  -2.939  -5.018
  322   2HB   ARG  39          1HB       ARG  39   1.518  -1.459  -4.493
  323   1HG   ARG  39          2HG       ARG  39   3.083  -2.987  -3.162
  324   2HG   ARG  39          1HG       ARG  39   2.435  -4.285  -4.167
  325   1HD   ARG  39          2HD       ARG  39   4.061  -1.900  -4.966
  326   2HD   ARG  39          1HD       ARG  39   4.322  -3.601  -5.348
  327    HE   ARG  39           HE       ARG  39   2.072  -2.097  -6.515
  328   1HH1  ARG  39          1HH1      ARG  39   4.908  -4.100  -6.873
  329   2HH1  ARG  39          2HH1      ARG  39   4.742  -4.255  -8.595
  330   1HH2  ARG  39          1HH2      ARG  39   1.860  -2.260  -8.798
  331   2HH2  ARG  39          2HH2      ARG  39   3.007  -3.223  -9.686
  332    H    ILE  40           H        ILE  40  -0.384  -0.094  -2.750
  333    HA   ILE  40           HA       ILE  40  -3.019  -0.674  -3.883
  334    HB   ILE  40           HB       ILE  40  -1.855   1.986  -3.002
  335   1HG1  ILE  40          2HG1      ILE  40  -3.786   0.136  -1.578
  336   2HG1  ILE  40          1HG1      ILE  40  -2.109   0.417  -1.122
  337   1HG2  ILE  40          1HG2      ILE  40  -3.598   2.255  -4.660
  338   2HG2  ILE  40          2HG2      ILE  40  -4.194   2.762  -3.080
  339   3HG2  ILE  40          3HG2      ILE  40  -4.669   1.198  -3.744
  340   1HD1  ILE  40          1HD1      ILE  40  -3.641   1.653   0.299
  341   2HD1  ILE  40          2HD1      ILE  40  -4.301   2.480  -1.113
  342   3HD1  ILE  40          3HD1      ILE  40  -2.624   2.745  -0.639
  343    H    ASP  41           H        ASP  41  -3.138  -0.789  -6.035
  344    HA   ASP  41           HA       ASP  41  -1.087   0.667  -7.576
  345   1HB   ASP  41          2HB       ASP  41  -0.666  -1.815  -7.260
  346   2HB   ASP  41          1HB       ASP  41  -2.105  -2.098  -8.237
  347    H    ASP  42           H        ASP  42  -1.931   2.027  -8.966
  348    HA   ASP  42           HA       ASP  42  -3.275   3.014 -10.500
  349   1HB   ASP  42          2HB       ASP  42  -2.887   0.803 -11.655
  350   2HB   ASP  42          1HB       ASP  42  -4.430   0.265 -10.999
  351    H    GLY  43           H        GLY  43  -4.137   2.682  -7.723
  352   1HA   GLY  43          2HA       GLY  43  -5.956   3.741  -6.682
  353   2HA   GLY  43          1HA       GLY  43  -6.907   3.502  -8.142
  354    H    ILE  44           H        ILE  44  -5.454   0.612  -7.532
  355    HA   ILE  44           HA       ILE  44  -7.700  -0.308  -5.853
  356    HB   ILE  44           HB       ILE  44  -6.432  -1.725  -8.206
  357   1HG1  ILE  44          2HG1      ILE  44  -8.110  -0.045  -8.818
  358   2HG1  ILE  44          1HG1      ILE  44  -8.703  -1.670  -9.144
  359   1HG2  ILE  44          1HG2      ILE  44  -8.493  -2.757  -6.261
  360   2HG2  ILE  44          2HG2      ILE  44  -6.835  -3.330  -6.435
  361   3HG2  ILE  44          3HG2      ILE  44  -7.991  -3.568  -7.745
  362   1HD1  ILE  44          1HD1      ILE  44 -10.442  -0.271  -8.199
  363   2HD1  ILE  44          2HD1      ILE  44  -9.441   0.047  -6.782
  364   3HD1  ILE  44          3HD1      ILE  44 -10.034  -1.584  -7.094
  365    HA   PRO  45           HA       PRO  45  -4.269  -1.803  -3.311
  366   1HB   PRO  45          2HB       PRO  45  -6.466  -2.781  -1.618
  367   2HB   PRO  45          1HB       PRO  45  -5.162  -1.660  -1.219
  368   1HG   PRO  45          2HG       PRO  45  -7.713  -0.845  -1.482
  369   2HG   PRO  45          1HG       PRO  45  -6.342   0.179  -1.943
  370   1HD   PRO  45          2HD       PRO  45  -8.159  -1.449  -3.680
  371   2HD   PRO  45          1HD       PRO  45  -7.502   0.180  -3.951
  372    H    VAL  46           H        VAL  46  -3.338  -3.650  -3.941
  373    HA   VAL  46           HA       VAL  46  -4.892  -5.812  -5.007
  374    HB   VAL  46           HB       VAL  46  -1.935  -5.815  -4.383
  375   1HG1  VAL  46          1HG1      VAL  46  -3.577  -7.464  -6.305
  376   2HG1  VAL  46          2HG1      VAL  46  -2.848  -8.029  -4.804
  377   3HG1  VAL  46          3HG1      VAL  46  -1.821  -7.523  -6.144
  378   1HG2  VAL  46          1HG2      VAL  46  -1.589  -5.138  -6.713
  379   2HG2  VAL  46          2HG2      VAL  46  -2.475  -3.913  -5.804
  380   3HG2  VAL  46          3HG2      VAL  46  -3.331  -4.975  -6.920
  381    H    LEU  47           H        LEU  47  -6.173  -6.286  -3.143
  382    HA   LEU  47           HA       LEU  47  -4.805  -7.549  -0.899
  383   1HB   LEU  47          2HB       LEU  47  -7.738  -6.996  -1.369
  384   2HB   LEU  47          1HB       LEU  47  -7.067  -7.692   0.095
  385    HG   LEU  47           HG       LEU  47  -6.474  -4.921  -0.951
  386   1HD1  LEU  47          1HD1      LEU  47  -7.802  -4.136   0.919
  387   2HD1  LEU  47          2HD1      LEU  47  -8.148  -5.800   1.398
  388   3HD1  LEU  47          3HD1      LEU  47  -8.771  -5.174  -0.129
  389   1HD2  LEU  47          1HD2      LEU  47  -5.624  -6.333   1.573
  390   2HD2  LEU  47          2HD2      LEU  47  -5.415  -4.608   1.267
  391   3HD2  LEU  47          3HD2      LEU  47  -4.582  -5.790   0.258
  392    H    LEU  48           H        LEU  48  -4.027  -9.242  -2.374
  393    HA   LEU  48           HA       LEU  48  -6.064 -11.342  -2.713
  394   1HB   LEU  48          2HB       LEU  48  -3.650 -10.776  -4.432
  395   2HB   LEU  48          1HB       LEU  48  -4.647 -12.210  -4.572
  396    HG   LEU  48           HG       LEU  48  -5.631  -9.387  -5.000
  397   1HD1  LEU  48          1HD1      LEU  48  -4.915 -11.531  -6.990
  398   2HD1  LEU  48          2HD1      LEU  48  -4.063 -10.006  -6.734
  399   3HD1  LEU  48          3HD1      LEU  48  -5.707 -10.002  -7.375
  400   1HD2  LEU  48          1HD2      LEU  48  -7.617 -10.479  -5.931
  401   2HD2  LEU  48          2HD2      LEU  48  -7.382 -10.901  -4.235
  402   3HD2  LEU  48          3HD2      LEU  48  -6.952 -12.054  -5.499
  403    H    ILE  49           H        ILE  49  -5.736 -13.135  -1.666
  404    HA   ILE  49           HA       ILE  49  -3.994 -13.426   0.410
  405    HB   ILE  49           HB       ILE  49  -5.296 -15.610  -1.214
  406   1HG1  ILE  49          2HG1      ILE  49  -6.130 -14.243   1.352
  407   2HG1  ILE  49          1HG1      ILE  49  -6.831 -13.941  -0.234
  408   1HG2  ILE  49          1HG2      ILE  49  -5.019 -17.026   0.769
  409   2HG2  ILE  49          2HG2      ILE  49  -4.116 -15.736   1.562
  410   3HG2  ILE  49          3HG2      ILE  49  -3.457 -16.517   0.126
  411   1HD1  ILE  49          1HD1      ILE  49  -7.685 -16.202  -0.324
  412   2HD1  ILE  49          2HD1      ILE  49  -8.225 -15.413   1.159
  413   3HD1  ILE  49          3HD1      ILE  49  -6.905 -16.581   1.209
  414    H    ASP  50           H        ASP  50  -3.615 -15.081  -2.743
  415    HA   ASP  50           HA       ASP  50  -1.009 -16.043  -1.861
  416   1HB   ASP  50          2HB       ASP  50  -2.517 -16.650  -4.415
  417   2HB   ASP  50          1HB       ASP  50  -1.053 -17.454  -3.860
  418    H    GLU  51           H        GLU  51  -1.897 -13.228  -3.042
  419    HA   GLU  51           HA       GLU  51   0.251 -13.014  -5.043
  420   1HB   GLU  51          2HB       GLU  51  -2.165 -12.180  -5.458
  421   2HB   GLU  51          1HB       GLU  51  -1.744 -10.861  -4.376
  422   1HG   GLU  51          2HG       GLU  51  -1.448 -10.109  -6.605
  423   2HG   GLU  51          1HG       GLU  51   0.149 -10.308  -5.885
  424    H    ALA  52           H        ALA  52  -0.270 -12.636  -1.816
  425    HA   ALA  52           HA       ALA  52   0.944 -10.197  -1.165
  426   1HB   ALA  52          1HB       ALA  52   1.256 -11.140   1.059
  427   2HB   ALA  52          2HB       ALA  52   0.921 -12.755   0.437
  428   3HB   ALA  52          3HB       ALA  52  -0.346 -11.529   0.437
  429    H    THR  53           H        THR  53   3.045  -9.604  -0.768
  430    HA   THR  53           HA       THR  53   5.106 -11.539  -1.615
  431    HB   THR  53           HB       THR  53   5.440  -8.546  -1.713
  432    HG1  THR  53           1HG      THR  53   3.747 -10.049  -3.217
  433   1HG2  THR  53          1HG2      THR  53   7.449  -9.916  -1.962
  434   2HG2  THR  53          2HG2      THR  53   7.057  -9.095  -3.473
  435   3HG2  THR  53          3HG2      THR  53   6.686 -10.810  -3.277
  436    H    GLU  54           H        GLU  54   7.078 -11.570  -0.424
  437    HA   GLU  54           HA       GLU  54   6.779 -10.965   2.358
  438   1HB   GLU  54          2HB       GLU  54   9.178 -11.924   0.794
  439   2HB   GLU  54          1HB       GLU  54   9.135 -11.769   2.543
  440   1HG   GLU  54          2HG       GLU  54   7.133 -13.355   2.452
  441   2HG   GLU  54          1HG       GLU  54   7.645 -13.689   0.797
  442    H    TRP  55           H        TRP  55   7.440  -9.224   3.456
  443    HA   TRP  55           HA       TRP  55   8.810  -7.145   1.888
  444   1HB   TRP  55          2HB       TRP  55   6.484  -6.604   2.529
  445   2HB   TRP  55          1HB       TRP  55   6.915  -6.808   4.225
  446    HD1  TRP  55           HD       TRP  55   7.427  -4.611   5.415
  447    HE1  TRP  55           1HE      TRP  55   8.210  -2.262   4.717
  448    HE3  TRP  55           3HE      TRP  55   8.119  -5.440   0.422
  449    HZ2  TRP  55           2HZ      TRP  55   9.037  -0.937   2.360
  450    HZ3  TRP  55           3HZ      TRP  55   8.910  -3.585  -0.988
  451    HH2  TRP  55           HH       TRP  55   9.359  -1.380  -0.036
  452    H    THR  56           H        THR  56  10.654  -6.324   2.598
  453    HA   THR  56           HA       THR  56  11.771  -7.226   5.128
  454    HB   THR  56           HB       THR  56  13.006  -5.522   2.957
  455    HG1  THR  56           1HG      THR  56  12.403  -8.050   2.873
  456   1HG2  THR  56          1HG2      THR  56  15.148  -6.090   4.002
  457   2HG2  THR  56          2HG2      THR  56  14.299  -6.977   5.267
  458   3HG2  THR  56          3HG2      THR  56  14.103  -5.232   5.135
  459    HA   PRO  57           HA       PRO  57  10.377  -3.591   7.244
  460   1HB   PRO  57          2HB       PRO  57  12.658  -4.010   9.068
  461   2HB   PRO  57          1HB       PRO  57  10.926  -4.029   9.410
  462   1HG   PRO  57          2HG       PRO  57  12.359  -6.285   9.404
  463   2HG   PRO  57          1HG       PRO  57  10.696  -6.249   8.787
  464   1HD   PRO  57          2HD       PRO  57  13.282  -6.214   7.272
  465   2HD   PRO  57          1HD       PRO  57  11.799  -7.132   6.939
  466    H    ASN  58           H        ASN  58  11.747  -2.742   5.086
  467    HA   ASN  58           HA       ASN  58  12.749  -0.888   4.252
  468   1HB   ASN  58          2HB       ASN  58  11.418   0.088   6.277
  469   2HB   ASN  58          1HB       ASN  58  13.002   0.251   7.029
  470   1HD2  ASN  58          1HD2      ASN  58  10.877   1.390   4.542
  471   2HD2  ASN  58          2HD2      ASN  58  11.798   2.788   4.106
  472    H    ASN  59           H        ASN  59  14.788   0.759   5.327
  473    HA   ASN  59           HA       ASN  59  17.023  -1.071   5.091
  474   1HB   ASN  59          2HB       ASN  59  16.916   1.951   5.263
  475   2HB   ASN  59          1HB       ASN  59  18.389   1.018   5.028
  476   1HD2  ASN  59          1HD2      ASN  59  18.778   0.041   3.056
  477   2HD2  ASN  59          2HD2      ASN  59  17.863   0.431   1.634
  478    H    LEU  60           H        LEU  60  17.318  -2.152   6.977
  479    HA   LEU  60           HA       LEU  60  17.494  -0.672   9.475
  480   1HB   LEU  60          2HB       LEU  60  16.439  -2.932   9.376
  481   2HB   LEU  60          1HB       LEU  60  18.000  -3.604   8.946
  482    HG   LEU  60           HG       LEU  60  18.897  -2.797  11.125
  483   1HD1  LEU  60          1HD1      LEU  60  17.302  -0.992  11.507
  484   2HD1  LEU  60          2HD1      LEU  60  17.336  -2.118  12.864
  485   3HD1  LEU  60          3HD1      LEU  60  16.006  -2.172  11.703
  486   1HD2  LEU  60          1HD2      LEU  60  16.519  -4.644  11.256
  487   2HD2  LEU  60          2HD2      LEU  60  17.778  -4.507  12.483
  488   3HD2  LEU  60          3HD2      LEU  60  18.179  -5.097  10.871
  489    H    GLU  61           H        GLU  61  19.283   0.577   9.457
  490    HA   GLU  61           HA       GLU  61  21.778  -0.578   8.440
  491   1HB   GLU  61          2HB       GLU  61  21.152   1.549   7.475
  492   2HB   GLU  61          1HB       GLU  61  20.999   2.272   9.071
  493   1HG   GLU  61          2HG       GLU  61  23.385   2.017   9.438
  494   2HG   GLU  61          1HG       GLU  61  23.555   1.234   7.866
  Start of MODEL   12
    1   1H    MET   1          1HT       MET   1  -9.267  13.338  13.701
    2   2H    MET   1          2HT       MET   1  -7.920  13.521  12.679
    3   3H    MET   1          3HT       MET   1  -9.196  12.497  12.232
    4    HA   MET   1           HA       MET   1 -10.683  14.281  11.944
    5   1HB   MET   1          2HB       MET   1  -9.996  16.606  12.310
    6   2HB   MET   1          1HB       MET   1  -9.927  15.678  13.799
    7   1HG   MET   1          2HG       MET   1  -7.502  15.463  13.538
    8   2HG   MET   1          1HG       MET   1  -7.590  16.425  12.062
    9   1HE   MET   1          1HE       MET   1  -8.669  18.050  16.241
   10   2HE   MET   1          2HE       MET   1  -8.095  16.406  15.955
   11   3HE   MET   1          3HE       MET   1  -9.677  16.905  15.353
   12    H    SER   2           H        SER   2 -10.847  15.381   9.984
   13    HA   SER   2           HA       SER   2 -10.331  16.026   7.876
   14   1HB   SER   2          2HB       SER   2  -7.458  15.953   8.841
   15   2HB   SER   2          1HB       SER   2  -8.020  16.691   7.338
   16    HG   SER   2           HG       SER   2  -7.794  18.222   9.043
   17    H    LEU   3           H        LEU   3  -8.254  15.279   6.159
   18    HA   LEU   3           HA       LEU   3  -7.628  13.631   4.736
   19   1HB   LEU   3          2HB       LEU   3  -7.922  11.965   7.227
   20   2HB   LEU   3          1HB       LEU   3  -7.488  11.257   5.685
   21    HG   LEU   3           HG       LEU   3  -5.476  11.564   6.899
   22   1HD1  LEU   3          1HD1      LEU   3  -4.218  13.107   5.490
   23   2HD1  LEU   3          2HD1      LEU   3  -5.729  13.782   4.881
   24   3HD1  LEU   3          3HD1      LEU   3  -5.317  12.101   4.549
   25   1HD2  LEU   3          1HD2      LEU   3  -4.754  13.745   7.778
   26   2HD2  LEU   3          2HD2      LEU   3  -6.217  13.152   8.562
   27   3HD2  LEU   3          3HD2      LEU   3  -6.325  14.424   7.345
   28    H    ASP   4           H        ASP   4  -8.458  11.190   4.116
   29    HA   ASP   4           HA       ASP   4 -11.389  11.392   3.933
   30   1HB   ASP   4          2HB       ASP   4 -10.222  11.917   1.766
   31   2HB   ASP   4          1HB       ASP   4  -9.614  10.262   1.762
   32    HA   PRO   5           HA       PRO   5 -10.412   7.531   6.173
   33   1HB   PRO   5          2HB       PRO   5 -12.985   7.298   7.145
   34   2HB   PRO   5          1HB       PRO   5 -11.674   8.161   7.955
   35   1HG   PRO   5          2HG       PRO   5 -13.880   9.233   6.250
   36   2HG   PRO   5          1HG       PRO   5 -13.190   9.900   7.741
   37   1HD   PRO   5          2HD       PRO   5 -12.553  10.892   5.333
   38   2HD   PRO   5          1HD       PRO   5 -11.353  10.788   6.639
   39    H    GLN   6           H        GLN   6 -12.829   8.276   3.777
   40    HA   GLN   6           HA       GLN   6 -13.847   5.610   3.555
   41   1HB   GLN   6          2HB       GLN   6 -14.209   8.136   2.001
   42   2HB   GLN   6          1HB       GLN   6 -14.707   6.611   1.284
   43   1HG   GLN   6          2HG       GLN   6 -16.592   7.613   2.343
   44   2HG   GLN   6          1HG       GLN   6 -16.123   6.185   3.261
   45   1HE2  GLN   6          1HE2      GLN   6 -17.058   6.847   5.141
   46   2HE2  GLN   6          2HE2      GLN   6 -16.467   8.173   6.086
   47    H    LEU   7           H        LEU   7 -11.187   7.348   2.135
   48    HA   LEU   7           HA       LEU   7 -10.717   5.461   0.034
   49   1HB   LEU   7          2HB       LEU   7  -8.954   7.525   1.345
   50   2HB   LEU   7          1HB       LEU   7  -8.387   6.478   0.059
   51    HG   LEU   7           HG       LEU   7 -10.644   8.471  -0.170
   52   1HD1  LEU   7          1HD1      LEU   7  -8.448   9.529   0.008
   53   2HD1  LEU   7          2HD1      LEU   7  -9.113   9.701  -1.616
   54   3HD1  LEU   7          3HD1      LEU   7  -7.850   8.512  -1.302
   55   1HD2  LEU   7          1HD2      LEU   7 -10.568   7.936  -2.561
   56   2HD2  LEU   7          2HD2      LEU   7 -10.993   6.522  -1.596
   57   3HD2  LEU   7          3HD2      LEU   7  -9.362   6.690  -2.242
   58    H    LEU   8           H        LEU   8 -10.321   5.361   3.379
   59    HA   LEU   8           HA       LEU   8  -8.272   3.262   3.182
   60   1HB   LEU   8          2HB       LEU   8  -8.972   5.021   5.532
   61   2HB   LEU   8          1HB       LEU   8  -7.737   3.776   5.527
   62    HG   LEU   8           HG       LEU   8  -7.689   6.251   3.795
   63   1HD1  LEU   8          1HD1      LEU   8  -6.179   5.601   6.322
   64   2HD1  LEU   8          2HD1      LEU   8  -7.431   6.832   6.142
   65   3HD1  LEU   8          3HD1      LEU   8  -5.896   7.002   5.290
   66   1HD2  LEU   8          1HD2      LEU   8  -5.373   5.597   3.353
   67   2HD2  LEU   8          2HD2      LEU   8  -6.505   4.357   2.810
   68   3HD2  LEU   8          3HD2      LEU   8  -5.604   4.134   4.309
   69    H    GLU   9           H        GLU   9 -10.642   4.126   5.686
   70    HA   GLU   9           HA       GLU   9 -11.974   2.873   7.021
   71   1HB   GLU   9          2HB       GLU   9 -12.196   1.137   4.554
   72   2HB   GLU   9          1HB       GLU   9 -13.215   0.993   5.980
   73   1HG   GLU   9          2HG       GLU   9 -13.974   3.327   5.612
   74   2HG   GLU   9          1HG       GLU   9 -13.048   3.345   4.112
   75    H    VAL  10           H        VAL  10 -12.290   0.063   7.278
   76    HA   VAL  10           HA       VAL  10  -9.803  -0.532   8.599
   77    HB   VAL  10           HB       VAL  10 -12.261  -2.260   8.269
   78   1HG1  VAL  10          1HG1      VAL  10 -11.328  -3.506  10.200
   79   2HG1  VAL  10          2HG1      VAL  10  -9.856  -2.541  10.067
   80   3HG1  VAL  10          3HG1      VAL  10 -10.327  -3.620   8.753
   81   1HG2  VAL  10          1HG2      VAL  10 -11.379  -0.504  10.554
   82   2HG2  VAL  10          2HG2      VAL  10 -12.767  -1.594  10.574
   83   3HG2  VAL  10          3HG2      VAL  10 -12.746  -0.210   9.481
   84    H    LEU  11           H        LEU  11  -8.168  -0.951   7.252
   85    HA   LEU  11           HA       LEU  11  -8.555  -2.963   5.155
   86   1HB   LEU  11          2HB       LEU  11  -6.296  -1.009   5.618
   87   2HB   LEU  11          1HB       LEU  11  -6.351  -2.185   4.319
   88    HG   LEU  11           HG       LEU  11  -8.311   0.079   4.684
   89   1HD1  LEU  11          1HD1      LEU  11  -6.114   0.911   4.078
   90   2HD1  LEU  11          2HD1      LEU  11  -7.214   1.040   2.705
   91   3HD1  LEU  11          3HD1      LEU  11  -6.017  -0.254   2.755
   92   1HD2  LEU  11          1HD2      LEU  11  -9.299  -1.866   3.586
   93   2HD2  LEU  11          2HD2      LEU  11  -7.962  -1.902   2.434
   94   3HD2  LEU  11          3HD2      LEU  11  -9.079  -0.537   2.445
   95    H    ALA  12           H        ALA  12  -8.024  -4.962   5.664
   96    HA   ALA  12           HA       ALA  12  -5.778  -5.430   7.491
   97   1HB   ALA  12          1HB       ALA  12  -7.850  -5.504   8.816
   98   2HB   ALA  12          2HB       ALA  12  -7.043  -7.072   8.746
   99   3HB   ALA  12          3HB       ALA  12  -8.468  -6.769   7.751
  100    H    CYS  13           H        CYS  13  -4.873  -7.554   7.359
  101    HA   CYS  13           HA       CYS  13  -4.665  -8.578   4.730
  102   1HB   CYS  13          2HB       CYS  13  -2.852  -8.781   6.363
  103   2HB   CYS  13          1HB       CYS  13  -3.856  -9.811   7.375
  104    HG   CYS  13           HG       CYS  13  -2.546 -10.597   4.309
  105    HA   PRO  14           HA       PRO  14  -8.182 -11.304   4.527
  106   1HB   PRO  14          2HB       PRO  14  -6.522 -12.971   2.740
  107   2HB   PRO  14          1HB       PRO  14  -8.066 -12.176   2.425
  108   1HG   PRO  14          2HG       PRO  14  -5.796 -11.268   1.348
  109   2HG   PRO  14          1HG       PRO  14  -7.074 -10.159   1.887
  110   1HD   PRO  14          2HD       PRO  14  -4.502 -10.887   3.240
  111   2HD   PRO  14          1HD       PRO  14  -5.289  -9.301   3.099
  112    H    LYS  15           H        LYS  15  -5.004 -12.379   5.422
  113    HA   LYS  15           HA       LYS  15  -5.799 -15.082   6.020
  114   1HB   LYS  15          2HB       LYS  15  -3.269 -13.520   6.436
  115   2HB   LYS  15          1HB       LYS  15  -3.475 -15.129   7.112
  116   1HG   LYS  15          2HG       LYS  15  -3.776 -14.501   4.184
  117   2HG   LYS  15          1HG       LYS  15  -2.269 -15.041   4.925
  118   1HD   LYS  15          2HD       LYS  15  -4.869 -16.568   5.046
  119   2HD   LYS  15          1HD       LYS  15  -3.591 -16.875   3.869
  120   1HE   LYS  15          2HE       LYS  15  -2.053 -17.478   5.607
  121   2HE   LYS  15          1HE       LYS  15  -3.192 -16.974   6.854
  122   1HZ   LYS  15          1HZ       LYS  15  -4.660 -18.754   6.228
  123   2HZ   LYS  15          2HZ       LYS  15  -3.122 -19.391   6.551
  124   3HZ   LYS  15          3HZ       LYS  15  -3.647 -19.208   4.947
  125    H    ASP  16           H        ASP  16  -4.327 -12.632   8.150
  126    HA   ASP  16           HA       ASP  16  -5.631 -13.952  10.420
  127   1HB   ASP  16          2HB       ASP  16  -3.972 -12.808  11.790
  128   2HB   ASP  16          1HB       ASP  16  -3.171 -13.642  10.462
  129    H    LYS  17           H        LYS  17  -6.045 -11.339   8.427
  130    HA   LYS  17           HA       LYS  17  -7.236  -9.432   8.446
  131   1HB   LYS  17          2HB       LYS  17  -8.568 -10.755  10.811
  132   2HB   LYS  17          1HB       LYS  17  -9.127  -9.247  10.094
  133   1HG   LYS  17          2HG       LYS  17  -9.246 -10.524   7.896
  134   2HG   LYS  17          1HG       LYS  17  -9.069 -11.985   8.868
  135   1HD   LYS  17          2HD       LYS  17 -11.075 -11.451  10.099
  136   2HD   LYS  17          1HD       LYS  17 -11.229  -9.915   9.242
  137   1HE   LYS  17          2HE       LYS  17 -11.397 -11.209   7.112
  138   2HE   LYS  17          1HE       LYS  17 -11.434 -12.686   8.073
  139   1HZ   LYS  17          1HZ       LYS  17 -13.459 -11.870   9.155
  140   2HZ   LYS  17          2HZ       LYS  17 -13.663 -11.999   7.477
  141   3HZ   LYS  17          3HZ       LYS  17 -13.428 -10.479   8.186
  142    H    GLY  18           H        GLY  18  -4.712  -9.536   9.744
  143   1HA   GLY  18          2HA       GLY  18  -4.838  -7.718  11.978
  144   2HA   GLY  18          1HA       GLY  18  -3.390  -8.230  11.120
  145    HA   PRO  19           HA       PRO  19  -5.352  -3.933   9.794
  146   1HB   PRO  19          2HB       PRO  19  -3.489  -2.776  11.791
  147   2HB   PRO  19          1HB       PRO  19  -5.145  -2.305  11.391
  148   1HG   PRO  19          2HG       PRO  19  -4.596  -3.600  13.658
  149   2HG   PRO  19          1HG       PRO  19  -6.076  -3.947  12.740
  150   1HD   PRO  19          2HD       PRO  19  -3.524  -5.503  12.888
  151   2HD   PRO  19          1HD       PRO  19  -5.198  -6.091  12.842
  152    H    LEU  20           H        LEU  20  -4.389  -2.968   8.128
  153    HA   LEU  20           HA       LEU  20  -1.663  -3.696   7.503
  154   1HB   LEU  20          2HB       LEU  20  -3.680  -2.065   5.953
  155   2HB   LEU  20          1HB       LEU  20  -2.121  -2.584   5.342
  156    HG   LEU  20           HG       LEU  20  -4.382  -4.421   6.143
  157   1HD1  LEU  20          1HD1      LEU  20  -4.626  -4.859   3.773
  158   2HD1  LEU  20          2HD1      LEU  20  -3.324  -3.726   3.406
  159   3HD1  LEU  20          3HD1      LEU  20  -4.834  -3.138   4.094
  160   1HD2  LEU  20          1HD2      LEU  20  -3.021  -6.189   5.174
  161   2HD2  LEU  20          2HD2      LEU  20  -2.162  -5.403   6.498
  162   3HD2  LEU  20          3HD2      LEU  20  -1.738  -5.031   4.828
  163    H    ARG  21           H        ARG  21   0.063  -2.459   7.632
  164    HA   ARG  21           HA       ARG  21  -0.107   0.199   8.766
  165   1HB   ARG  21          2HB       ARG  21   1.587  -1.456   9.512
  166   2HB   ARG  21          1HB       ARG  21   2.268  -1.468   7.897
  167   1HG   ARG  21          2HG       ARG  21   2.947   0.847   8.136
  168   2HG   ARG  21          1HG       ARG  21   2.196   0.918   9.733
  169   1HD   ARG  21          2HD       ARG  21   3.711  -0.829  10.527
  170   2HD   ARG  21          1HD       ARG  21   4.453  -0.924   8.932
  171    HE   ARG  21           HE       ARG  21   4.570   1.715  10.019
  172   1HH1  ARG  21          1HH1      ARG  21   6.087  -1.459  10.176
  173   2HH1  ARG  21          2HH1      ARG  21   7.641  -0.818  10.648
  174   1HH2  ARG  21          1HH2      ARG  21   6.581   2.548  10.667
  175   2HH2  ARG  21          2HH2      ARG  21   7.928   1.465  10.910
  176    H    TYR  22           H        TYR  22  -0.231   1.972   7.532
  177    HA   TYR  22           HA       TYR  22  -0.054   1.623   4.649
  178   1HB   TYR  22          2HB       TYR  22  -2.056   2.665   5.484
  179   2HB   TYR  22          1HB       TYR  22  -1.120   3.871   6.359
  180    HD1  TYR  22           1HD      TYR  22  -1.601   2.626   2.858
  181    HD2  TYR  22           2HD      TYR  22  -0.891   5.960   5.402
  182    HE1  TYR  22           1HE      TYR  22  -1.745   4.130   0.916
  183    HE2  TYR  22           2HE      TYR  22  -1.035   7.475   3.470
  184    HH   TYR  22           HH       TYR  22  -0.762   7.384   1.033
  185    H    LEU  23           H        LEU  23   1.801   1.956   3.685
  186    HA   LEU  23           HA       LEU  23   3.657   3.982   4.671
  187   1HB   LEU  23          2HB       LEU  23   3.838   1.891   2.510
  188   2HB   LEU  23          1HB       LEU  23   5.035   3.160   2.665
  189    HG   LEU  23           HG       LEU  23   5.470   2.339   5.012
  190   1HD1  LEU  23          1HD1      LEU  23   4.783   0.066   5.565
  191   2HD1  LEU  23          2HD1      LEU  23   3.822  -0.009   4.088
  192   3HD1  LEU  23          3HD1      LEU  23   3.387   1.125   5.366
  193   1HD2  LEU  23          1HD2      LEU  23   5.966   0.455   2.713
  194   2HD2  LEU  23          2HD2      LEU  23   6.808   0.413   4.262
  195   3HD2  LEU  23          3HD2      LEU  23   6.979   1.814   3.202
  196    H    GLU  24           H        GLU  24   3.085   5.966   4.157
  197    HA   GLU  24           HA       GLU  24   1.347   6.723   2.113
  198   1HB   GLU  24          2HB       GLU  24   3.442   8.461   3.423
  199   2HB   GLU  24          1HB       GLU  24   1.963   9.001   2.642
  200   1HG   GLU  24          2HG       GLU  24   0.626   7.969   4.362
  201   2HG   GLU  24          1HG       GLU  24   2.068   7.288   5.114
  202    H    SER  25           H        SER  25   4.879   6.790   2.213
  203    HA   SER  25           HA       SER  25   5.343   8.388  -0.001
  204   1HB   SER  25          2HB       SER  25   7.107   6.127   0.938
  205   2HB   SER  25          1HB       SER  25   7.603   7.609   0.118
  206    HG   SER  25           HG       SER  25   7.190   8.776   1.918
  207    H    GLU  26           H        GLU  26   5.176   4.826   0.125
  208    HA   GLU  26           HA       GLU  26   5.440   4.807  -2.801
  209   1HB   GLU  26          2HB       GLU  26   6.079   2.722  -0.724
  210   2HB   GLU  26          1HB       GLU  26   6.007   2.353  -2.441
  211   1HG   GLU  26          2HG       GLU  26   7.844   4.359  -1.155
  212   2HG   GLU  26          1HG       GLU  26   8.287   2.734  -1.670
  213    H    GLN  27           H        GLN  27   2.965   4.876  -0.771
  214    HA   GLN  27           HA       GLN  27   0.831   4.073  -0.721
  215   1HB   GLN  27          2HB       GLN  27   1.482   3.500  -3.618
  216   2HB   GLN  27          1HB       GLN  27  -0.133   3.393  -2.931
  217   1HG   GLN  27          2HG       GLN  27   1.519   5.905  -2.893
  218   2HG   GLN  27          1HG       GLN  27   0.381   5.504  -4.176
  219   1HE2  GLN  27          1HE2      GLN  27   0.382   7.731  -2.259
  220   2HE2  GLN  27          2HE2      GLN  27  -1.139   7.643  -1.444
  221    H    LEU  28           H        LEU  28   2.186   2.372   0.601
  222    HA   LEU  28           HA       LEU  28   1.611  -0.283  -0.536
  223   1HB   LEU  28          2HB       LEU  28   3.894   0.509   1.271
  224   2HB   LEU  28          1HB       LEU  28   3.507  -1.141   0.828
  225    HG   LEU  28           HG       LEU  28   4.378   1.028  -1.080
  226   1HD1  LEU  28          1HD1      LEU  28   6.450  -0.246  -1.249
  227   2HD1  LEU  28          2HD1      LEU  28   5.856  -1.391  -0.045
  228   3HD1  LEU  28          3HD1      LEU  28   6.171   0.283   0.411
  229   1HD2  LEU  28          1HD2      LEU  28   2.868  -0.572  -2.134
  230   2HD2  LEU  28          2HD2      LEU  28   3.851  -1.909  -1.539
  231   3HD2  LEU  28          3HD2      LEU  28   4.516  -0.785  -2.723
  232    H    LEU  29           H        LEU  29   0.612  -1.754   0.740
  233    HA   LEU  29           HA       LEU  29  -0.065  -0.904   3.481
  234   1HB   LEU  29          2HB       LEU  29  -1.596  -2.663   1.561
  235   2HB   LEU  29          1HB       LEU  29  -2.028  -2.438   3.245
  236    HG   LEU  29           HG       LEU  29  -1.939  -0.229   1.187
  237   1HD1  LEU  29          1HD1      LEU  29  -4.385  -0.292   1.335
  238   2HD1  LEU  29          2HD1      LEU  29  -4.277  -1.714   2.376
  239   3HD1  LEU  29          3HD1      LEU  29  -3.722  -1.801   0.703
  240   1HD2  LEU  29          1HD2      LEU  29  -3.117   1.067   2.915
  241   2HD2  LEU  29          2HD2      LEU  29  -1.508   0.577   3.439
  242   3HD2  LEU  29          3HD2      LEU  29  -2.927  -0.280   4.039
  243    H    VAL  30           H        VAL  30   1.180  -1.949   4.889
  244    HA   VAL  30           HA       VAL  30   1.900  -4.751   4.302
  245    HB   VAL  30           HB       VAL  30   3.476  -2.730   5.909
  246   1HG1  VAL  30          1HG1      VAL  30   5.253  -4.421   5.902
  247   2HG1  VAL  30          2HG1      VAL  30   4.166  -5.548   5.090
  248   3HG1  VAL  30          3HG1      VAL  30   3.801  -4.994   6.724
  249   1HG2  VAL  30          1HG2      VAL  30   4.040  -3.860   3.168
  250   2HG2  VAL  30          2HG2      VAL  30   5.082  -2.764   4.076
  251   3HG2  VAL  30          3HG2      VAL  30   3.501  -2.216   3.517
  252    H    ASN  31           H        ASN  31   0.867  -6.145   5.613
  253    HA   ASN  31           HA       ASN  31  -0.165  -5.316   8.177
  254   1HB   ASN  31          2HB       ASN  31  -1.398  -7.025   6.970
  255   2HB   ASN  31          1HB       ASN  31   0.030  -8.050   6.881
  256   1HD2  ASN  31          1HD2      ASN  31  -1.179  -9.714   7.872
  257   2HD2  ASN  31          2HD2      ASN  31  -1.491  -9.714   9.573
  258    H    GLU  32           H        GLU  32   1.058  -5.139   9.929
  259    HA   GLU  32           HA       GLU  32   3.817  -5.883   9.806
  260   1HB   GLU  32          2HB       GLU  32   2.732  -3.817  10.926
  261   2HB   GLU  32          1HB       GLU  32   2.415  -4.897  12.277
  262   1HG   GLU  32          2HG       GLU  32   4.450  -3.616  12.626
  263   2HG   GLU  32          1HG       GLU  32   4.796  -5.342  12.501
  264    H    ARG  33           H        ARG  33   1.010  -7.452  10.857
  265    HA   ARG  33           HA       ARG  33   2.185  -9.012  12.956
  266   1HB   ARG  33          2HB       ARG  33  -0.432  -9.148  11.474
  267   2HB   ARG  33          1HB       ARG  33   0.018 -10.339  12.689
  268   1HG   ARG  33          2HG       ARG  33  -0.059  -8.801  14.417
  269   2HG   ARG  33          1HG       ARG  33   0.115  -7.422  13.330
  270   1HD   ARG  33          2HD       ARG  33  -2.174  -7.736  14.328
  271   2HD   ARG  33          1HD       ARG  33  -2.118  -7.621  12.571
  272    HE   ARG  33           HE       ARG  33  -2.386 -10.050  12.496
  273   1HH1  ARG  33          1HH1      ARG  33  -3.083  -8.486  15.550
  274   2HH1  ARG  33          2HH1      ARG  33  -4.300  -9.641  16.008
  275   1HH2  ARG  33          1HH2      ARG  33  -3.933 -11.588  13.113
  276   2HH2  ARG  33          2HH2      ARG  33  -4.747 -11.439  14.645
  277    H    LEU  34           H        LEU  34   1.721  -9.415   9.514
  278    HA   LEU  34           HA       LEU  34   3.051 -12.039   9.705
  279   1HB   LEU  34          2HB       LEU  34   1.286 -10.951   7.505
  280   2HB   LEU  34          1HB       LEU  34   2.106 -12.500   7.463
  281    HG   LEU  34           HG       LEU  34  -0.053 -11.714   9.427
  282   1HD1  LEU  34          1HD1      LEU  34  -0.944 -12.010   7.200
  283   2HD1  LEU  34          2HD1      LEU  34  -1.399 -13.381   8.211
  284   3HD1  LEU  34          3HD1      LEU  34  -0.096 -13.544   7.034
  285   1HD2  LEU  34          1HD2      LEU  34   0.005 -14.077  10.085
  286   2HD2  LEU  34          2HD2      LEU  34   1.545 -13.278  10.402
  287   3HD2  LEU  34          3HD2      LEU  34   1.374 -14.342   9.004
  288    H    ASN  35           H        ASN  35   3.417  -8.850   8.902
  289    HA   ASN  35           HA       ASN  35   4.854  -7.572   7.743
  290   1HB   ASN  35          2HB       ASN  35   6.391  -8.908   9.285
  291   2HB   ASN  35          1HB       ASN  35   6.807  -9.859   7.858
  292   1HD2  ASN  35          1HD2      ASN  35   6.886  -6.672   9.301
  293   2HD2  ASN  35          2HD2      ASN  35   8.145  -6.040   8.297
  294    H    LEU  36           H        LEU  36   3.077  -8.520   6.129
  295    HA   LEU  36           HA       LEU  36   4.548  -9.282   3.692
  296   1HB   LEU  36          2HB       LEU  36   1.643  -9.794   4.382
  297   2HB   LEU  36          1HB       LEU  36   2.393 -10.175   2.845
  298    HG   LEU  36           HG       LEU  36   3.097 -11.431   5.503
  299   1HD1  LEU  36          1HD1      LEU  36   1.637 -12.549   3.115
  300   2HD1  LEU  36          2HD1      LEU  36   0.916 -12.135   4.669
  301   3HD1  LEU  36          3HD1      LEU  36   2.091 -13.445   4.565
  302   1HD2  LEU  36          1HD2      LEU  36   4.493 -12.935   4.199
  303   2HD2  LEU  36          2HD2      LEU  36   5.021 -11.264   3.997
  304   3HD2  LEU  36          3HD2      LEU  36   4.090 -12.056   2.725
  305    H    ALA  37           H        ALA  37   3.873  -8.192   1.740
  306    HA   ALA  37           HA       ALA  37   2.721  -5.554   2.384
  307   1HB   ALA  37          1HB       ALA  37   4.272  -4.547   0.836
  308   2HB   ALA  37          2HB       ALA  37   4.921  -6.130   0.412
  309   3HB   ALA  37          3HB       ALA  37   5.155  -5.489   2.038
  310    H    TYR  38           H        TYR  38   1.069  -4.926   1.264
  311    HA   TYR  38           HA       TYR  38   0.444  -6.254  -1.284
  312   1HB   TYR  38          2HB       TYR  38  -1.395  -4.769   0.612
  313   2HB   TYR  38          1HB       TYR  38  -1.884  -5.556  -0.886
  314    HD1  TYR  38           1HD      TYR  38  -1.025  -6.039   2.613
  315    HD2  TYR  38           2HD      TYR  38  -1.866  -8.017  -1.057
  316    HE1  TYR  38           1HE      TYR  38  -1.384  -8.140   3.836
  317    HE2  TYR  38           2HE      TYR  38  -2.240 -10.122   0.159
  318    HH   TYR  38           HH       TYR  38  -1.585 -11.152   2.286
  319    H    ARG  39           H        ARG  39   0.037  -4.997  -3.081
  320    HA   ARG  39           HA       ARG  39   1.194  -2.328  -2.910
  321   1HB   ARG  39          2HB       ARG  39   0.538  -4.081  -5.285
  322   2HB   ARG  39          1HB       ARG  39   1.265  -2.483  -5.400
  323   1HG   ARG  39          2HG       ARG  39   3.225  -3.254  -4.212
  324   2HG   ARG  39          1HG       ARG  39   2.488  -4.840  -3.978
  325   1HD   ARG  39          2HD       ARG  39   4.098  -4.843  -5.830
  326   2HD   ARG  39          1HD       ARG  39   2.463  -5.212  -6.379
  327    HE   ARG  39           HE       ARG  39   3.426  -2.448  -6.589
  328   1HH1  ARG  39          1HH1      ARG  39   2.561  -5.468  -8.170
  329   2HH1  ARG  39          2HH1      ARG  39   2.452  -4.747  -9.753
  330   1HH2  ARG  39          1HH2      ARG  39   3.217  -1.496  -8.652
  331   2HH2  ARG  39          2HH2      ARG  39   2.790  -2.478 -10.021
  332    H    ILE  40           H        ILE  40   0.111  -0.477  -3.359
  333    HA   ILE  40           HA       ILE  40  -2.722  -0.690  -4.079
  334    HB   ILE  40           HB       ILE  40  -1.155   1.745  -3.188
  335   1HG1  ILE  40          2HG1      ILE  40  -3.162   0.051  -1.674
  336   2HG1  ILE  40          1HG1      ILE  40  -1.422   0.034  -1.412
  337   1HG2  ILE  40          1HG2      ILE  40  -4.117   1.349  -3.624
  338   2HG2  ILE  40          2HG2      ILE  40  -3.040   2.327  -4.619
  339   3HG2  ILE  40          3HG2      ILE  40  -3.370   2.797  -2.952
  340   1HD1  ILE  40          1HD1      ILE  40  -3.217   2.418  -1.015
  341   2HD1  ILE  40          2HD1      ILE  40  -1.489   2.340  -0.678
  342   3HD1  ILE  40          3HD1      ILE  40  -2.615   1.362   0.264
  343    H    ASP  41           H        ASP  41  -3.131  -0.657  -6.186
  344    HA   ASP  41           HA       ASP  41  -1.421   1.005  -7.923
  345   1HB   ASP  41          2HB       ASP  41  -0.903  -1.445  -8.101
  346   2HB   ASP  41          1HB       ASP  41  -2.561  -1.712  -8.624
  347    H    ASP  42           H        ASP  42  -2.527   2.415  -9.142
  348    HA   ASP  42           HA       ASP  42  -4.233   3.540 -10.136
  349   1HB   ASP  42          2HB       ASP  42  -4.473   1.467 -11.449
  350   2HB   ASP  42          1HB       ASP  42  -5.565   0.816 -10.234
  351    H    GLY  43           H        GLY  43  -4.199   2.754  -7.150
  352   1HA   GLY  43          2HA       GLY  43  -5.437   3.721  -5.407
  353   2HA   GLY  43          1HA       GLY  43  -6.768   3.980  -6.524
  354    H    ILE  44           H        ILE  44  -5.592   0.897  -6.897
  355    HA   ILE  44           HA       ILE  44  -7.703  -0.199  -5.166
  356    HB   ILE  44           HB       ILE  44  -6.346  -1.487  -7.547
  357   1HG1  ILE  44          2HG1      ILE  44  -9.137  -0.344  -7.277
  358   2HG1  ILE  44          1HG1      ILE  44  -7.817   0.390  -8.182
  359   1HG2  ILE  44          1HG2      ILE  44  -8.671  -2.409  -5.862
  360   2HG2  ILE  44          2HG2      ILE  44  -7.060  -3.125  -5.903
  361   3HG2  ILE  44          3HG2      ILE  44  -8.096  -3.201  -7.329
  362   1HD1  ILE  44          1HD1      ILE  44  -7.775  -1.558  -9.671
  363   2HD1  ILE  44          2HD1      ILE  44  -9.337  -0.737  -9.675
  364   3HD1  ILE  44          3HD1      ILE  44  -9.137  -2.246  -8.784
  365    HA   PRO  45           HA       PRO  45  -4.228  -1.857  -2.816
  366   1HB   PRO  45          2HB       PRO  45  -6.315  -2.826  -1.017
  367   2HB   PRO  45          1HB       PRO  45  -5.025  -1.666  -0.698
  368   1HG   PRO  45          2HG       PRO  45  -7.631  -0.947  -0.842
  369   2HG   PRO  45          1HG       PRO  45  -6.307   0.134  -1.312
  370   1HD   PRO  45          2HD       PRO  45  -8.116  -1.510  -3.044
  371   2HD   PRO  45          1HD       PRO  45  -7.523   0.148  -3.287
  372    H    VAL  46           H        VAL  46  -3.528  -3.590  -3.957
  373    HA   VAL  46           HA       VAL  46  -5.257  -5.781  -4.631
  374    HB   VAL  46           HB       VAL  46  -2.240  -5.643  -4.824
  375   1HG1  VAL  46          1HG1      VAL  46  -4.233  -7.442  -6.196
  376   2HG1  VAL  46          2HG1      VAL  46  -3.070  -7.915  -4.958
  377   3HG1  VAL  46          3HG1      VAL  46  -2.504  -7.382  -6.544
  378   1HG2  VAL  46          1HG2      VAL  46  -2.603  -5.021  -7.180
  379   2HG2  VAL  46          2HG2      VAL  46  -3.239  -3.814  -6.062
  380   3HG2  VAL  46          3HG2      VAL  46  -4.339  -4.931  -6.872
  381    H    LEU  47           H        LEU  47  -6.013  -6.783  -2.836
  382    HA   LEU  47           HA       LEU  47  -4.162  -7.542  -0.722
  383   1HB   LEU  47          2HB       LEU  47  -7.167  -7.805  -0.898
  384   2HB   LEU  47          1HB       LEU  47  -6.200  -8.203   0.511
  385    HG   LEU  47           HG       LEU  47  -6.501  -5.450  -0.693
  386   1HD1  LEU  47          1HD1      LEU  47  -8.528  -6.213   0.419
  387   2HD1  LEU  47          2HD1      LEU  47  -7.742  -4.930   1.338
  388   3HD1  LEU  47          3HD1      LEU  47  -7.597  -6.607   1.865
  389   1HD2  LEU  47          1HD2      LEU  47  -5.285  -4.673   1.270
  390   2HD2  LEU  47          2HD2      LEU  47  -4.302  -5.781   0.313
  391   3HD2  LEU  47          3HD2      LEU  47  -5.062  -6.338   1.803
  392    H    LEU  48           H        LEU  48  -3.890  -8.842  -3.207
  393    HA   LEU  48           HA       LEU  48  -5.030 -11.492  -2.900
  394   1HB   LEU  48          2HB       LEU  48  -3.079 -10.372  -4.914
  395   2HB   LEU  48          1HB       LEU  48  -3.698 -12.012  -4.942
  396    HG   LEU  48           HG       LEU  48  -5.352  -9.503  -5.265
  397   1HD1  LEU  48          1HD1      LEU  48  -4.537 -11.604  -7.266
  398   2HD1  LEU  48          2HD1      LEU  48  -3.943  -9.945  -7.202
  399   3HD1  LEU  48          3HD1      LEU  48  -5.639 -10.261  -7.571
  400   1HD2  LEU  48          1HD2      LEU  48  -7.167 -11.062  -5.837
  401   2HD2  LEU  48          2HD2      LEU  48  -6.626 -11.249  -4.170
  402   3HD2  LEU  48          3HD2      LEU  48  -6.125 -12.414  -5.395
  403    H    ILE  49           H        ILE  49  -4.126 -12.999  -1.686
  404    HA   ILE  49           HA       ILE  49  -1.704 -12.652  -0.306
  405    HB   ILE  49           HB       ILE  49  -3.125 -15.268  -0.847
  406   1HG1  ILE  49          2HG1      ILE  49  -3.520 -13.350   1.466
  407   2HG1  ILE  49          1HG1      ILE  49  -4.612 -13.478   0.089
  408   1HG2  ILE  49          1HG2      ILE  49  -0.880 -15.533   0.076
  409   2HG2  ILE  49          2HG2      ILE  49  -2.108 -15.991   1.259
  410   3HG2  ILE  49          3HG2      ILE  49  -1.290 -14.434   1.394
  411   1HD1  ILE  49          1HD1      ILE  49  -3.981 -15.675   2.047
  412   2HD1  ILE  49          2HD1      ILE  49  -5.111 -15.775   0.695
  413   3HD1  ILE  49          3HD1      ILE  49  -5.436 -14.680   2.037
  414    H    ASP  50           H        ASP  50  -2.504 -14.285  -3.293
  415    HA   ASP  50           HA       ASP  50  -0.049 -15.607  -3.724
  416   1HB   ASP  50          2HB       ASP  50  -2.066 -16.199  -4.943
  417   2HB   ASP  50          1HB       ASP  50  -2.119 -14.605  -5.686
  418    H    GLU  51           H        GLU  51  -1.069 -12.325  -4.223
  419    HA   GLU  51           HA       GLU  51   1.342 -11.677  -5.736
  420   1HB   GLU  51          2HB       GLU  51  -1.238 -10.287  -5.186
  421   2HB   GLU  51          1HB       GLU  51   0.180  -9.297  -5.515
  422   1HG   GLU  51          2HG       GLU  51  -0.741 -11.516  -7.320
  423   2HG   GLU  51          1HG       GLU  51  -1.256  -9.840  -7.497
  424    H    ALA  52           H        ALA  52   0.350 -11.861  -2.558
  425    HA   ALA  52           HA       ALA  52   1.704  -9.605  -1.478
  426   1HB   ALA  52          1HB       ALA  52   1.388 -10.681   0.688
  427   2HB   ALA  52          2HB       ALA  52   0.918 -12.178  -0.113
  428   3HB   ALA  52          3HB       ALA  52  -0.097 -10.747  -0.260
  429    H    THR  53           H        THR  53   3.788  -9.343  -1.054
  430    HA   THR  53           HA       THR  53   5.552 -11.693  -1.266
  431    HB   THR  53           HB       THR  53   6.446  -8.838  -1.618
  432    HG1  THR  53           1HG      THR  53   4.705 -10.029  -3.175
  433   1HG2  THR  53          1HG2      THR  53   7.531 -11.460  -2.649
  434   2HG2  THR  53          2HG2      THR  53   8.173 -10.543  -1.290
  435   3HG2  THR  53          3HG2      THR  53   8.245  -9.871  -2.917
  436    H    GLU  54           H        GLU  54   7.206 -11.910   0.304
  437    HA   GLU  54           HA       GLU  54   6.579 -10.908   2.891
  438   1HB   GLU  54          2HB       GLU  54   9.145 -12.198   1.924
  439   2HB   GLU  54          1HB       GLU  54   8.659 -12.000   3.604
  440   1HG   GLU  54          2HG       GLU  54   6.727 -13.454   3.203
  441   2HG   GLU  54          1HG       GLU  54   7.252 -13.673   1.534
  442    H    TRP  55           H        TRP  55   7.221  -9.055   3.846
  443    HA   TRP  55           HA       TRP  55   8.420  -7.166   2.010
  444   1HB   TRP  55          2HB       TRP  55   6.324  -6.620   3.219
  445   2HB   TRP  55          1HB       TRP  55   7.215  -6.677   4.735
  446    HD1  TRP  55           HD       TRP  55   7.528  -4.281   5.558
  447    HE1  TRP  55           1HE      TRP  55   8.208  -2.034   4.499
  448    HE3  TRP  55           3HE      TRP  55   7.894  -5.754   0.683
  449    HZ2  TRP  55           2HZ      TRP  55   8.829  -1.024   1.938
  450    HZ3  TRP  55           3HZ      TRP  55   8.540  -4.097  -1.008
  451    HH2  TRP  55           HH       TRP  55   8.998  -1.779  -0.394
  452    H    THR  56           H        THR  56  10.241  -6.040   2.283
  453    HA   THR  56           HA       THR  56  11.618  -6.060   4.818
  454    HB   THR  56           HB       THR  56  12.649  -7.989   3.802
  455    HG1  THR  56           1HG      THR  56  14.443  -5.805   3.474
  456   1HG2  THR  56          1HG2      THR  56  13.856  -7.877   1.667
  457   2HG2  THR  56          2HG2      THR  56  13.270  -6.231   1.430
  458   3HG2  THR  56          3HG2      THR  56  12.131  -7.577   1.457
  459    HA   PRO  57           HA       PRO  57  11.810  -1.854   3.299
  460   1HB   PRO  57          2HB       PRO  57  13.153  -1.393   5.878
  461   2HB   PRO  57          1HB       PRO  57  11.667  -0.678   5.243
  462   1HG   PRO  57          2HG       PRO  57  11.624  -2.469   7.243
  463   2HG   PRO  57          1HG       PRO  57  10.346  -2.403   6.015
  464   1HD   PRO  57          2HD       PRO  57  12.658  -4.294   6.244
  465   2HD   PRO  57          1HD       PRO  57  10.970  -4.625   5.798
  466    H    ASN  58           H        ASN  58  13.634  -0.151   3.383
  467    HA   ASN  58           HA       ASN  58  15.948  -1.356   2.206
  468   1HB   ASN  58          2HB       ASN  58  14.862   0.816   1.446
  469   2HB   ASN  58          1HB       ASN  58  15.571   1.565   2.873
  470   1HD2  ASN  58          1HD2      ASN  58  16.746   2.965   1.522
  471   2HD2  ASN  58          2HD2      ASN  58  18.171   2.420   0.695
  472    H    ASN  59           H        ASN  59  15.007  -0.630   5.273
  473    HA   ASN  59           HA       ASN  59  17.757  -0.868   6.258
  474   1HB   ASN  59          2HB       ASN  59  17.168   0.551   8.195
  475   2HB   ASN  59          1HB       ASN  59  17.062   1.430   6.678
  476   1HD2  ASN  59          1HD2      ASN  59  15.803   1.877   9.305
  477   2HD2  ASN  59          2HD2      ASN  59  14.107   1.967   9.001
  478    H    LEU  60           H        LEU  60  18.074  -2.456   7.696
  479    HA   LEU  60           HA       LEU  60  15.691  -3.950   8.547
  480   1HB   LEU  60          2HB       LEU  60  18.532  -4.805   8.072
  481   2HB   LEU  60          1HB       LEU  60  17.427  -5.793   9.006
  482    HG   LEU  60           HG       LEU  60  15.897  -5.776   6.977
  483   1HD1  LEU  60          1HD1      LEU  60  18.390  -4.783   5.607
  484   2HD1  LEU  60          2HD1      LEU  60  16.896  -3.870   5.821
  485   3HD1  LEU  60          3HD1      LEU  60  16.908  -5.320   4.819
  486   1HD2  LEU  60          1HD2      LEU  60  17.146  -7.550   5.861
  487   2HD2  LEU  60          2HD2      LEU  60  17.231  -7.708   7.615
  488   3HD2  LEU  60          3HD2      LEU  60  18.609  -7.067   6.720
  489    H    GLU  61           H        GLU  61  15.080  -3.219  10.465
  490    HA   GLU  61           HA       GLU  61  16.887  -2.462  12.549
  491   1HB   GLU  61          2HB       GLU  61  13.977  -3.251  12.825
  492   2HB   GLU  61          1HB       GLU  61  14.917  -2.272  13.940
  493   1HG   GLU  61          2HG       GLU  61  15.050  -0.488  12.312
  494   2HG   GLU  61          1HG       GLU  61  14.204  -1.486  11.128
  Start of MODEL   13
    1   1H    MET   1          1HT       MET   1  -3.858  12.485  -3.435
    2   2H    MET   1          2HT       MET   1  -4.920  13.298  -2.387
    3   3H    MET   1          3HT       MET   1  -3.727  12.263  -1.762
    4    HA   MET   1           HA       MET   1  -1.987  13.701  -2.518
    5   1HB   MET   1          2HB       MET   1  -3.127  14.556  -4.516
    6   2HB   MET   1          1HB       MET   1  -4.254  15.447  -3.505
    7   1HG   MET   1          2HG       MET   1  -2.436  16.816  -2.660
    8   2HG   MET   1          1HG       MET   1  -1.287  15.907  -3.639
    9   1HE   MET   1          1HE       MET   1  -4.280  18.446  -3.652
   10   2HE   MET   1          2HE       MET   1  -4.926  17.080  -4.563
   11   3HE   MET   1          3HE       MET   1  -4.602  18.610  -5.379
   12    H    SER   2           H        SER   2  -5.025  15.273  -1.481
   13    HA   SER   2           HA       SER   2  -3.683  15.940   1.055
   14   1HB   SER   2          2HB       SER   2  -5.672  17.727  -0.363
   15   2HB   SER   2          1HB       SER   2  -4.690  18.122   1.048
   16    HG   SER   2           HG       SER   2  -4.000  18.857  -1.180
   17    H    LEU   3           H        LEU   3  -4.634  14.330   2.233
   18    HA   LEU   3           HA       LEU   3  -6.217  13.083   3.279
   19   1HB   LEU   3          2HB       LEU   3  -7.531  15.795   3.271
   20   2HB   LEU   3          1HB       LEU   3  -8.249  14.416   4.077
   21    HG   LEU   3           HG       LEU   3  -7.126  15.677   5.737
   22   1HD1  LEU   3          1HD1      LEU   3  -5.384  13.338   4.991
   23   2HD1  LEU   3          2HD1      LEU   3  -6.863  13.275   5.948
   24   3HD1  LEU   3          3HD1      LEU   3  -5.447  14.121   6.569
   25   1HD2  LEU   3          1HD2      LEU   3  -4.683  15.614   3.978
   26   2HD2  LEU   3          2HD2      LEU   3  -4.754  16.263   5.616
   27   3HD2  LEU   3          3HD2      LEU   3  -5.688  17.019   4.327
   28    H    ASP   4           H        ASP   4  -6.660  11.670   1.579
   29    HA   ASP   4           HA       ASP   4  -9.020  12.338  -0.035
   30   1HB   ASP   4          2HB       ASP   4  -6.946  12.339  -1.365
   31   2HB   ASP   4          1HB       ASP   4  -6.666  10.662  -0.900
   32    HA   PRO   5           HA       PRO   5 -10.332   8.565   2.222
   33   1HB   PRO   5          2HB       PRO   5 -12.993   9.693   1.694
   34   2HB   PRO   5          1HB       PRO   5 -12.255   9.234   3.231
   35   1HG   PRO   5          2HG       PRO   5 -12.671  11.807   2.562
   36   2HG   PRO   5          1HG       PRO   5 -11.272  11.295   3.527
   37   1HD   PRO   5          2HD       PRO   5 -11.419  11.968   0.608
   38   2HD   PRO   5          1HD       PRO   5 -10.177  12.397   1.803
   39    H    GLN   6           H        GLN   6 -10.423   9.616  -0.894
   40    HA   GLN   6           HA       GLN   6 -12.278   7.722  -2.008
   41   1HB   GLN   6          2HB       GLN   6 -10.085   9.381  -3.273
   42   2HB   GLN   6          1HB       GLN   6 -11.203   8.371  -4.175
   43   1HG   GLN   6          2HG       GLN   6 -12.114  10.596  -2.380
   44   2HG   GLN   6          1HG       GLN   6 -11.740  10.822  -4.091
   45   1HE2  GLN   6          1HE2      GLN   6 -13.939   9.364  -1.804
   46   2HE2  GLN   6          2HE2      GLN   6 -15.189   9.002  -2.949
   47    H    LEU   7           H        LEU   7  -8.730   8.028  -1.927
   48    HA   LEU   7           HA       LEU   7  -8.302   5.337  -2.817
   49   1HB   LEU   7          2HB       LEU   7  -6.458   7.338  -1.515
   50   2HB   LEU   7          1HB       LEU   7  -5.940   5.784  -2.138
   51    HG   LEU   7           HG       LEU   7  -7.153   7.989  -3.811
   52   1HD1  LEU   7          1HD1      LEU   7  -4.861   8.244  -4.694
   53   2HD1  LEU   7          2HD1      LEU   7  -4.287   7.133  -3.452
   54   3HD1  LEU   7          3HD1      LEU   7  -5.000   8.681  -2.990
   55   1HD2  LEU   7          1HD2      LEU   7  -7.548   5.748  -4.697
   56   2HD2  LEU   7          2HD2      LEU   7  -5.823   5.400  -4.591
   57   3HD2  LEU   7          3HD2      LEU   7  -6.406   6.641  -5.698
   58    H    LEU   8           H        LEU   8  -8.472   6.962   0.292
   59    HA   LEU   8           HA       LEU   8  -7.443   4.612   1.672
   60   1HB   LEU   8          2HB       LEU   8  -8.260   7.309   2.754
   61   2HB   LEU   8          1HB       LEU   8  -7.477   6.036   3.670
   62    HG   LEU   8           HG       LEU   8  -6.261   7.514   1.333
   63   1HD1  LEU   8          1HD1      LEU   8  -4.800   8.521   3.003
   64   2HD1  LEU   8          2HD1      LEU   8  -5.663   7.672   4.285
   65   3HD1  LEU   8          3HD1      LEU   8  -6.489   8.905   3.335
   66   1HD2  LEU   8          1HD2      LEU   8  -5.468   5.209   1.491
   67   2HD2  LEU   8          2HD2      LEU   8  -5.076   5.456   3.193
   68   3HD2  LEU   8          3HD2      LEU   8  -4.203   6.349   1.951
   69    H    GLU   9           H        GLU   9  -8.817   3.049   2.102
   70    HA   GLU   9           HA       GLU   9 -11.297   3.761   3.508
   71   1HB   GLU   9          2HB       GLU   9 -11.760   2.947   1.162
   72   2HB   GLU   9          1HB       GLU   9 -11.018   1.417   1.607
   73   1HG   GLU   9          2HG       GLU   9 -12.720   1.051   3.293
   74   2HG   GLU   9          1HG       GLU   9 -13.450   2.612   2.924
   75    H    VAL  10           H        VAL  10 -11.991   2.008   5.017
   76    HA   VAL  10           HA       VAL  10  -9.736   1.084   6.509
   77    HB   VAL  10           HB       VAL  10 -12.638   0.353   6.928
   78   1HG1  VAL  10          1HG1      VAL  10 -11.064  -1.083   8.121
   79   2HG1  VAL  10          2HG1      VAL  10 -11.949  -0.048   9.243
   80   3HG1  VAL  10          3HG1      VAL  10 -10.282   0.339   8.814
   81   1HG2  VAL  10          1HG2      VAL  10 -12.697   2.195   8.542
   82   2HG2  VAL  10          2HG2      VAL  10 -12.371   2.775   6.904
   83   3HG2  VAL  10          3HG2      VAL  10 -11.054   2.647   8.078
   84    H    LEU  11           H        LEU  11  -8.569  -0.430   5.466
   85    HA   LEU  11           HA       LEU  11  -9.960  -2.791   4.405
   86   1HB   LEU  11          2HB       LEU  11  -7.131  -1.868   3.873
   87   2HB   LEU  11          1HB       LEU  11  -7.971  -3.173   3.063
   88    HG   LEU  11           HG       LEU  11  -8.670  -0.240   2.876
   89   1HD1  LEU  11          1HD1      LEU  11  -6.615  -0.788   1.712
   90   2HD1  LEU  11          2HD1      LEU  11  -7.908  -0.420   0.573
   91   3HD1  LEU  11          3HD1      LEU  11  -7.430  -2.096   0.855
   92   1HD2  LEU  11          1HD2      LEU  11 -10.242  -0.942   1.127
   93   2HD2  LEU  11          2HD2      LEU  11 -10.658  -1.621   2.701
   94   3HD2  LEU  11          3HD2      LEU  11  -9.879  -2.632   1.484
   95    H    ALA  12           H        ALA  12  -9.013  -4.892   4.788
   96    HA   ALA  12           HA       ALA  12  -7.297  -5.015   7.179
   97   1HB   ALA  12          1HB       ALA  12  -9.618  -5.363   7.879
   98   2HB   ALA  12          2HB       ALA  12  -8.651  -6.826   8.086
   99   3HB   ALA  12          3HB       ALA  12  -9.763  -6.687   6.725
  100    H    CYS  13           H        CYS  13  -6.591  -7.404   7.513
  101    HA   CYS  13           HA       CYS  13  -5.302  -8.185   5.034
  102   1HB   CYS  13          2HB       CYS  13  -4.963  -9.390   7.782
  103   2HB   CYS  13          1HB       CYS  13  -3.872  -9.535   6.409
  104    HG   CYS  13           HG       CYS  13  -4.356  -6.850   8.447
  105    HA   PRO  14           HA       PRO  14  -8.308 -11.442   4.411
  106   1HB   PRO  14          2HB       PRO  14  -7.249 -12.456   2.148
  107   2HB   PRO  14          1HB       PRO  14  -8.098 -10.905   2.177
  108   1HG   PRO  14          2HG       PRO  14  -5.157 -11.456   2.192
  109   2HG   PRO  14          1HG       PRO  14  -6.061 -10.234   1.279
  110   1HD   PRO  14          2HD       PRO  14  -4.695  -9.697   3.583
  111   2HD   PRO  14          1HD       PRO  14  -6.120  -8.782   3.052
  112    H    LYS  15           H        LYS  15  -6.377 -11.998   6.389
  113    HA   LYS  15           HA       LYS  15  -6.234 -14.855   6.105
  114   1HB   LYS  15          2HB       LYS  15  -4.129 -14.291   5.032
  115   2HB   LYS  15          1HB       LYS  15  -3.679 -13.256   6.380
  116   1HG   LYS  15          2HG       LYS  15  -3.400 -15.109   7.829
  117   2HG   LYS  15          1HG       LYS  15  -4.154 -16.209   6.675
  118   1HD   LYS  15          2HD       LYS  15  -1.614 -14.706   6.087
  119   2HD   LYS  15          1HD       LYS  15  -1.630 -16.303   6.834
  120   1HE   LYS  15          2HE       LYS  15  -2.845 -15.613   4.159
  121   2HE   LYS  15          1HE       LYS  15  -1.290 -16.406   4.398
  122   1HZ   LYS  15          1HZ       LYS  15  -2.431 -18.246   5.477
  123   2HZ   LYS  15          2HZ       LYS  15  -3.032 -18.005   3.908
  124   3HZ   LYS  15          3HZ       LYS  15  -3.927 -17.480   5.245
  125    H    ASP  16           H        ASP  16  -4.426 -12.544   8.137
  126    HA   ASP  16           HA       ASP  16  -5.469 -13.874  10.517
  127   1HB   ASP  16          2HB       ASP  16  -3.739 -12.787  11.723
  128   2HB   ASP  16          1HB       ASP  16  -3.005 -13.228  10.184
  129    H    LYS  17           H        LYS  17  -5.977 -11.113   8.611
  130    HA   LYS  17           HA       LYS  17  -7.283  -9.277   8.734
  131   1HB   LYS  17          2HB       LYS  17  -8.968 -11.077   9.264
  132   2HB   LYS  17          1HB       LYS  17  -8.737 -10.697  10.965
  133   1HG   LYS  17          2HG       LYS  17  -9.737  -8.606  10.764
  134   2HG   LYS  17          1HG       LYS  17  -9.515  -8.563   9.013
  135   1HD   LYS  17          2HD       LYS  17 -11.858  -8.955   9.669
  136   2HD   LYS  17          1HD       LYS  17 -11.189 -10.279   8.717
  137   1HE   LYS  17          2HE       LYS  17 -10.741 -11.492  10.843
  138   2HE   LYS  17          1HE       LYS  17 -11.577 -10.204  11.706
  139   1HZ   LYS  17          1HZ       LYS  17 -12.948 -12.206  11.178
  140   2HZ   LYS  17          2HZ       LYS  17 -12.837 -11.787   9.539
  141   3HZ   LYS  17          3HZ       LYS  17 -13.599 -10.737  10.635
  142    H    GLY  18           H        GLY  18  -4.908  -9.031   9.950
  143   1HA   GLY  18          2HA       GLY  18  -5.426  -7.609  12.463
  144   2HA   GLY  18          1HA       GLY  18  -3.846  -8.047  11.831
  145    HA   PRO  19           HA       PRO  19  -4.839  -3.564  10.894
  146   1HB   PRO  19          2HB       PRO  19  -2.805  -2.422  12.259
  147   2HB   PRO  19          1HB       PRO  19  -4.350  -2.828  13.014
  148   1HG   PRO  19          2HG       PRO  19  -1.750  -4.309  13.090
  149   2HG   PRO  19          1HG       PRO  19  -2.911  -4.014  14.399
  150   1HD   PRO  19          2HD       PRO  19  -2.758  -6.372  13.023
  151   2HD   PRO  19          1HD       PRO  19  -4.251  -5.771  13.769
  152    H    LEU  20           H        LEU  20  -4.156  -2.834   9.016
  153    HA   LEU  20           HA       LEU  20  -1.588  -3.639   7.930
  154   1HB   LEU  20          2HB       LEU  20  -3.924  -2.108   6.803
  155   2HB   LEU  20          1HB       LEU  20  -2.417  -2.300   5.930
  156    HG   LEU  20           HG       LEU  20  -4.110  -4.619   6.865
  157   1HD1  LEU  20          1HD1      LEU  20  -3.964  -3.325   4.147
  158   2HD1  LEU  20          2HD1      LEU  20  -5.351  -3.300   5.236
  159   3HD1  LEU  20          3HD1      LEU  20  -4.810  -4.823   4.531
  160   1HD2  LEU  20          1HD2      LEU  20  -1.803  -4.432   4.930
  161   2HD2  LEU  20          2HD2      LEU  20  -2.742  -5.886   5.273
  162   3HD2  LEU  20          3HD2      LEU  20  -1.754  -5.155   6.540
  163    H    ARG  21           H        ARG  21   0.179  -2.435   7.949
  164    HA   ARG  21           HA       ARG  21   0.070   0.311   8.921
  165   1HB   ARG  21          2HB       ARG  21   1.760  -1.321   9.765
  166   2HB   ARG  21          1HB       ARG  21   2.437  -1.408   8.149
  167   1HG   ARG  21          2HG       ARG  21   3.051   0.952   8.273
  168   2HG   ARG  21          1HG       ARG  21   2.354   1.044   9.894
  169   1HD   ARG  21          2HD       ARG  21   3.933  -0.710  10.632
  170   2HD   ARG  21          1HD       ARG  21   4.671  -0.688   9.033
  171    HE   ARG  21           HE       ARG  21   4.748   1.917   9.985
  172   1HH1  ARG  21          1HH1      ARG  21   6.038  -1.208  10.919
  173   2HH1  ARG  21          2HH1      ARG  21   7.450  -0.540  11.667
  174   1HH2  ARG  21          1HH2      ARG  21   6.585   2.796  11.004
  175   2HH2  ARG  21          2HH2      ARG  21   7.761   1.732  11.722
  176    H    TYR  22           H        TYR  22  -0.124   1.948   7.505
  177    HA   TYR  22           HA       TYR  22   0.221   1.331   4.672
  178   1HB   TYR  22          2HB       TYR  22  -1.935   2.242   5.322
  179   2HB   TYR  22          1HB       TYR  22  -1.158   3.638   6.055
  180    HD1  TYR  22           1HD      TYR  22  -1.559   5.553   4.854
  181    HD2  TYR  22           2HD      TYR  22  -0.866   1.933   2.732
  182    HE1  TYR  22           1HE      TYR  22  -1.733   6.772   2.730
  183    HE2  TYR  22           2HE      TYR  22  -1.041   3.145   0.598
  184    HH   TYR  22           HH       TYR  22  -0.988   6.534   0.406
  185    H    LEU  23           H        LEU  23   1.759   2.151   3.445
  186    HA   LEU  23           HA       LEU  23   3.408   4.353   4.512
  187   1HB   LEU  23          2HB       LEU  23   4.065   2.137   2.572
  188   2HB   LEU  23          1HB       LEU  23   5.078   3.552   2.755
  189    HG   LEU  23           HG       LEU  23   5.300   2.930   5.206
  190   1HD1  LEU  23          1HD1      LEU  23   3.411   1.411   5.389
  191   2HD1  LEU  23          2HD1      LEU  23   4.918   0.586   5.790
  192   3HD1  LEU  23          3HD1      LEU  23   4.158   0.319   4.221
  193   1HD2  LEU  23          1HD2      LEU  23   7.040   1.289   4.765
  194   2HD2  LEU  23          2HD2      LEU  23   7.072   2.585   3.571
  195   3HD2  LEU  23          3HD2      LEU  23   6.385   1.017   3.150
  196    H    GLU  24           H        GLU  24   2.667   6.218   3.699
  197    HA   GLU  24           HA       GLU  24   1.114   6.452   1.365
  198   1HB   GLU  24          2HB       GLU  24   2.643   8.590   2.858
  199   2HB   GLU  24          1HB       GLU  24   1.439   8.899   1.618
  200   1HG   GLU  24          2HG       GLU  24   0.235   9.210   3.544
  201   2HG   GLU  24          1HG       GLU  24  -0.135   7.533   3.156
  202    H    SER  25           H        SER  25   4.545   6.512   1.831
  203    HA   SER  25           HA       SER  25   5.216   8.087  -0.422
  204   1HB   SER  25          2HB       SER  25   6.926   6.040   1.002
  205   2HB   SER  25          1HB       SER  25   7.497   7.356  -0.024
  206    HG   SER  25           HG       SER  25   6.437   7.432   2.575
  207    H    GLU  26           H        GLU  26   4.661   4.629  -0.038
  208    HA   GLU  26           HA       GLU  26   5.322   4.287  -2.887
  209   1HB   GLU  26          2HB       GLU  26   5.913   2.373  -0.627
  210   2HB   GLU  26          1HB       GLU  26   6.123   1.992  -2.331
  211   1HG   GLU  26          2HG       GLU  26   7.765   3.800  -2.519
  212   2HG   GLU  26          1HG       GLU  26   7.563   4.153  -0.805
  213    H    GLN  27           H        GLN  27   2.800   4.441  -0.953
  214    HA   GLN  27           HA       GLN  27   0.701   3.583  -0.859
  215   1HB   GLN  27          2HB       GLN  27   1.522   3.388  -3.674
  216   2HB   GLN  27          1HB       GLN  27   0.196   2.325  -3.240
  217   1HG   GLN  27          2HG       GLN  27  -0.667   4.400  -4.079
  218   2HG   GLN  27          1HG       GLN  27  -1.037   4.258  -2.363
  219   1HE2  GLN  27          1HE2      GLN  27  -1.288   6.435  -2.079
  220   2HE2  GLN  27          2HE2      GLN  27   0.034   7.554  -2.121
  221    H    LEU  28           H        LEU  28   2.224   2.019   0.547
  222    HA   LEU  28           HA       LEU  28   1.565  -0.723  -0.295
  223   1HB   LEU  28          2HB       LEU  28   3.901   0.237   1.353
  224   2HB   LEU  28          1HB       LEU  28   3.483  -1.449   1.123
  225    HG   LEU  28           HG       LEU  28   4.274   0.452  -1.084
  226   1HD1  LEU  28          1HD1      LEU  28   5.837  -1.755   0.254
  227   2HD1  LEU  28          2HD1      LEU  28   6.136  -0.027   0.421
  228   3HD1  LEU  28          3HD1      LEU  28   6.364  -0.813  -1.141
  229   1HD2  LEU  28          1HD2      LEU  28   3.813  -2.531  -1.095
  230   2HD2  LEU  28          2HD2      LEU  28   4.410  -1.573  -2.450
  231   3HD2  LEU  28          3HD2      LEU  28   2.776  -1.318  -1.842
  232    H    LEU  29           H        LEU  29   0.487  -1.993   1.073
  233    HA   LEU  29           HA       LEU  29  -0.028  -0.991   3.800
  234   1HB   LEU  29          2HB       LEU  29  -1.589  -2.950   2.093
  235   2HB   LEU  29          1HB       LEU  29  -1.958  -2.583   3.766
  236    HG   LEU  29           HG       LEU  29  -2.002  -0.522   1.560
  237   1HD1  LEU  29          1HD1      LEU  29  -4.433  -0.735   1.646
  238   2HD1  LEU  29          2HD1      LEU  29  -4.280  -2.068   2.788
  239   3HD1  LEU  29          3HD1      LEU  29  -3.679  -2.247   1.140
  240   1HD2  LEU  29          1HD2      LEU  29  -1.651   0.341   3.832
  241   2HD2  LEU  29          2HD2      LEU  29  -3.105  -0.503   4.364
  242   3HD2  LEU  29          3HD2      LEU  29  -3.225   0.803   3.186
  243    H    VAL  30           H        VAL  30   1.337  -1.927   5.183
  244    HA   VAL  30           HA       VAL  30   2.289  -4.638   4.533
  245    HB   VAL  30           HB       VAL  30   3.712  -2.545   6.185
  246   1HG1  VAL  30          1HG1      VAL  30   4.617  -5.223   5.135
  247   2HG1  VAL  30          2HG1      VAL  30   4.354  -4.778   6.824
  248   3HG1  VAL  30          3HG1      VAL  30   5.667  -4.035   5.909
  249   1HG2  VAL  30          1HG2      VAL  30   5.222  -2.282   4.273
  250   2HG2  VAL  30          2HG2      VAL  30   3.563  -1.841   3.855
  251   3HG2  VAL  30          3HG2      VAL  30   4.221  -3.391   3.335
  252    H    ASN  31           H        ASN  31   1.684  -6.211   5.849
  253    HA   ASN  31           HA       ASN  31   0.925  -5.570   8.608
  254   1HB   ASN  31          2HB       ASN  31  -0.547  -7.078   7.269
  255   2HB   ASN  31          1HB       ASN  31   0.789  -8.208   7.104
  256   1HD2  ASN  31          1HD2      ASN  31  -1.837  -8.617   8.279
  257   2HD2  ASN  31          2HD2      ASN  31  -1.564  -9.128   9.909
  258    H    GLU  32           H        GLU  32   2.508  -5.589  10.058
  259    HA   GLU  32           HA       GLU  32   5.087  -6.674   9.346
  260   1HB   GLU  32          2HB       GLU  32   4.734  -4.438  10.466
  261   2HB   GLU  32          1HB       GLU  32   4.286  -5.313  11.921
  262   1HG   GLU  32          2HG       GLU  32   6.500  -6.360  11.962
  263   2HG   GLU  32          1HG       GLU  32   6.946  -5.437  10.526
  264    H    ARG  33           H        ARG  33   2.352  -7.760  10.948
  265    HA   ARG  33           HA       ARG  33   3.668  -9.481  12.856
  266   1HB   ARG  33          2HB       ARG  33   0.802  -9.696  11.943
  267   2HB   ARG  33          1HB       ARG  33   1.485 -10.151  13.500
  268   1HG   ARG  33          2HG       ARG  33   1.811  -7.835  14.081
  269   2HG   ARG  33          1HG       ARG  33   1.276  -7.329  12.478
  270   1HD   ARG  33          2HD       ARG  33  -0.632  -7.010  13.734
  271   2HD   ARG  33          1HD       ARG  33  -0.892  -8.625  13.079
  272    HE   ARG  33           HE       ARG  33   0.330  -8.416  15.724
  273   1HH1  ARG  33          1HH1      ARG  33  -2.453  -9.196  13.747
  274   2HH1  ARG  33          2HH1      ARG  33  -3.354  -9.890  15.060
  275   1HH2  ARG  33          1HH2      ARG  33  -0.870  -9.304  17.466
  276   2HH2  ARG  33          2HH2      ARG  33  -2.455  -9.954  17.164
  277    H    LEU  34           H        LEU  34   2.220  -9.716   9.662
  278    HA   LEU  34           HA       LEU  34   2.930 -12.554   9.490
  279   1HB   LEU  34          2HB       LEU  34   1.433 -10.778   7.563
  280   2HB   LEU  34          1HB       LEU  34   1.742 -12.484   7.318
  281    HG   LEU  34           HG       LEU  34   0.050 -11.291   9.512
  282   1HD1  LEU  34          1HD1      LEU  34  -1.802 -12.376   8.327
  283   2HD1  LEU  34          2HD1      LEU  34  -0.689 -12.874   7.051
  284   3HD1  LEU  34          3HD1      LEU  34  -1.008 -11.161   7.328
  285   1HD2  LEU  34          1HD2      LEU  34   0.555 -14.188   8.826
  286   2HD2  LEU  34          2HD2      LEU  34  -0.518 -13.578  10.087
  287   3HD2  LEU  34          3HD2      LEU  34   1.225 -13.339  10.219
  288    H    ASN  35           H        ASN  35   4.149  -9.500   8.682
  289    HA   ASN  35           HA       ASN  35   5.972  -8.759   7.549
  290   1HB   ASN  35          2HB       ASN  35   6.971 -10.922   8.555
  291   2HB   ASN  35          1HB       ASN  35   6.749 -11.617   6.954
  292   1HD2  ASN  35          1HD2      ASN  35   8.058 -10.943   5.268
  293   2HD2  ASN  35          2HD2      ASN  35   9.475  -9.980   5.508
  294    H    LEU  36           H        LEU  36   3.418  -9.303   6.298
  295    HA   LEU  36           HA       LEU  36   4.269  -9.726   3.511
  296   1HB   LEU  36          2HB       LEU  36   1.604 -10.338   4.785
  297   2HB   LEU  36          1HB       LEU  36   1.929 -10.446   3.066
  298    HG   LEU  36           HG       LEU  36   3.266 -12.113   5.203
  299   1HD1  LEU  36          1HD1      LEU  36   1.973 -13.958   4.316
  300   2HD1  LEU  36          2HD1      LEU  36   1.207 -12.881   3.146
  301   3HD1  LEU  36          3HD1      LEU  36   0.903 -12.669   4.871
  302   1HD2  LEU  36          1HD2      LEU  36   4.173 -13.387   3.309
  303   2HD2  LEU  36          2HD2      LEU  36   4.737 -11.716   3.302
  304   3HD2  LEU  36          3HD2      LEU  36   3.462 -12.221   2.192
  305    H    ALA  37           H        ALA  37   3.626  -8.269   1.986
  306    HA   ALA  37           HA       ALA  37   2.170  -5.916   2.987
  307   1HB   ALA  37          1HB       ALA  37   3.594  -4.515   1.595
  308   2HB   ALA  37          2HB       ALA  37   4.488  -5.939   1.056
  309   3HB   ALA  37          3HB       ALA  37   4.560  -5.441   2.747
  310    H    TYR  38           H        TYR  38   0.631  -5.077   1.724
  311    HA   TYR  38           HA       TYR  38   0.122  -6.361  -0.878
  312   1HB   TYR  38          2HB       TYR  38  -1.817  -4.912   0.945
  313   2HB   TYR  38          1HB       TYR  38  -2.223  -5.711  -0.573
  314    HD1  TYR  38           1HD      TYR  38  -1.478  -6.181   2.967
  315    HD2  TYR  38           2HD      TYR  38  -2.226  -8.167  -0.721
  316    HE1  TYR  38           1HE      TYR  38  -1.878  -8.279   4.185
  317    HE2  TYR  38           2HE      TYR  38  -2.632 -10.269   0.489
  318    HH   TYR  38           HH       TYR  38  -2.045 -11.294   2.637
  319    H    ARG  39           H        ARG  39  -0.173  -5.056  -2.665
  320    HA   ARG  39           HA       ARG  39   0.877  -2.342  -2.307
  321   1HB   ARG  39          2HB       ARG  39   1.437  -2.467  -4.712
  322   2HB   ARG  39          1HB       ARG  39   2.189  -3.755  -3.780
  323   1HG   ARG  39          2HG       ARG  39   0.506  -5.327  -4.540
  324   2HG   ARG  39          1HG       ARG  39  -0.313  -4.041  -5.429
  325   1HD   ARG  39          2HD       ARG  39   1.545  -3.787  -6.910
  326   2HD   ARG  39          1HD       ARG  39   2.534  -4.875  -5.935
  327    HE   ARG  39           HE       ARG  39   0.097  -5.994  -7.056
  328   1HH1  ARG  39          1HH1      ARG  39   3.525  -5.490  -7.448
  329   2HH1  ARG  39          2HH1      ARG  39   3.765  -6.932  -8.397
  330   1HH2  ARG  39          1HH2      ARG  39   0.392  -7.883  -8.332
  331   2HH2  ARG  39          2HH2      ARG  39   1.982  -8.293  -8.890
  332    H    ILE  40           H        ILE  40  -0.185  -0.554  -3.002
  333    HA   ILE  40           HA       ILE  40  -2.839  -0.903  -4.187
  334    HB   ILE  40           HB       ILE  40  -1.451   1.640  -3.308
  335   1HG1  ILE  40          2HG1      ILE  40  -3.615   0.027  -1.937
  336   2HG1  ILE  40          1HG1      ILE  40  -1.932   0.114  -1.428
  337   1HG2  ILE  40          1HG2      ILE  40  -4.311   1.136  -4.112
  338   2HG2  ILE  40          2HG2      ILE  40  -3.107   2.023  -5.050
  339   3HG2  ILE  40          3HG2      ILE  40  -3.669   2.662  -3.505
  340   1HD1  ILE  40          1HD1      ILE  40  -2.191   2.493  -0.982
  341   2HD1  ILE  40          2HD1      ILE  40  -3.352   1.533  -0.066
  342   3HD1  ILE  40          3HD1      ILE  40  -3.871   2.410  -1.504
  343    H    ASP  41           H        ASP  41  -3.013  -0.924  -6.329
  344    HA   ASP  41           HA       ASP  41  -0.862   0.341  -7.898
  345   1HB   ASP  41          2HB       ASP  41  -0.630  -2.129  -7.828
  346   2HB   ASP  41          1HB       ASP  41  -2.242  -2.277  -8.522
  347    H    ASP  42           H        ASP  42  -1.555   1.816  -9.240
  348    HA   ASP  42           HA       ASP  42  -2.818   3.034 -10.677
  349   1HB   ASP  42          2HB       ASP  42  -2.907   0.841 -11.879
  350   2HB   ASP  42          1HB       ASP  42  -4.429   0.502 -11.065
  351    H    GLY  43           H        GLY  43  -3.590   2.631  -7.804
  352   1HA   GLY  43          2HA       GLY  43  -5.149   3.915  -6.587
  353   2HA   GLY  43          1HA       GLY  43  -6.201   3.930  -7.996
  354    H    ILE  44           H        ILE  44  -5.215   0.840  -7.766
  355    HA   ILE  44           HA       ILE  44  -7.549   0.084  -6.135
  356    HB   ILE  44           HB       ILE  44  -6.178  -1.503  -8.311
  357   1HG1  ILE  44          2HG1      ILE  44  -8.877  -0.135  -8.336
  358   2HG1  ILE  44          1HG1      ILE  44  -7.433   0.477  -9.136
  359   1HG2  ILE  44          1HG2      ILE  44  -8.090  -3.032  -8.101
  360   2HG2  ILE  44          2HG2      ILE  44  -8.690  -2.080  -6.740
  361   3HG2  ILE  44          3HG2      ILE  44  -7.152  -2.936  -6.610
  362   1HD1  ILE  44          1HD1      ILE  44  -7.383  -1.530 -10.537
  363   2HD1  ILE  44          2HD1      ILE  44  -8.881  -0.618 -10.722
  364   3HD1  ILE  44          3HD1      ILE  44  -8.860  -2.094  -9.757
  365    HA   PRO  45           HA       PRO  45  -4.401  -1.610  -3.382
  366   1HB   PRO  45          2HB       PRO  45  -6.741  -2.435  -1.809
  367   2HB   PRO  45          1HB       PRO  45  -5.406  -1.374  -1.356
  368   1HG   PRO  45          2HG       PRO  45  -7.893  -0.431  -1.788
  369   2HG   PRO  45          1HG       PRO  45  -6.442   0.511  -2.191
  370   1HD   PRO  45          2HD       PRO  45  -8.234  -1.083  -3.993
  371   2HD   PRO  45          1HD       PRO  45  -7.496   0.513  -4.261
  372    H    VAL  46           H        VAL  46  -3.586  -3.441  -4.224
  373    HA   VAL  46           HA       VAL  46  -5.283  -5.646  -4.996
  374    HB   VAL  46           HB       VAL  46  -2.262  -5.529  -4.912
  375   1HG1  VAL  46          1HG1      VAL  46  -3.164  -7.799  -5.009
  376   2HG1  VAL  46          2HG1      VAL  46  -2.342  -7.364  -6.508
  377   3HG1  VAL  46          3HG1      VAL  46  -4.105  -7.363  -6.435
  378   1HG2  VAL  46          1HG2      VAL  46  -4.142  -4.914  -7.188
  379   2HG2  VAL  46          2HG2      VAL  46  -2.387  -5.026  -7.313
  380   3HG2  VAL  46          3HG2      VAL  46  -3.122  -3.760  -6.332
  381    H    LEU  47           H        LEU  47  -6.219  -6.384  -3.103
  382    HA   LEU  47           HA       LEU  47  -4.422  -7.296  -0.971
  383   1HB   LEU  47          2HB       LEU  47  -7.430  -7.012  -0.928
  384   2HB   LEU  47          1HB       LEU  47  -6.404  -7.393   0.441
  385    HG   LEU  47           HG       LEU  47  -6.393  -4.778  -1.072
  386   1HD1  LEU  47          1HD1      LEU  47  -8.426  -5.052   0.212
  387   2HD1  LEU  47          2HD1      LEU  47  -7.376  -3.864   0.987
  388   3HD1  LEU  47          3HD1      LEU  47  -7.495  -5.497   1.642
  389   1HD2  LEU  47          1HD2      LEU  47  -4.950  -3.991   0.738
  390   2HD2  LEU  47          2HD2      LEU  47  -4.206  -5.325  -0.144
  391   3HD2  LEU  47          3HD2      LEU  47  -4.934  -5.609   1.435
  392    H    LEU  48           H        LEU  48  -3.808  -9.088  -2.421
  393    HA   LEU  48           HA       LEU  48  -5.776 -11.266  -2.250
  394   1HB   LEU  48          2HB       LEU  48  -3.779 -10.657  -4.416
  395   2HB   LEU  48          1HB       LEU  48  -4.440 -12.264  -4.207
  396    HG   LEU  48           HG       LEU  48  -6.745 -11.165  -4.444
  397   1HD1  LEU  48          1HD1      LEU  48  -6.791  -9.093  -5.740
  398   2HD1  LEU  48          2HD1      LEU  48  -5.040  -8.955  -5.571
  399   3HD1  LEU  48          3HD1      LEU  48  -6.074  -8.857  -4.147
  400   1HD2  LEU  48          1HD2      LEU  48  -6.610 -11.225  -6.892
  401   2HD2  LEU  48          2HD2      LEU  48  -5.778 -12.592  -6.147
  402   3HD2  LEU  48          3HD2      LEU  48  -4.848 -11.233  -6.784
  403    H    ILE  49           H        ILE  49  -5.000 -13.322  -1.711
  404    HA   ILE  49           HA       ILE  49  -3.133 -13.194   0.404
  405    HB   ILE  49           HB       ILE  49  -4.246 -15.692  -0.878
  406   1HG1  ILE  49          2HG1      ILE  49  -5.399 -14.053   1.392
  407   2HG1  ILE  49          1HG1      ILE  49  -6.023 -14.061  -0.254
  408   1HG2  ILE  49          1HG2      ILE  49  -2.402 -16.107   0.640
  409   2HG2  ILE  49          2HG2      ILE  49  -3.916 -16.647   1.364
  410   3HG2  ILE  49          3HG2      ILE  49  -3.181 -15.132   1.885
  411   1HD1  ILE  49          1HD1      ILE  49  -5.921 -16.422   1.610
  412   2HD1  ILE  49          2HD1      ILE  49  -6.544 -16.434  -0.042
  413   3HD1  ILE  49          3HD1      ILE  49  -7.351 -15.474   1.198
  414    H    ASP  50           H        ASP  50  -2.968 -14.687  -2.827
  415    HA   ASP  50           HA       ASP  50  -0.353 -15.799  -2.349
  416   1HB   ASP  50          2HB       ASP  50  -1.782 -15.444  -4.998
  417   2HB   ASP  50          1HB       ASP  50  -0.403 -16.488  -4.684
  418    H    GLU  51           H        GLU  51  -1.688 -12.931  -3.742
  419    HA   GLU  51           HA       GLU  51   0.686 -12.136  -5.136
  420   1HB   GLU  51          2HB       GLU  51  -1.961 -10.818  -4.575
  421   2HB   GLU  51          1HB       GLU  51  -0.657  -9.957  -5.378
  422   1HG   GLU  51          2HG       GLU  51  -2.357 -10.923  -6.909
  423   2HG   GLU  51          1HG       GLU  51  -0.709 -11.446  -7.234
  424    H    ALA  52           H        ALA  52  -0.097 -12.151  -1.937
  425    HA   ALA  52           HA       ALA  52   0.850  -9.674  -1.005
  426   1HB   ALA  52          1HB       ALA  52  -0.387 -11.224   0.421
  427   2HB   ALA  52          2HB       ALA  52   1.167 -10.802   1.141
  428   3HB   ALA  52          3HB       ALA  52   0.955 -12.365   0.353
  429    H    THR  53           H        THR  53   2.836  -8.857  -0.889
  430    HA   THR  53           HA       THR  53   5.071 -10.602  -1.678
  431    HB   THR  53           HB       THR  53   5.122  -7.595  -1.625
  432    HG1  THR  53           1HG      THR  53   3.430  -8.894  -3.053
  433   1HG2  THR  53          1HG2      THR  53   6.657  -9.645  -3.225
  434   2HG2  THR  53          2HG2      THR  53   7.277  -8.697  -1.874
  435   3HG2  THR  53          3HG2      THR  53   6.829  -7.896  -3.378
  436    H    GLU  54           H        GLU  54   6.968 -10.608  -0.434
  437    HA   GLU  54           HA       GLU  54   6.570  -9.924   2.345
  438   1HB   GLU  54          2HB       GLU  54   8.805 -10.937   2.689
  439   2HB   GLU  54          1HB       GLU  54   7.678 -12.012   1.875
  440   1HG   GLU  54          2HG       GLU  54   8.736 -11.521  -0.262
  441   2HG   GLU  54          1HG       GLU  54   9.847 -10.410   0.542
  442    H    TRP  55           H        TRP  55   7.607  -8.349   3.499
  443    HA   TRP  55           HA       TRP  55   9.150  -6.408   1.922
  444   1HB   TRP  55          2HB       TRP  55   6.827  -5.635   2.165
  445   2HB   TRP  55          1HB       TRP  55   6.950  -5.793   3.912
  446    HD1  TRP  55           HD       TRP  55   7.760  -3.708   5.204
  447    HE1  TRP  55           1HE      TRP  55   8.726  -1.411   4.544
  448    HE3  TRP  55           3HE      TRP  55   8.419  -4.511   0.194
  449    HZ2  TRP  55           2HZ      TRP  55   9.632  -0.114   2.210
  450    HZ3  TRP  55           3HZ      TRP  55   9.339  -2.687  -1.182
  451    HH2  TRP  55           HH       TRP  55   9.932  -0.536  -0.190
  452    H    THR  56           H        THR  56  10.732  -5.255   3.040
  453    HA   THR  56           HA       THR  56  11.469  -6.339   5.658
  454    HB   THR  56           HB       THR  56  13.106  -4.481   3.945
  455    HG1  THR  56           1HG      THR  56  13.215  -7.335   3.973
  456   1HG2  THR  56          1HG2      THR  56  13.843  -6.438   6.125
  457   2HG2  THR  56          2HG2      THR  56  13.842  -4.678   6.258
  458   3HG2  THR  56          3HG2      THR  56  14.990  -5.478   5.186
  459    HA   PRO  57           HA       PRO  57   9.455  -2.500   6.989
  460   1HB   PRO  57          2HB       PRO  57   9.639  -3.683   9.662
  461   2HB   PRO  57          1HB       PRO  57   8.206  -3.236   8.734
  462   1HG   PRO  57          2HG       PRO  57   8.873  -5.807   9.201
  463   2HG   PRO  57          1HG       PRO  57   8.063  -5.293   7.709
  464   1HD   PRO  57          2HD       PRO  57  10.959  -5.900   8.182
  465   2HD   PRO  57          1HD       PRO  57   9.926  -6.345   6.805
  466    H    ASN  58           H        ASN  58  10.725  -0.768   7.122
  467    HA   ASN  58           HA       ASN  58  13.209  -0.834   8.614
  468   1HB   ASN  58          2HB       ASN  58  12.971   0.404   6.443
  469   2HB   ASN  58          1HB       ASN  58  11.879   1.523   7.253
  470   1HD2  ASN  58          1HD2      ASN  58  13.073   3.343   7.183
  471   2HD2  ASN  58          2HD2      ASN  58  14.618   3.527   7.940
  472    H    ASN  59           H        ASN  59  13.071  -0.679  10.786
  473    HA   ASN  59           HA       ASN  59  11.212   1.329  11.875
  474   1HB   ASN  59          2HB       ASN  59  11.936  -1.373  13.018
  475   2HB   ASN  59          1HB       ASN  59  11.144  -0.115  13.960
  476   1HD2  ASN  59          1HD2      ASN  59  10.772  -2.585  11.625
  477   2HD2  ASN  59          2HD2      ASN  59   9.052  -2.455  11.438
  478    H    LEU  60           H        LEU  60  12.777   2.924  11.917
  479    HA   LEU  60           HA       LEU  60  14.184   4.304  12.999
  480   1HB   LEU  60          2HB       LEU  60  13.041   3.533  15.013
  481   2HB   LEU  60          1HB       LEU  60  14.159   2.187  15.139
  482    HG   LEU  60           HG       LEU  60  16.008   3.881  15.338
  483   1HD1  LEU  60          1HD1      LEU  60  14.899   5.812  14.427
  484   2HD1  LEU  60          2HD1      LEU  60  15.357   6.137  16.100
  485   3HD1  LEU  60          3HD1      LEU  60  13.681   5.760  15.702
  486   1HD2  LEU  60          1HD2      LEU  60  13.884   3.834  17.479
  487   2HD2  LEU  60          2HD2      LEU  60  15.562   4.320  17.715
  488   3HD2  LEU  60          3HD2      LEU  60  15.180   2.659  17.265
  489    H    GLU  61           H        GLU  61  16.075   4.558  12.016
  490    HA   GLU  61           HA       GLU  61  18.031   2.450  11.859
  491   1HB   GLU  61          2HB       GLU  61  18.135   5.381  11.136
  492   2HB   GLU  61          1HB       GLU  61  19.492   4.287  10.922
  493   1HG   GLU  61          2HG       GLU  61  18.101   2.911   9.421
  494   2HG   GLU  61          1HG       GLU  61  16.801   4.091   9.590
  Start of MODEL   14
    1   1H    MET   1          1HT       MET   1  -3.280  20.033   9.320
    2   2H    MET   1          2HT       MET   1  -1.704  20.285   9.879
    3   3H    MET   1          3HT       MET   1  -3.017  20.486  10.932
    4    HA   MET   1           HA       MET   1  -2.164  17.943   9.680
    5   1HB   MET   1          2HB       MET   1  -0.720  18.940  11.543
    6   2HB   MET   1          1HB       MET   1  -2.099  18.698  12.604
    7   1HG   MET   1          2HG       MET   1  -0.789  16.474  11.058
    8   2HG   MET   1          1HG       MET   1  -0.338  16.924  12.698
    9   1HE   MET   1          1HE       MET   1  -0.762  14.437  13.535
   10   2HE   MET   1          2HE       MET   1  -1.159  13.989  11.877
   11   3HE   MET   1          3HE       MET   1  -2.242  13.538  13.198
   12    H    SER   2           H        SER   2  -4.048  17.037   9.096
   13    HA   SER   2           HA       SER   2  -6.135  16.832  11.171
   14   1HB   SER   2          2HB       SER   2  -6.641  17.110   8.199
   15   2HB   SER   2          1HB       SER   2  -7.852  17.049   9.478
   16    HG   SER   2           HG       SER   2  -5.938  19.011   9.801
   17    H    LEU   3           H        LEU   3  -6.895  14.810  11.526
   18    HA   LEU   3           HA       LEU   3  -5.883  12.657   9.828
   19   1HB   LEU   3          2HB       LEU   3  -5.631  12.414  12.262
   20   2HB   LEU   3          1HB       LEU   3  -7.367  12.548  12.457
   21    HG   LEU   3           HG       LEU   3  -7.653  10.455  11.168
   22   1HD1  LEU   3          1HD1      LEU   3  -5.617  10.554   9.835
   23   2HD1  LEU   3          2HD1      LEU   3  -5.710   9.039  10.734
   24   3HD1  LEU   3          3HD1      LEU   3  -4.645  10.328  11.289
   25   1HD2  LEU   3          1HD2      LEU   3  -6.845   8.954  12.919
   26   2HD2  LEU   3          2HD2      LEU   3  -7.584  10.403  13.601
   27   3HD2  LEU   3          3HD2      LEU   3  -5.827  10.244  13.557
   28    H    ASP   4           H        ASP   4  -7.087  12.232   8.123
   29    HA   ASP   4           HA       ASP   4 -10.012  12.344   8.415
   30   1HB   ASP   4          2HB       ASP   4  -9.014  14.016   6.823
   31   2HB   ASP   4          1HB       ASP   4  -8.477  12.661   5.833
   32    HA   PRO   5           HA       PRO   5  -9.074   7.897   7.781
   33   1HB   PRO   5          2HB       PRO   5 -11.626   7.574   9.200
   34   2HB   PRO   5          1HB       PRO   5 -10.034   6.923   9.594
   35   1HG   PRO   5          2HG       PRO   5 -11.166   8.871  11.058
   36   2HG   PRO   5          1HG       PRO   5  -9.414   8.795  10.788
   37   1HD   PRO   5          2HD       PRO   5 -11.464  10.515   9.437
   38   2HD   PRO   5          1HD       PRO   5  -9.842  10.943  10.024
   39    H    GLN   6           H        GLN   6 -11.465  10.011   6.692
   40    HA   GLN   6           HA       GLN   6 -13.172   8.144   5.372
   41   1HB   GLN   6          2HB       GLN   6 -13.788  10.514   5.924
   42   2HB   GLN   6          1HB       GLN   6 -12.682  11.049   4.672
   43   1HG   GLN   6          2HG       GLN   6 -14.736   9.094   3.853
   44   2HG   GLN   6          1HG       GLN   6 -15.308  10.703   4.290
   45   1HE2  GLN   6          1HE2      GLN   6 -13.504   8.826   1.998
   46   2HE2  GLN   6          2HE2      GLN   6 -13.323  10.076   0.810
   47    H    LEU   7           H        LEU   7 -10.292   9.971   4.493
   48    HA   LEU   7           HA       LEU   7 -10.221   8.887   1.815
   49   1HB   LEU   7          2HB       LEU   7  -8.186  10.488   3.365
   50   2HB   LEU   7          1HB       LEU   7  -8.059  10.076   1.666
   51    HG   LEU   7           HG       LEU   7 -10.194  11.827   2.892
   52   1HD1  LEU   7          1HD1      LEU   7  -8.015  12.905   2.874
   53   2HD1  LEU   7          2HD1      LEU   7  -9.089  13.635   1.681
   54   3HD1  LEU   7          3HD1      LEU   7  -7.825  12.520   1.162
   55   1HD2  LEU   7          1HD2      LEU   7 -10.820  12.297   0.573
   56   2HD2  LEU   7          2HD2      LEU   7 -11.031  10.594   0.974
   57   3HD2  LEU   7          3HD2      LEU   7  -9.644  11.108   0.017
   58    H    LEU   8           H        LEU   8  -9.856   7.303   4.510
   59    HA   LEU   8           HA       LEU   8  -7.469   5.820   3.633
   60   1HB   LEU   8          2HB       LEU   8  -8.290   6.423   6.474
   61   2HB   LEU   8          1HB       LEU   8  -6.971   5.364   6.013
   62    HG   LEU   8           HG       LEU   8  -7.104   8.321   5.400
   63   1HD1  LEU   8          1HD1      LEU   8  -5.359   8.541   7.098
   64   2HD1  LEU   8          2HD1      LEU   8  -5.515   6.826   7.483
   65   3HD1  LEU   8          3HD1      LEU   8  -6.861   7.926   7.788
   66   1HD2  LEU   8          1HD2      LEU   8  -5.814   7.041   3.763
   67   2HD2  LEU   8          2HD2      LEU   8  -4.859   6.334   5.065
   68   3HD2  LEU   8          3HD2      LEU   8  -4.771   8.065   4.747
   69    H    GLU   9           H        GLU   9 -10.294   5.575   5.791
   70    HA   GLU   9           HA       GLU   9 -11.693   3.889   6.320
   71   1HB   GLU   9          2HB       GLU   9 -10.861   3.020   3.575
   72   2HB   GLU   9          1HB       GLU   9 -11.887   1.989   4.563
   73   1HG   GLU   9          2HG       GLU   9 -12.500   4.816   3.733
   74   2HG   GLU   9          1HG       GLU   9 -13.197   3.353   3.040
   75    H    VAL  10           H        VAL  10 -11.653   1.200   6.203
   76    HA   VAL  10           HA       VAL  10  -9.309   0.612   7.841
   77    HB   VAL  10           HB       VAL  10 -11.831  -1.014   7.493
   78   1HG1  VAL  10          1HG1      VAL  10  -9.918  -2.352   8.189
   79   2HG1  VAL  10          2HG1      VAL  10 -11.086  -2.189   9.501
   80   3HG1  VAL  10          3HG1      VAL  10  -9.607  -1.230   9.515
   81   1HG2  VAL  10          1HG2      VAL  10 -12.464  -0.158   9.701
   82   2HG2  VAL  10          2HG2      VAL  10 -12.325   1.140   8.514
   83   3HG2  VAL  10          3HG2      VAL  10 -11.044   0.885   9.701
   84    H    LEU  11           H        LEU  11  -7.648  -0.129   6.718
   85    HA   LEU  11           HA       LEU  11  -8.124  -2.063   4.566
   86   1HB   LEU  11          2HB       LEU  11  -5.649  -0.453   5.216
   87   2HB   LEU  11          1HB       LEU  11  -5.806  -1.573   3.874
   88    HG   LEU  11           HG       LEU  11  -7.442   0.943   4.222
   89   1HD1  LEU  11          1HD1      LEU  11  -6.101   1.836   2.401
   90   2HD1  LEU  11          2HD1      LEU  11  -5.141   0.356   2.368
   91   3HD1  LEU  11          3HD1      LEU  11  -5.081   1.415   3.779
   92   1HD2  LEU  11          1HD2      LEU  11  -7.231  -0.993   1.918
   93   2HD2  LEU  11          2HD2      LEU  11  -8.148   0.512   1.922
   94   3HD2  LEU  11          3HD2      LEU  11  -8.619  -0.808   2.993
   95    H    ALA  12           H        ALA  12  -8.027  -4.101   5.197
   96    HA   ALA  12           HA       ALA  12  -6.096  -4.818   7.299
   97   1HB   ALA  12          1HB       ALA  12  -7.702  -6.460   8.140
   98   2HB   ALA  12          2HB       ALA  12  -8.871  -5.932   6.931
   99   3HB   ALA  12          3HB       ALA  12  -8.358  -4.824   8.201
  100    H    CYS  13           H        CYS  13  -5.530  -7.124   7.315
  101    HA   CYS  13           HA       CYS  13  -4.784  -8.003   4.687
  102   1HB   CYS  13          2HB       CYS  13  -3.235  -8.224   6.557
  103   2HB   CYS  13          1HB       CYS  13  -4.389  -9.227   7.428
  104    HG   CYS  13           HG       CYS  13  -2.988 -10.175   4.448
  105    HA   PRO  14           HA       PRO  14  -8.390 -10.568   4.046
  106   1HB   PRO  14          2HB       PRO  14  -6.813 -11.858   1.939
  107   2HB   PRO  14          1HB       PRO  14  -8.285 -10.893   1.804
  108   1HG   PRO  14          2HG       PRO  14  -5.898  -9.983   0.956
  109   2HG   PRO  14          1HG       PRO  14  -7.127  -8.907   1.644
  110   1HD   PRO  14          2HD       PRO  14  -4.672 -10.052   2.929
  111   2HD   PRO  14          1HD       PRO  14  -5.344  -8.410   3.040
  112    H    LYS  15           H        LYS  15  -6.397 -11.438   6.011
  113    HA   LYS  15           HA       LYS  15  -6.649 -14.347   5.651
  114   1HB   LYS  15          2HB       LYS  15  -4.424 -12.715   6.827
  115   2HB   LYS  15          1HB       LYS  15  -4.711 -14.343   7.423
  116   1HG   LYS  15          2HG       LYS  15  -4.319 -15.275   5.252
  117   2HG   LYS  15          1HG       LYS  15  -4.213 -13.664   4.534
  118   1HD   LYS  15          2HD       LYS  15  -2.176 -13.200   5.623
  119   2HD   LYS  15          1HD       LYS  15  -2.381 -14.549   6.743
  120   1HE   LYS  15          2HE       LYS  15  -2.092 -14.959   3.780
  121   2HE   LYS  15          1HE       LYS  15  -0.698 -14.848   4.852
  122   1HZ   LYS  15          1HZ       LYS  15  -1.479 -16.741   6.077
  123   2HZ   LYS  15          2HZ       LYS  15  -1.409 -17.154   4.432
  124   3HZ   LYS  15          3HZ       LYS  15  -2.906 -16.820   5.162
  125    H    ASP  16           H        ASP  16  -6.084 -12.008   8.286
  126    HA   ASP  16           HA       ASP  16  -8.211 -13.343   9.817
  127   1HB   ASP  16          2HB       ASP  16  -5.825 -14.050  10.418
  128   2HB   ASP  16          1HB       ASP  16  -5.613 -12.421  11.048
  129    H    LYS  17           H        LYS  17  -7.856 -10.727   8.294
  130    HA   LYS  17           HA       LYS  17  -8.711  -8.633   8.437
  131   1HB   LYS  17          2HB       LYS  17  -9.814  -9.719  11.021
  132   2HB   LYS  17          1HB       LYS  17 -10.099  -8.064  10.514
  133   1HG   LYS  17          2HG       LYS  17 -12.002  -9.280   9.880
  134   2HG   LYS  17          1HG       LYS  17 -11.091  -9.016   8.394
  135   1HD   LYS  17          2HD       LYS  17 -10.200 -11.284   8.528
  136   2HD   LYS  17          1HD       LYS  17 -11.069 -11.547  10.041
  137   1HE   LYS  17          2HE       LYS  17 -12.240 -12.538   8.125
  138   2HE   LYS  17          1HE       LYS  17 -13.192 -11.275   8.903
  139   1HZ   LYS  17          1HZ       LYS  17 -11.538 -10.858   6.477
  140   2HZ   LYS  17          2HZ       LYS  17 -12.625  -9.757   7.170
  141   3HZ   LYS  17          3HZ       LYS  17 -13.203 -11.176   6.444
  142    H    GLY  18           H        GLY  18  -6.061  -9.450   9.714
  143   1HA   GLY  18          2HA       GLY  18  -5.564  -7.605  11.818
  144   2HA   GLY  18          1HA       GLY  18  -4.343  -8.410  10.843
  145    HA   PRO  19           HA       PRO  19  -5.524  -3.843   9.465
  146   1HB   PRO  19          2HB       PRO  19  -3.875  -2.804  11.691
  147   2HB   PRO  19          1HB       PRO  19  -5.430  -2.232  11.079
  148   1HG   PRO  19          2HG       PRO  19  -5.261  -3.520  13.413
  149   2HG   PRO  19          1HG       PRO  19  -6.636  -3.769  12.319
  150   1HD   PRO  19          2HD       PRO  19  -4.238  -5.511  12.775
  151   2HD   PRO  19          1HD       PRO  19  -5.943  -5.970  12.574
  152    H    LEU  20           H        LEU  20  -4.208  -2.937   8.008
  153    HA   LEU  20           HA       LEU  20  -1.407  -3.806   7.950
  154   1HB   LEU  20          2HB       LEU  20  -3.030  -2.462   5.782
  155   2HB   LEU  20          1HB       LEU  20  -1.447  -3.193   5.603
  156    HG   LEU  20           HG       LEU  20  -3.979  -4.705   6.257
  157   1HD1  LEU  20          1HD1      LEU  20  -3.818  -5.556   3.976
  158   2HD1  LEU  20          2HD1      LEU  20  -2.432  -4.507   3.678
  159   3HD1  LEU  20          3HD1      LEU  20  -4.019  -3.804   3.991
  160   1HD2  LEU  20          1HD2      LEU  20  -1.196  -5.650   5.595
  161   2HD2  LEU  20          2HD2      LEU  20  -2.611  -6.685   5.783
  162   3HD2  LEU  20          3HD2      LEU  20  -1.994  -5.771   7.162
  163    H    ARG  21           H        ARG  21   0.289  -2.281   7.611
  164    HA   ARG  21           HA       ARG  21  -0.303   0.405   8.541
  165   1HB   ARG  21          2HB       ARG  21   1.752  -0.744   9.323
  166   2HB   ARG  21          1HB       ARG  21   2.344  -0.784   7.666
  167   1HG   ARG  21          2HG       ARG  21   2.235   1.703   7.638
  168   2HG   ARG  21          1HG       ARG  21   1.836   1.651   9.354
  169   1HD   ARG  21          2HD       ARG  21   4.336   0.472   8.153
  170   2HD   ARG  21          1HD       ARG  21   4.241   2.085   8.850
  171    HE   ARG  21           HE       ARG  21   4.246  -0.457  10.282
  172   1HH1  ARG  21          1HH1      ARG  21   3.780   3.023  10.438
  173   2HH1  ARG  21          2HH1      ARG  21   4.173   3.120  12.131
  174   1HH2  ARG  21          1HH2      ARG  21   4.732  -0.343  12.488
  175   2HH2  ARG  21          2HH2      ARG  21   4.680   1.192  13.315
  176    H    TYR  22           H        TYR  22  -0.856   1.982   7.221
  177    HA   TYR  22           HA       TYR  22  -0.599   1.623   4.350
  178   1HB   TYR  22          2HB       TYR  22  -2.719   2.448   5.272
  179   2HB   TYR  22          1HB       TYR  22  -1.892   3.832   5.972
  180    HD1  TYR  22           1HD      TYR  22  -1.280   5.733   4.608
  181    HD2  TYR  22           2HD      TYR  22  -3.084   2.305   2.848
  182    HE1  TYR  22           1HE      TYR  22  -1.712   7.022   2.559
  183    HE2  TYR  22           2HE      TYR  22  -3.514   3.583   0.790
  184    HH   TYR  22           HH       TYR  22  -3.783   5.921   0.098
  185    H    LEU  23           H        LEU  23   1.328   2.083   3.523
  186    HA   LEU  23           HA       LEU  23   2.899   4.299   4.526
  187   1HB   LEU  23          2HB       LEU  23   3.339   2.475   2.155
  188   2HB   LEU  23          1HB       LEU  23   4.482   3.680   2.719
  189    HG   LEU  23           HG       LEU  23   3.585   1.246   4.266
  190   1HD1  LEU  23          1HD1      LEU  23   5.061   0.737   2.380
  191   2HD1  LEU  23          2HD1      LEU  23   5.853   0.456   3.930
  192   3HD1  LEU  23          3HD1      LEU  23   6.235   1.901   2.992
  193   1HD2  LEU  23          1HD2      LEU  23   4.053   3.139   5.731
  194   2HD2  LEU  23          2HD2      LEU  23   5.619   3.362   4.946
  195   3HD2  LEU  23          3HD2      LEU  23   5.297   1.898   5.878
  196    H    GLU  24           H        GLU  24   2.465   6.301   3.964
  197    HA   GLU  24           HA       GLU  24   0.755   6.874   1.708
  198   1HB   GLU  24          2HB       GLU  24   1.512   9.286   2.793
  199   2HB   GLU  24          1HB       GLU  24   0.072   8.379   3.217
  200   1HG   GLU  24          2HG       GLU  24   1.131   9.006   5.234
  201   2HG   GLU  24          1HG       GLU  24   1.407   7.280   5.025
  202    H    SER  25           H        SER  25   4.069   6.971   2.502
  203    HA   SER  25           HA       SER  25   4.911   8.854   0.556
  204   1HB   SER  25          2HB       SER  25   7.148   7.474   1.021
  205   2HB   SER  25          1HB       SER  25   6.495   8.629   2.183
  206    HG   SER  25           HG       SER  25   5.779   7.020   3.434
  207    H    GLU  26           H        GLU  26   5.171   5.279   0.609
  208    HA   GLU  26           HA       GLU  26   5.691   5.393  -2.284
  209   1HB   GLU  26          2HB       GLU  26   6.395   3.286  -0.243
  210   2HB   GLU  26          1HB       GLU  26   6.667   3.113  -1.972
  211   1HG   GLU  26          2HG       GLU  26   8.160   5.023  -1.950
  212   2HG   GLU  26          1HG       GLU  26   7.857   5.259  -0.230
  213    H    GLN  27           H        GLN  27   3.159   4.962  -0.374
  214    HA   GLN  27           HA       GLN  27   1.179   3.888  -0.427
  215   1HB   GLN  27          2HB       GLN  27   1.883   4.238  -3.294
  216   2HB   GLN  27          1HB       GLN  27   0.483   3.248  -2.902
  217   1HG   GLN  27          2HG       GLN  27  -0.448   5.330  -3.177
  218   2HG   GLN  27          1HG       GLN  27  -0.226   5.257  -1.433
  219   1HE2  GLN  27          1HE2      GLN  27  -0.530   7.595  -2.971
  220   2HE2  GLN  27          2HE2      GLN  27   0.925   8.521  -2.829
  221    H    LEU  28           H        LEU  28   2.262   2.160   0.749
  222    HA   LEU  28           HA       LEU  28   1.843  -0.379  -0.661
  223   1HB   LEU  28          2HB       LEU  28   4.117   0.264   1.226
  224   2HB   LEU  28          1HB       LEU  28   3.709  -1.354   0.691
  225    HG   LEU  28           HG       LEU  28   4.598   0.886  -1.128
  226   1HD1  LEU  28          1HD1      LEU  28   6.109  -1.526  -0.116
  227   2HD1  LEU  28          2HD1      LEU  28   6.382   0.143   0.390
  228   3HD1  LEU  28          3HD1      LEU  28   6.703  -0.340  -1.278
  229   1HD2  LEU  28          1HD2      LEU  28   3.139  -0.748  -2.227
  230   2HD2  LEU  28          2HD2      LEU  28   4.171  -2.057  -1.653
  231   3HD2  LEU  28          3HD2      LEU  28   4.800  -0.882  -2.808
  232    H    LEU  29           H        LEU  29   0.933  -2.007   0.609
  233    HA   LEU  29           HA       LEU  29   0.051  -1.155   3.289
  234   1HB   LEU  29          2HB       LEU  29  -1.163  -3.176   1.396
  235   2HB   LEU  29          1HB       LEU  29  -1.737  -2.872   3.025
  236    HG   LEU  29           HG       LEU  29  -1.753  -0.898   0.745
  237   1HD1  LEU  29          1HD1      LEU  29  -4.193  -1.114   0.920
  238   2HD1  LEU  29          2HD1      LEU  29  -3.982  -2.388   2.120
  239   3HD1  LEU  29          3HD1      LEU  29  -3.415  -2.631   0.466
  240   1HD2  LEU  29          1HD2      LEU  29  -2.986   0.552   2.261
  241   2HD2  LEU  29          2HD2      LEU  29  -1.378   0.191   2.896
  242   3HD2  LEU  29          3HD2      LEU  29  -2.794  -0.627   3.559
  243    H    VAL  30           H        VAL  30   1.332  -2.019   4.797
  244    HA   VAL  30           HA       VAL  30   2.432  -4.704   4.279
  245    HB   VAL  30           HB       VAL  30   3.654  -2.501   5.946
  246   1HG1  VAL  30          1HG1      VAL  30   4.751  -5.198   5.164
  247   2HG1  VAL  30          2HG1      VAL  30   4.221  -4.715   6.776
  248   3HG1  VAL  30          3HG1      VAL  30   5.624  -3.941   6.040
  249   1HG2  VAL  30          1HG2      VAL  30   5.346  -2.353   4.183
  250   2HG2  VAL  30          2HG2      VAL  30   3.737  -1.952   3.581
  251   3HG2  VAL  30          3HG2      VAL  30   4.445  -3.527   3.222
  252    H    ASN  31           H        ASN  31   1.774  -6.254   5.593
  253    HA   ASN  31           HA       ASN  31   0.475  -5.630   8.113
  254   1HB   ASN  31          2HB       ASN  31  -0.292  -7.521   6.640
  255   2HB   ASN  31          1HB       ASN  31   1.234  -8.335   6.962
  256   1HD2  ASN  31          1HD2      ASN  31  -1.524  -9.120   7.530
  257   2HD2  ASN  31          2HD2      ASN  31  -1.585  -9.430   9.230
  258    H    GLU  32           H        GLU  32   1.643  -5.231   9.865
  259    HA   GLU  32           HA       GLU  32   4.489  -5.751   9.789
  260   1HB   GLU  32          2HB       GLU  32   3.351  -3.579  10.518
  261   2HB   GLU  32          1HB       GLU  32   2.956  -4.418  12.008
  262   1HG   GLU  32          2HG       GLU  32   5.203  -4.602  12.636
  263   2HG   GLU  32          1HG       GLU  32   5.772  -4.218  11.010
  264    H    ARG  33           H        ARG  33   1.832  -7.428  10.826
  265    HA   ARG  33           HA       ARG  33   3.202  -8.677  13.087
  266   1HB   ARG  33          2HB       ARG  33   0.382  -9.054  12.058
  267   2HB   ARG  33          1HB       ARG  33   1.049  -9.796  13.506
  268   1HG   ARG  33          2HG       ARG  33   1.393  -7.566  14.471
  269   2HG   ARG  33          1HG       ARG  33   0.661  -6.849  13.035
  270   1HD   ARG  33          2HD       ARG  33  -1.430  -7.988  13.503
  271   2HD   ARG  33          1HD       ARG  33  -0.702  -8.798  14.889
  272    HE   ARG  33           HE       ARG  33  -1.446  -5.970  14.702
  273   1HH1  ARG  33          1HH1      ARG  33  -0.131  -8.630  16.558
  274   2HH1  ARG  33          2HH1      ARG  33  -0.290  -7.818  18.086
  275   1HH2  ARG  33          1HH2      ARG  33  -1.691  -4.905  16.715
  276   2HH2  ARG  33          2HH2      ARG  33  -1.174  -5.695  18.177
  277    H    LEU  34           H        LEU  34   2.024  -9.358   9.850
  278    HA   LEU  34           HA       LEU  34   2.982 -12.119  10.077
  279   1HB   LEU  34          2HB       LEU  34   1.273 -10.809   7.965
  280   2HB   LEU  34          1HB       LEU  34   1.781 -12.487   7.944
  281    HG   LEU  34           HG       LEU  34  -0.014 -11.206  10.007
  282   1HD1  LEU  34          1HD1      LEU  34  -1.727 -12.678   9.064
  283   2HD1  LEU  34          2HD1      LEU  34  -0.580 -13.213   7.835
  284   3HD1  LEU  34          3HD1      LEU  34  -1.115 -11.531   7.870
  285   1HD2  LEU  34          1HD2      LEU  34  -0.269 -13.445  10.922
  286   2HD2  LEU  34          2HD2      LEU  34   1.424 -12.950  10.970
  287   3HD2  LEU  34          3HD2      LEU  34   0.870 -14.076   9.732
  288    H    ASN  35           H        ASN  35   3.964  -9.119   8.930
  289    HA   ASN  35           HA       ASN  35   5.778  -8.404   7.763
  290   1HB   ASN  35          2HB       ASN  35   6.594 -11.316   7.864
  291   2HB   ASN  35          1HB       ASN  35   7.626 -10.004   7.309
  292   1HD2  ASN  35          1HD2      ASN  35   6.678  -8.133   9.325
  293   2HD2  ASN  35          2HD2      ASN  35   7.380  -8.638  10.820
  294    H    LEU  36           H        LEU  36   3.381  -9.071   6.371
  295    HA   LEU  36           HA       LEU  36   4.483  -9.846   3.751
  296   1HB   LEU  36          2HB       LEU  36   1.672 -10.222   4.792
  297   2HB   LEU  36          1HB       LEU  36   2.174 -10.546   3.145
  298    HG   LEU  36           HG       LEU  36   3.208 -11.980   5.594
  299   1HD1  LEU  36          1HD1      LEU  36   0.882 -12.527   5.143
  300   2HD1  LEU  36          2HD1      LEU  36   1.931 -13.886   4.734
  301   3HD1  LEU  36          3HD1      LEU  36   1.273 -12.864   3.455
  302   1HD2  LEU  36          1HD2      LEU  36   4.239 -13.506   3.989
  303   2HD2  LEU  36          2HD2      LEU  36   4.865 -11.868   3.804
  304   3HD2  LEU  36          3HD2      LEU  36   3.678 -12.493   2.659
  305    H    ALA  37           H        ALA  37   3.893  -8.593   1.957
  306    HA   ALA  37           HA       ALA  37   2.612  -6.027   2.644
  307   1HB   ALA  37          1HB       ALA  37   5.027  -5.767   2.378
  308   2HB   ALA  37          2HB       ALA  37   4.147  -4.922   1.108
  309   3HB   ALA  37          3HB       ALA  37   4.926  -6.465   0.762
  310    H    TYR  38           H        TYR  38   1.191  -5.166   1.254
  311    HA   TYR  38           HA       TYR  38   0.595  -6.626  -1.240
  312   1HB   TYR  38          2HB       TYR  38  -1.307  -5.014   0.487
  313   2HB   TYR  38          1HB       TYR  38  -1.728  -5.854  -0.999
  314    HD1  TYR  38           1HD      TYR  38  -1.914  -8.288  -1.043
  315    HD2  TYR  38           2HD      TYR  38  -1.007  -6.217   2.558
  316    HE1  TYR  38           1HE      TYR  38  -2.468 -10.305   0.249
  317    HE2  TYR  38           2HE      TYR  38  -1.562  -8.223   3.864
  318    HH   TYR  38           HH       TYR  38  -1.949 -11.273   2.454
  319    H    ARG  39           H        ARG  39  -0.117  -5.272  -3.030
  320    HA   ARG  39           HA       ARG  39   1.266  -2.692  -2.965
  321   1HB   ARG  39          2HB       ARG  39   0.261  -4.346  -5.279
  322   2HB   ARG  39          1HB       ARG  39   1.074  -2.798  -5.441
  323   1HG   ARG  39          2HG       ARG  39   3.069  -3.768  -4.371
  324   2HG   ARG  39          1HG       ARG  39   2.243  -5.328  -4.312
  325   1HD   ARG  39          2HD       ARG  39   2.861  -3.751  -6.809
  326   2HD   ARG  39          1HD       ARG  39   3.750  -5.165  -6.240
  327    HE   ARG  39           HE       ARG  39   1.251  -6.130  -6.426
  328   1HH1  ARG  39          1HH1      ARG  39   3.097  -4.149  -8.667
  329   2HH1  ARG  39          2HH1      ARG  39   2.436  -4.921 -10.083
  330   1HH2  ARG  39          1HH2      ARG  39   0.376  -7.126  -8.265
  331   2HH2  ARG  39          2HH2      ARG  39   0.884  -6.619  -9.853
  332    H    ILE  40           H        ILE  40   0.326  -0.870  -4.079
  333    HA   ILE  40           HA       ILE  40  -2.615  -0.941  -4.235
  334    HB   ILE  40           HB       ILE  40  -0.905   1.473  -3.577
  335   1HG1  ILE  40          2HG1      ILE  40  -2.732  -0.145  -1.779
  336   2HG1  ILE  40          1HG1      ILE  40  -0.974  -0.169  -1.727
  337   1HG2  ILE  40          1HG2      ILE  40  -3.038   2.586  -3.117
  338   2HG2  ILE  40          2HG2      ILE  40  -3.905   1.134  -3.616
  339   3HG2  ILE  40          3HG2      ILE  40  -2.947   2.036  -4.790
  340   1HD1  ILE  40          1HD1      ILE  40  -0.958   2.184  -1.096
  341   2HD1  ILE  40          2HD1      ILE  40  -1.894   1.212   0.037
  342   3HD1  ILE  40          3HD1      ILE  40  -2.720   2.210  -1.155
  343    H    ASP  41           H        ASP  41  -3.489  -0.292  -6.160
  344    HA   ASP  41           HA       ASP  41  -1.588   0.736  -8.163
  345   1HB   ASP  41          2HB       ASP  41  -2.191  -1.619  -8.619
  346   2HB   ASP  41          1HB       ASP  41  -3.891  -1.161  -8.675
  347    H    ASP  42           H        ASP  42  -2.109   2.855  -8.058
  348    HA   ASP  42           HA       ASP  42  -3.216   4.774  -8.543
  349   1HB   ASP  42          2HB       ASP  42  -3.242   3.605 -10.764
  350   2HB   ASP  42          1HB       ASP  42  -4.865   3.036 -10.391
  351    H    GLY  43           H        GLY  43  -4.045   4.126  -6.203
  352   1HA   GLY  43          2HA       GLY  43  -5.778   4.928  -4.854
  353   2HA   GLY  43          1HA       GLY  43  -6.840   4.938  -6.254
  354    H    ILE  44           H        ILE  44  -5.864   2.025  -6.707
  355    HA   ILE  44           HA       ILE  44  -7.874   0.889  -4.879
  356    HB   ILE  44           HB       ILE  44  -6.932  -0.163  -7.553
  357   1HG1  ILE  44          2HG1      ILE  44  -9.558   1.130  -6.772
  358   2HG1  ILE  44          1HG1      ILE  44  -8.295   1.888  -7.737
  359   1HG2  ILE  44          1HG2      ILE  44  -8.783  -1.768  -7.335
  360   2HG2  ILE  44          2HG2      ILE  44  -9.109  -1.156  -5.711
  361   3HG2  ILE  44          3HG2      ILE  44  -7.580  -1.967  -6.059
  362   1HD1  ILE  44          1HD1      ILE  44  -8.609   0.195  -9.471
  363   2HD1  ILE  44          2HD1      ILE  44 -10.099   1.079  -9.146
  364   3HD1  ILE  44          3HD1      ILE  44  -9.884  -0.550  -8.507
  365    HA   PRO  45           HA       PRO  45  -4.345  -1.249  -3.074
  366   1HB   PRO  45          2HB       PRO  45  -5.797  -2.466  -1.119
  367   2HB   PRO  45          1HB       PRO  45  -5.234  -0.796  -1.006
  368   1HG   PRO  45          2HG       PRO  45  -7.933  -1.837  -1.767
  369   2HG   PRO  45          1HG       PRO  45  -7.516  -0.455  -0.737
  370   1HD   PRO  45          2HD       PRO  45  -8.293  -0.181  -3.316
  371   2HD   PRO  45          1HD       PRO  45  -7.150   0.933  -2.536
  372    H    VAL  46           H        VAL  46  -3.557  -3.164  -3.679
  373    HA   VAL  46           HA       VAL  46  -5.366  -5.078  -4.941
  374    HB   VAL  46           HB       VAL  46  -2.337  -5.077  -4.881
  375   1HG1  VAL  46          1HG1      VAL  46  -2.530  -6.681  -6.721
  376   2HG1  VAL  46          2HG1      VAL  46  -4.286  -6.651  -6.563
  377   3HG1  VAL  46          3HG1      VAL  46  -3.294  -7.287  -5.252
  378   1HG2  VAL  46          1HG2      VAL  46  -3.178  -3.110  -6.049
  379   2HG2  VAL  46          2HG2      VAL  46  -4.227  -4.128  -7.038
  380   3HG2  VAL  46          3HG2      VAL  46  -2.474  -4.257  -7.189
  381    H    LEU  47           H        LEU  47  -6.296  -6.326  -3.421
  382    HA   LEU  47           HA       LEU  47  -4.622  -7.378  -1.258
  383   1HB   LEU  47          2HB       LEU  47  -7.621  -7.377  -1.591
  384   2HB   LEU  47          1HB       LEU  47  -6.768  -8.070  -0.225
  385    HG   LEU  47           HG       LEU  47  -6.781  -5.147  -0.992
  386   1HD1  LEU  47          1HD1      LEU  47  -8.920  -5.886  -0.100
  387   2HD1  LEU  47          2HD1      LEU  47  -8.080  -4.862   1.062
  388   3HD1  LEU  47          3HD1      LEU  47  -8.107  -6.612   1.286
  389   1HD2  LEU  47          1HD2      LEU  47  -5.540  -6.558   1.369
  390   2HD2  LEU  47          2HD2      LEU  47  -5.623  -4.811   1.139
  391   3HD2  LEU  47          3HD2      LEU  47  -4.671  -5.801   0.032
  392    H    LEU  48           H        LEU  48  -3.544  -8.792  -2.782
  393    HA   LEU  48           HA       LEU  48  -5.131 -11.218  -3.310
  394   1HB   LEU  48          2HB       LEU  48  -2.724 -10.154  -4.785
  395   2HB   LEU  48          1HB       LEU  48  -3.428 -11.735  -5.061
  396    HG   LEU  48           HG       LEU  48  -4.804  -9.090  -5.533
  397   1HD1  LEU  48          1HD1      LEU  48  -3.753 -11.143  -7.475
  398   2HD1  LEU  48          2HD1      LEU  48  -3.040  -9.562  -7.158
  399   3HD1  LEU  48          3HD1      LEU  48  -4.638  -9.677  -7.893
  400   1HD2  LEU  48          1HD2      LEU  48  -6.578 -10.430  -6.548
  401   2HD2  LEU  48          2HD2      LEU  48  -6.375 -10.830  -4.844
  402   3HD2  LEU  48          3HD2      LEU  48  -5.735 -11.908  -6.081
  403    H    ILE  49           H        ILE  49  -4.579 -12.961  -2.203
  404    HA   ILE  49           HA       ILE  49  -2.483 -12.900  -0.288
  405    HB   ILE  49           HB       ILE  49  -4.031 -15.297  -1.298
  406   1HG1  ILE  49          2HG1      ILE  49  -4.593 -13.478   1.058
  407   2HG1  ILE  49          1HG1      ILE  49  -5.502 -13.502  -0.448
  408   1HG2  ILE  49          1HG2      ILE  49  -2.515 -14.898   1.279
  409   2HG2  ILE  49          2HG2      ILE  49  -2.004 -15.907  -0.072
  410   3HG2  ILE  49          3HG2      ILE  49  -3.454 -16.322   0.840
  411   1HD1  ILE  49          1HD1      ILE  49  -6.241 -15.759   0.006
  412   2HD1  ILE  49          2HD1      ILE  49  -6.643 -14.689   1.353
  413   3HD1  ILE  49          3HD1      ILE  49  -5.276 -15.798   1.481
  414    H    ASP  50           H        ASP  50  -2.816 -14.205  -3.514
  415    HA   ASP  50           HA       ASP  50  -0.347 -15.680  -3.450
  416   1HB   ASP  50          2HB       ASP  50  -2.177 -14.924  -5.734
  417   2HB   ASP  50          1HB       ASP  50  -0.744 -15.928  -5.918
  418    H    GLU  51           H        GLU  51  -0.888 -12.459  -3.464
  419    HA   GLU  51           HA       GLU  51   1.515 -11.932  -5.081
  420   1HB   GLU  51          2HB       GLU  51  -0.630 -10.849  -5.859
  421   2HB   GLU  51          1HB       GLU  51  -0.629  -9.930  -4.360
  422   1HG   GLU  51          2HG       GLU  51   1.534  -8.956  -4.977
  423   2HG   GLU  51          1HG       GLU  51   1.491  -9.853  -6.493
  424    H    ALA  52           H        ALA  52   0.564 -12.385  -2.023
  425    HA   ALA  52           HA       ALA  52   1.685 -10.113  -0.702
  426   1HB   ALA  52          1HB       ALA  52  -0.076 -11.463   0.325
  427   2HB   ALA  52          2HB       ALA  52   1.361 -11.393   1.344
  428   3HB   ALA  52          3HB       ALA  52   1.022 -12.842   0.396
  429    H    THR  53           H        THR  53   3.787  -9.702  -0.866
  430    HA   THR  53           HA       THR  53   5.679 -11.937  -0.743
  431    HB   THR  53           HB       THR  53   7.368 -10.141  -1.408
  432    HG1  THR  53           1HG      THR  53   5.216  -8.657  -2.453
  433   1HG2  THR  53          1HG2      THR  53   6.523 -11.802  -2.989
  434   2HG2  THR  53          2HG2      THR  53   6.750 -10.241  -3.777
  435   3HG2  THR  53          3HG2      THR  53   5.131 -10.776  -3.332
  436    H    GLU  54           H        GLU  54   7.415 -11.898   0.750
  437    HA   GLU  54           HA       GLU  54   6.737 -10.854   3.291
  438   1HB   GLU  54          2HB       GLU  54   9.444 -11.863   2.406
  439   2HB   GLU  54          1HB       GLU  54   8.863 -11.721   4.059
  440   1HG   GLU  54          2HG       GLU  54   8.503 -13.927   3.765
  441   2HG   GLU  54          1HG       GLU  54   6.973 -13.335   3.115
  442    H    TRP  55           H        TRP  55   7.300  -9.053   4.305
  443    HA   TRP  55           HA       TRP  55   9.167  -7.229   2.938
  444   1HB   TRP  55          2HB       TRP  55   6.684  -6.557   3.161
  445   2HB   TRP  55          1HB       TRP  55   7.022  -6.365   4.875
  446    HD1  TRP  55           HD       TRP  55   7.894  -4.047   5.596
  447    HE1  TRP  55           1HE      TRP  55   8.776  -1.965   4.358
  448    HE3  TRP  55           3HE      TRP  55   8.148  -5.951   0.855
  449    HZ2  TRP  55           2HZ      TRP  55   9.495  -1.230   1.735
  450    HZ3  TRP  55           3HZ      TRP  55   8.949  -4.494  -0.958
  451    HH2  TRP  55           HH       TRP  55   9.608  -2.185  -0.526
  452    H    THR  56           H        THR  56  10.992  -6.845   4.006
  453    HA   THR  56           HA       THR  56  11.567  -8.117   6.455
  454    HB   THR  56           HB       THR  56  13.712  -6.825   6.323
  455    HG1  THR  56           1HG      THR  56  13.405  -4.986   5.262
  456   1HG2  THR  56          1HG2      THR  56  14.520  -7.928   4.297
  457   2HG2  THR  56          2HG2      THR  56  12.858  -8.204   3.781
  458   3HG2  THR  56          3HG2      THR  56  13.474  -8.999   5.229
  459    HA   PRO  57           HA       PRO  57  10.662  -5.068   9.580
  460   1HB   PRO  57          2HB       PRO  57  13.475  -5.081  10.491
  461   2HB   PRO  57          1HB       PRO  57  12.003  -5.492  11.377
  462   1HG   PRO  57          2HG       PRO  57  13.726  -7.385  10.594
  463   2HG   PRO  57          1HG       PRO  57  11.975  -7.669  10.578
  464   1HD   PRO  57          2HD       PRO  57  13.811  -7.027   8.302
  465   2HD   PRO  57          1HD       PRO  57  12.456  -8.174   8.369
  466    H    ASN  58           H        ASN  58  10.507  -3.524   7.758
  467    HA   ASN  58           HA       ASN  58  12.751  -1.704   7.435
  468   1HB   ASN  58          2HB       ASN  58  11.363  -2.496   5.489
  469   2HB   ASN  58          1HB       ASN  58  10.021  -1.565   6.141
  470   1HD2  ASN  58          1HD2      ASN  58  10.121   0.697   6.094
  471   2HD2  ASN  58          2HD2      ASN  58  11.232   1.531   5.056
  472    H    ASN  59           H        ASN  59  12.706  -0.960   9.609
  473    HA   ASN  59           HA       ASN  59  11.186   1.437   9.919
  474   1HB   ASN  59          2HB       ASN  59  10.035   0.876  11.991
  475   2HB   ASN  59          1HB       ASN  59   9.526  -0.233  10.726
  476   1HD2  ASN  59          1HD2      ASN  59  10.130  -2.390  10.846
  477   2HD2  ASN  59          2HD2      ASN  59  10.761  -3.093  12.293
  478    H    LEU  60           H        LEU  60  11.673   2.187  12.416
  479    HA   LEU  60           HA       LEU  60  14.589   2.241  12.365
  480   1HB   LEU  60          2HB       LEU  60  12.578   3.908  13.871
  481   2HB   LEU  60          1HB       LEU  60  14.316   4.121  13.980
  482    HG   LEU  60           HG       LEU  60  12.641   4.487  11.494
  483   1HD1  LEU  60          1HD1      LEU  60  13.230   6.839  11.717
  484   2HD1  LEU  60          2HD1      LEU  60  14.099   6.488  13.213
  485   3HD1  LEU  60          3HD1      LEU  60  12.350   6.268  13.135
  486   1HD2  LEU  60          1HD2      LEU  60  14.833   3.615  10.929
  487   2HD2  LEU  60          2HD2      LEU  60  15.604   4.843  11.932
  488   3HD2  LEU  60          3HD2      LEU  60  14.722   5.317  10.480
  489    H    GLU  61           H        GLU  61  13.375  -0.162  13.355
  490    HA   GLU  61           HA       GLU  61  14.989  -0.312  15.743
  491   1HB   GLU  61          2HB       GLU  61  12.747   0.295  16.645
  492   2HB   GLU  61          1HB       GLU  61  12.084  -1.152  15.896
  493   1HG   GLU  61          2HG       GLU  61  13.560  -2.537  17.265
  494   2HG   GLU  61          1HG       GLU  61  14.227  -1.089  18.011
  Start of MODEL   15
    1   1H    MET   1          1HT       MET   1  -5.723  19.488  11.622
    2   2H    MET   1          2HT       MET   1  -6.572  18.104  12.107
    3   3H    MET   1          3HT       MET   1  -7.419  19.495  11.648
    4    HA   MET   1           HA       MET   1  -6.612  19.292   9.393
    5   1HB   MET   1          2HB       MET   1  -4.473  18.212   9.911
    6   2HB   MET   1          1HB       MET   1  -5.314  16.771  10.466
    7   1HG   MET   1          2HG       MET   1  -6.166  16.403   8.200
    8   2HG   MET   1          1HG       MET   1  -5.301  17.840   7.652
    9   1HE   MET   1          1HE       MET   1  -4.240  16.287   5.743
   10   2HE   MET   1          2HE       MET   1  -5.016  14.844   6.385
   11   3HE   MET   1          3HE       MET   1  -3.279  14.848   6.071
   12    H    SER   2           H        SER   2  -8.114  18.472   8.021
   13    HA   SER   2           HA       SER   2 -10.350  17.115   9.082
   14   1HB   SER   2          2HB       SER   2 -10.980  16.956   6.592
   15   2HB   SER   2          1HB       SER   2 -10.778  18.570   7.274
   16    HG   SER   2           HG       SER   2  -9.220  17.207   5.412
   17    H    LEU   3           H        LEU   3 -10.896  15.011   9.127
   18    HA   LEU   3           HA       LEU   3  -8.897  13.105   8.110
   19   1HB   LEU   3          2HB       LEU   3  -9.370  13.020  10.527
   20   2HB   LEU   3          1HB       LEU   3 -11.061  12.712  10.186
   21    HG   LEU   3           HG       LEU   3 -10.432  10.573   9.109
   22   1HD1  LEU   3          1HD1      LEU   3  -8.166  11.184   8.425
   23   2HD1  LEU   3          2HD1      LEU   3  -8.172   9.705   9.386
   24   3HD1  LEU   3          3HD1      LEU   3  -7.667  11.229  10.115
   25   1HD2  LEU   3          1HD2      LEU   3  -9.429  10.937  11.928
   26   2HD2  LEU   3          2HD2      LEU   3  -9.856   9.399  11.180
   27   3HD2  LEU   3          3HD2      LEU   3 -11.096  10.625  11.450
   28    H    ASP   4           H        ASP   4  -9.427  11.581   6.647
   29    HA   ASP   4           HA       ASP   4 -12.225  11.478   5.750
   30   1HB   ASP   4          2HB       ASP   4 -10.751  12.796   4.189
   31   2HB   ASP   4          1HB       ASP   4  -9.841  11.315   3.896
   32    HA   PRO   5           HA       PRO   5 -10.975   7.168   6.712
   33   1HB   PRO   5          2HB       PRO   5 -13.812   6.846   7.328
   34   2HB   PRO   5          1HB       PRO   5 -12.412   6.606   8.375
   35   1HG   PRO   5          2HG       PRO   5 -14.150   8.651   8.710
   36   2HG   PRO   5          1HG       PRO   5 -12.426   8.785   9.111
   37   1HD   PRO   5          2HD       PRO   5 -13.892   9.764   6.687
   38   2HD   PRO   5          1HD       PRO   5 -12.628  10.570   7.639
   39    H    GLN   6           H        GLN   6 -12.850   8.668   4.389
   40    HA   GLN   6           HA       GLN   6 -14.056   6.287   3.267
   41   1HB   GLN   6          2HB       GLN   6 -13.956   9.145   2.290
   42   2HB   GLN   6          1HB       GLN   6 -14.822   7.848   1.475
   43   1HG   GLN   6          2HG       GLN   6 -16.247   7.542   3.409
   44   2HG   GLN   6          1HG       GLN   6 -15.354   8.790   4.282
   45   1HE2  GLN   6          1HE2      GLN   6 -17.593   8.126   1.717
   46   2HE2  GLN   6          2HE2      GLN   6 -18.175   9.749   1.534
   47    H    LEU   7           H        LEU   7 -11.303   8.395   2.646
   48    HA   LEU   7           HA       LEU   7 -10.442   7.115   0.263
   49   1HB   LEU   7          2HB       LEU   7  -8.878   8.570   2.399
   50   2HB   LEU   7          1HB       LEU   7  -8.200   8.046   0.871
   51    HG   LEU   7           HG       LEU   7 -10.430  10.058   1.187
   52   1HD1  LEU   7          1HD1      LEU   7  -8.299  10.925   1.984
   53   2HD1  LEU   7          2HD1      LEU   7  -8.752  11.689   0.457
   54   3HD1  LEU   7          3HD1      LEU   7  -7.521  10.425   0.482
   55   1HD2  LEU   7          1HD2      LEU   7 -10.081  10.459  -1.203
   56   2HD2  LEU   7          2HD2      LEU   7 -10.596   8.801  -0.892
   57   3HD2  LEU   7          3HD2      LEU   7  -8.904   9.146  -1.247
   58    H    LEU   8           H        LEU   8 -10.296   6.305   3.601
   59    HA   LEU   8           HA       LEU   8  -8.214   4.318   3.292
   60   1HB   LEU   8          2HB       LEU   8 -10.008   4.932   5.645
   61   2HB   LEU   8          1HB       LEU   8  -8.625   3.855   5.671
   62    HG   LEU   8           HG       LEU   8  -8.495   6.824   5.141
   63   1HD1  LEU   8          1HD1      LEU   8  -9.140   6.357   7.438
   64   2HD1  LEU   8          2HD1      LEU   8  -7.482   6.961   7.367
   65   3HD1  LEU   8          3HD1      LEU   8  -7.785   5.239   7.604
   66   1HD2  LEU   8          1HD2      LEU   8  -6.081   6.533   5.391
   67   2HD2  LEU   8          2HD2      LEU   8  -6.704   5.587   4.038
   68   3HD2  LEU   8          3HD2      LEU   8  -6.305   4.791   5.560
   69    H    GLU   9           H        GLU   9 -11.670   4.337   4.100
   70    HA   GLU   9           HA       GLU   9 -13.299   2.779   3.995
   71   1HB   GLU   9          2HB       GLU   9 -11.451   1.458   1.999
   72   2HB   GLU   9          1HB       GLU   9 -13.092   0.926   2.328
   73   1HG   GLU   9          2HG       GLU   9 -13.837   3.248   1.665
   74   2HG   GLU   9          1HG       GLU   9 -12.195   3.499   1.075
   75    H    VAL  10           H        VAL  10 -13.215  -0.006   3.800
   76    HA   VAL  10           HA       VAL  10 -12.365  -0.660   6.457
   77    HB   VAL  10           HB       VAL  10 -13.416  -2.524   4.322
   78   1HG1  VAL  10          1HG1      VAL  10 -13.244  -2.799   7.319
   79   2HG1  VAL  10          2HG1      VAL  10 -12.326  -3.713   6.120
   80   3HG1  VAL  10          3HG1      VAL  10 -14.074  -3.925   6.247
   81   1HG2  VAL  10          1HG2      VAL  10 -15.010  -0.738   4.699
   82   2HG2  VAL  10          2HG2      VAL  10 -14.914  -0.990   6.441
   83   3HG2  VAL  10          3HG2      VAL  10 -15.607  -2.240   5.410
   84    H    LEU  11           H        LEU  11 -10.276  -0.975   6.871
   85    HA   LEU  11           HA       LEU  11  -8.668  -2.383   4.841
   86   1HB   LEU  11          2HB       LEU  11  -7.832  -0.317   6.872
   87   2HB   LEU  11          1HB       LEU  11  -6.704  -1.238   5.896
   88    HG   LEU  11           HG       LEU  11  -8.784   0.677   4.841
   89   1HD1  LEU  11          1HD1      LEU  11  -5.785   0.918   5.025
   90   2HD1  LEU  11          2HD1      LEU  11  -6.966   1.821   5.975
   91   3HD1  LEU  11          3HD1      LEU  11  -6.863   2.065   4.231
   92   1HD2  LEU  11          1HD2      LEU  11  -8.355  -1.179   3.306
   93   2HD2  LEU  11          2HD2      LEU  11  -6.623  -0.849   3.388
   94   3HD2  LEU  11          3HD2      LEU  11  -7.718   0.341   2.677
   95    H    ALA  12           H        ALA  12  -8.366  -4.411   5.388
   96    HA   ALA  12           HA       ALA  12  -7.152  -5.049   7.929
   97   1HB   ALA  12          1HB       ALA  12  -9.538  -5.228   8.458
   98   2HB   ALA  12          2HB       ALA  12  -8.757  -6.811   8.495
   99   3HB   ALA  12          3HB       ALA  12  -9.757  -6.349   7.114
  100    H    CYS  13           H        CYS  13  -5.973  -6.980   7.842
  101    HA   CYS  13           HA       CYS  13  -5.162  -7.849   5.261
  102   1HB   CYS  13          2HB       CYS  13  -3.619  -7.913   7.136
  103   2HB   CYS  13          1HB       CYS  13  -4.666  -9.035   8.000
  104    HG   CYS  13           HG       CYS  13  -3.080  -9.783   5.048
  105    HA   PRO  14           HA       PRO  14  -8.525 -10.628   4.397
  106   1HB   PRO  14          2HB       PRO  14  -6.515 -11.895   2.612
  107   2HB   PRO  14          1HB       PRO  14  -8.136 -11.298   2.244
  108   1HG   PRO  14          2HG       PRO  14  -5.976  -9.935   1.481
  109   2HG   PRO  14          1HG       PRO  14  -7.427  -9.093   2.059
  110   1HD   PRO  14          2HD       PRO  14  -4.842  -9.607   3.470
  111   2HD   PRO  14          1HD       PRO  14  -5.893  -8.177   3.525
  112    H    LYS  15           H        LYS  15  -5.254 -11.892   4.962
  113    HA   LYS  15           HA       LYS  15  -6.335 -14.509   5.629
  114   1HB   LYS  15          2HB       LYS  15  -4.235 -14.315   4.303
  115   2HB   LYS  15          1HB       LYS  15  -3.458 -13.582   5.702
  116   1HG   LYS  15          2HG       LYS  15  -3.803 -15.611   6.988
  117   2HG   LYS  15          1HG       LYS  15  -4.647 -16.348   5.627
  118   1HD   LYS  15          2HD       LYS  15  -2.433 -17.210   5.632
  119   2HD   LYS  15          1HD       LYS  15  -2.545 -16.071   4.292
  120   1HE   LYS  15          2HE       LYS  15  -1.374 -14.396   5.529
  121   2HE   LYS  15          1HE       LYS  15  -1.442 -15.358   7.004
  122   1HZ   LYS  15          1HZ       LYS  15  -0.027 -17.011   5.949
  123   2HZ   LYS  15          2HZ       LYS  15   0.736 -15.498   5.966
  124   3HZ   LYS  15          3HZ       LYS  15   0.044 -16.084   4.530
  125    H    ASP  16           H        ASP  16  -4.376 -12.016   7.232
  126    HA   ASP  16           HA       ASP  16  -4.418 -13.456   9.729
  127   1HB   ASP  16          2HB       ASP  16  -2.395 -12.344   9.149
  128   2HB   ASP  16          1HB       ASP  16  -3.230 -10.826   8.862
  129    H    LYS  17           H        LYS  17  -6.252 -10.929   8.276
  130    HA   LYS  17           HA       LYS  17  -7.961  -9.621   8.961
  131   1HB   LYS  17          2HB       LYS  17  -8.155 -11.754  11.081
  132   2HB   LYS  17          1HB       LYS  17  -9.326 -10.450  10.912
  133   1HG   LYS  17          2HG       LYS  17  -9.742 -11.196   8.584
  134   2HG   LYS  17          1HG       LYS  17  -8.672 -12.566   8.874
  135   1HD   LYS  17          2HD       LYS  17 -11.020 -13.180   9.138
  136   2HD   LYS  17          1HD       LYS  17 -10.132 -13.352  10.653
  137   1HE   LYS  17          2HE       LYS  17 -11.048 -11.288  11.483
  138   2HE   LYS  17          1HE       LYS  17 -11.811 -10.952   9.930
  139   1HZ   LYS  17          1HZ       LYS  17 -13.325 -12.716  10.234
  140   2HZ   LYS  17          2HZ       LYS  17 -13.308 -11.868  11.701
  141   3HZ   LYS  17          3HZ       LYS  17 -12.473 -13.340  11.561
  142    H    GLY  18           H        GLY  18  -5.256  -9.092   9.872
  143   1HA   GLY  18          2HA       GLY  18  -5.827  -7.579  12.334
  144   2HA   GLY  18          1HA       GLY  18  -4.220  -8.036  11.782
  145    HA   PRO  19           HA       PRO  19  -5.306  -3.674  10.411
  146   1HB   PRO  19          2HB       PRO  19  -3.393  -2.341  11.765
  147   2HB   PRO  19          1HB       PRO  19  -4.952  -2.751  12.489
  148   1HG   PRO  19          2HG       PRO  19  -2.305  -4.113  12.794
  149   2HG   PRO  19          1HG       PRO  19  -3.526  -3.745  14.026
  150   1HD   PRO  19          2HD       PRO  19  -3.248  -6.208  12.881
  151   2HD   PRO  19          1HD       PRO  19  -4.789  -5.590  13.507
  152    H    LEU  20           H        LEU  20  -4.087  -2.287   9.033
  153    HA   LEU  20           HA       LEU  20  -1.650  -3.543   7.954
  154   1HB   LEU  20          2HB       LEU  20  -3.744  -1.922   6.496
  155   2HB   LEU  20          1HB       LEU  20  -2.276  -2.558   5.779
  156    HG   LEU  20           HG       LEU  20  -4.487  -4.258   6.940
  157   1HD1  LEU  20          1HD1      LEU  20  -3.814  -3.639   4.066
  158   2HD1  LEU  20          2HD1      LEU  20  -5.243  -3.088   4.939
  159   3HD1  LEU  20          3HD1      LEU  20  -5.015  -4.807   4.613
  160   1HD2  LEU  20          1HD2      LEU  20  -3.313  -6.091   5.798
  161   2HD2  LEU  20          2HD2      LEU  20  -2.315  -5.344   7.044
  162   3HD2  LEU  20          3HD2      LEU  20  -2.029  -4.973   5.344
  163    H    ARG  21           H        ARG  21   0.129  -2.289   7.708
  164    HA   ARG  21           HA       ARG  21   0.039   0.398   8.808
  165   1HB   ARG  21          2HB       ARG  21   1.844  -1.245   9.409
  166   2HB   ARG  21          1HB       ARG  21   2.421  -1.140   7.752
  167   1HG   ARG  21          2HG       ARG  21   2.938   1.196   8.036
  168   2HG   ARG  21          1HG       ARG  21   2.250   1.180   9.661
  169   1HD   ARG  21          2HD       ARG  21   3.955  -0.518  10.302
  170   2HD   ARG  21          1HD       ARG  21   4.687  -0.322   8.708
  171    HE   ARG  21           HE       ARG  21   4.626   2.213   9.655
  172   1HH1  ARG  21          1HH1      ARG  21   5.846  -0.801  10.980
  173   2HH1  ARG  21          2HH1      ARG  21   7.068  -0.038  11.942
  174   1HH2  ARG  21          1HH2      ARG  21   6.233   3.220  10.918
  175   2HH2  ARG  21          2HH2      ARG  21   7.293   2.268  11.907
  176    H    TYR  22           H        TYR  22  -0.123   2.157   7.605
  177    HA   TYR  22           HA       TYR  22  -0.142   1.858   4.716
  178   1HB   TYR  22          2HB       TYR  22  -2.073   2.927   5.625
  179   2HB   TYR  22          1HB       TYR  22  -1.095   4.036   6.575
  180    HD1  TYR  22           1HD      TYR  22  -0.462   6.116   5.713
  181    HD2  TYR  22           2HD      TYR  22  -2.043   3.171   3.082
  182    HE1  TYR  22           1HE      TYR  22  -0.595   7.794   3.925
  183    HE2  TYR  22           2HE      TYR  22  -2.185   4.846   1.285
  184    HH   TYR  22           HH       TYR  22  -2.329   7.298   1.048
  185    H    LEU  23           H        LEU  23   1.653   2.201   3.639
  186    HA   LEU  23           HA       LEU  23   3.664   4.065   4.574
  187   1HB   LEU  23          2HB       LEU  23   3.443   2.344   2.117
  188   2HB   LEU  23          1HB       LEU  23   4.719   3.528   2.304
  189    HG   LEU  23           HG       LEU  23   5.614   1.409   2.909
  190   1HD1  LEU  23          1HD1      LEU  23   6.235   1.747   5.257
  191   2HD1  LEU  23          2HD1      LEU  23   4.980   2.978   5.400
  192   3HD1  LEU  23          3HD1      LEU  23   6.345   3.234   4.314
  193   1HD2  LEU  23          1HD2      LEU  23   3.528   0.214   3.315
  194   2HD2  LEU  23          2HD2      LEU  23   3.301   1.107   4.819
  195   3HD2  LEU  23          3HD2      LEU  23   4.658  -0.008   4.649
  196    H    GLU  24           H        GLU  24   4.082   6.092   3.735
  197    HA   GLU  24           HA       GLU  24   1.750   7.260   2.413
  198   1HB   GLU  24          2HB       GLU  24   4.048   8.613   3.838
  199   2HB   GLU  24          1HB       GLU  24   2.578   9.392   3.264
  200   1HG   GLU  24          2HG       GLU  24   1.242   8.171   4.828
  201   2HG   GLU  24          1HG       GLU  24   2.625   7.197   5.320
  202    H    SER  25           H        SER  25   5.193   6.828   1.890
  203    HA   SER  25           HA       SER  25   5.136   8.576  -0.443
  204   1HB   SER  25          2HB       SER  25   7.105   8.651   1.039
  205   2HB   SER  25          1HB       SER  25   7.393   6.937   0.750
  206    HG   SER  25           HG       SER  25   7.705   9.117  -1.012
  207    H    GLU  26           H        GLU  26   5.771   5.210   0.383
  208    HA   GLU  26           HA       GLU  26   5.838   4.317  -2.341
  209   1HB   GLU  26          2HB       GLU  26   5.421   2.563   0.078
  210   2HB   GLU  26          1HB       GLU  26   6.208   2.157  -1.440
  211   1HG   GLU  26          2HG       GLU  26   8.045   2.399  -0.145
  212   2HG   GLU  26          1HG       GLU  26   7.866   4.068  -0.676
  213    H    GLN  27           H        GLN  27   3.489   4.710   0.148
  214    HA   GLN  27           HA       GLN  27   1.318   4.197   0.410
  215   1HB   GLN  27          2HB       GLN  27   1.259   4.658  -2.572
  216   2HB   GLN  27          1HB       GLN  27  -0.136   4.693  -1.497
  217   1HG   GLN  27          2HG       GLN  27   1.237   6.479  -0.206
  218   2HG   GLN  27          1HG       GLN  27   2.127   6.623  -1.718
  219   1HE2  GLN  27          1HE2      GLN  27   0.451   8.543  -0.337
  220   2HE2  GLN  27          2HE2      GLN  27  -0.795   8.999  -1.448
  221    H    LEU  28           H        LEU  28   2.130   2.074   0.937
  222    HA   LEU  28           HA       LEU  28   0.761   0.035  -0.660
  223   1HB   LEU  28          2HB       LEU  28   3.438  -0.312   0.717
  224   2HB   LEU  28          1HB       LEU  28   2.550  -1.562  -0.133
  225    HG   LEU  28           HG       LEU  28   3.710   0.908  -1.430
  226   1HD1  LEU  28          1HD1      LEU  28   4.686  -1.945  -1.429
  227   2HD1  LEU  28          2HD1      LEU  28   5.463  -0.579  -0.626
  228   3HD1  LEU  28          3HD1      LEU  28   5.359  -0.626  -2.387
  229   1HD2  LEU  28          1HD2      LEU  28   3.209  -0.247  -3.525
  230   2HD2  LEU  28          2HD2      LEU  28   1.741   0.046  -2.591
  231   3HD2  LEU  28          3HD2      LEU  28   2.460  -1.563  -2.626
  232    H    LEU  29           H        LEU  29   0.179  -1.868   0.723
  233    HA   LEU  29           HA       LEU  29  -0.240  -0.983   3.505
  234   1HB   LEU  29          2HB       LEU  29  -1.881  -2.893   1.828
  235   2HB   LEU  29          1HB       LEU  29  -2.175  -2.544   3.521
  236    HG   LEU  29           HG       LEU  29  -2.344  -0.532   1.276
  237   1HD1  LEU  29          1HD1      LEU  29  -4.505  -1.915   2.856
  238   2HD1  LEU  29          2HD1      LEU  29  -4.142  -2.145   1.146
  239   3HD1  LEU  29          3HD1      LEU  29  -4.756  -0.593   1.716
  240   1HD2  LEU  29          1HD2      LEU  29  -1.669   0.506   3.354
  241   2HD2  LEU  29          2HD2      LEU  29  -2.980  -0.299   4.214
  242   3HD2  LEU  29          3HD2      LEU  29  -3.345   0.922   2.994
  243    H    VAL  30           H        VAL  30   1.156  -1.946   4.818
  244    HA   VAL  30           HA       VAL  30   1.960  -4.719   4.210
  245    HB   VAL  30           HB       VAL  30   3.577  -2.664   5.730
  246   1HG1  VAL  30          1HG1      VAL  30   4.088  -4.962   6.344
  247   2HG1  VAL  30          2HG1      VAL  30   5.421  -4.245   5.437
  248   3HG1  VAL  30          3HG1      VAL  30   4.325  -5.376   4.644
  249   1HG2  VAL  30          1HG2      VAL  30   3.838  -3.549   2.861
  250   2HG2  VAL  30          2HG2      VAL  30   5.004  -2.551   3.730
  251   3HG2  VAL  30          3HG2      VAL  30   3.374  -1.944   3.432
  252    H    ASN  31           H        ASN  31   1.471  -6.219   5.701
  253    HA   ASN  31           HA       ASN  31   0.695  -5.286   8.376
  254   1HB   ASN  31          2HB       ASN  31  -0.941  -6.737   7.246
  255   2HB   ASN  31          1HB       ASN  31   0.281  -7.992   7.074
  256   1HD2  ASN  31          1HD2      ASN  31  -1.223  -9.351   8.205
  257   2HD2  ASN  31          2HD2      ASN  31  -1.341  -9.286   9.932
  258    H    GLU  32           H        GLU  32   2.171  -5.353   9.887
  259    HA   GLU  32           HA       GLU  32   4.732  -6.549   9.335
  260   1HB   GLU  32          2HB       GLU  32   4.333  -4.283  10.405
  261   2HB   GLU  32          1HB       GLU  32   3.846  -5.142  11.857
  262   1HG   GLU  32          2HG       GLU  32   6.050  -6.117  12.056
  263   2HG   GLU  32          1HG       GLU  32   6.548  -5.347  10.549
  264    H    ARG  33           H        ARG  33   1.900  -7.636  10.699
  265    HA   ARG  33           HA       ARG  33   3.025  -9.403  12.664
  266   1HB   ARG  33          2HB       ARG  33   0.300  -9.159  11.404
  267   2HB   ARG  33          1HB       ARG  33   0.688 -10.416  12.570
  268   1HG   ARG  33          2HG       ARG  33   1.038  -8.854  14.296
  269   2HG   ARG  33          1HG       ARG  33   1.089  -7.502  13.167
  270   1HD   ARG  33          2HD       ARG  33  -1.040  -7.798  14.538
  271   2HD   ARG  33          1HD       ARG  33  -1.224  -7.575  12.799
  272    HE   ARG  33           HE       ARG  33  -1.889  -9.804  12.581
  273   1HH1  ARG  33          1HH1      ARG  33  -1.106  -9.017  15.919
  274   2HH1  ARG  33          2HH1      ARG  33  -1.897 -10.429  16.555
  275   1HH2  ARG  33          1HH2      ARG  33  -2.903 -11.636  13.405
  276   2HH2  ARG  33          2HH2      ARG  33  -2.915 -11.934  15.124
  277    H    LEU  34           H        LEU  34   2.210  -9.556   9.277
  278    HA   LEU  34           HA       LEU  34   2.918 -12.406   9.207
  279   1HB   LEU  34          2HB       LEU  34   1.633 -10.679   7.094
  280   2HB   LEU  34          1HB       LEU  34   1.973 -12.390   6.934
  281    HG   LEU  34           HG       LEU  34   0.002 -11.138   8.849
  282   1HD1  LEU  34          1HD1      LEU  34  -0.746 -11.115   6.533
  283   2HD1  LEU  34          2HD1      LEU  34  -1.658 -12.301   7.467
  284   3HD1  LEU  34          3HD1      LEU  34  -0.373 -12.831   6.383
  285   1HD2  LEU  34          1HD2      LEU  34   1.038 -13.110   9.839
  286   2HD2  LEU  34          2HD2      LEU  34   0.698 -14.036   8.376
  287   3HD2  LEU  34          3HD2      LEU  34  -0.630 -13.450   9.378
  288    H    ASN  35           H        ASN  35   4.142  -9.326   8.558
  289    HA   ASN  35           HA       ASN  35   5.978  -8.504   7.507
  290   1HB   ASN  35          2HB       ASN  35   7.094 -10.460   8.647
  291   2HB   ASN  35          1HB       ASN  35   6.845 -11.391   7.177
  292   1HD2  ASN  35          1HD2      ASN  35   8.444  -8.564   8.518
  293   2HD2  ASN  35          2HD2      ASN  35   9.707  -8.496   7.331
  294    H    LEU  36           H        LEU  36   3.534  -9.207   6.135
  295    HA   LEU  36           HA       LEU  36   4.550  -9.648   3.406
  296   1HB   LEU  36          2HB       LEU  36   1.850 -10.369   4.554
  297   2HB   LEU  36          1HB       LEU  36   2.284 -10.517   2.863
  298    HG   LEU  36           HG       LEU  36   3.558 -12.043   5.136
  299   1HD1  LEU  36          1HD1      LEU  36   2.424 -13.979   4.145
  300   2HD1  LEU  36          2HD1      LEU  36   1.625 -12.911   2.990
  301   3HD1  LEU  36          3HD1      LEU  36   1.277 -12.765   4.713
  302   1HD2  LEU  36          1HD2      LEU  36   4.672 -13.317   3.382
  303   2HD2  LEU  36          2HD2      LEU  36   5.115 -11.612   3.294
  304   3HD2  LEU  36          3HD2      LEU  36   3.946 -12.279   2.153
  305    H    ALA  37           H        ALA  37   3.772  -8.330   1.787
  306    HA   ALA  37           HA       ALA  37   2.287  -5.953   2.693
  307   1HB   ALA  37          1HB       ALA  37   4.661  -5.473   2.330
  308   2HB   ALA  37          2HB       ALA  37   3.637  -4.614   1.180
  309   3HB   ALA  37          3HB       ALA  37   4.519  -6.054   0.669
  310    H    TYR  38           H        TYR  38   0.692  -5.189   1.436
  311    HA   TYR  38           HA       TYR  38   0.088  -6.661  -1.041
  312   1HB   TYR  38          2HB       TYR  38  -1.760  -4.983   0.680
  313   2HB   TYR  38          1HB       TYR  38  -2.228  -5.908  -0.741
  314    HD1  TYR  38           1HD      TYR  38  -1.424  -6.043   2.805
  315    HD2  TYR  38           2HD      TYR  38  -2.325  -8.358  -0.647
  316    HE1  TYR  38           1HE      TYR  38  -1.884  -7.987   4.237
  317    HE2  TYR  38           2HE      TYR  38  -2.781 -10.313   0.774
  318    HH   TYR  38           HH       TYR  38  -2.191 -11.139   3.007
  319    H    ARG  39           H        ARG  39   0.315  -5.581  -2.904
  320    HA   ARG  39           HA       ARG  39   1.228  -2.859  -2.800
  321   1HB   ARG  39          2HB       ARG  39   1.520  -3.083  -5.233
  322   2HB   ARG  39          1HB       ARG  39   2.284  -4.394  -4.347
  323   1HG   ARG  39          2HG       ARG  39   0.460  -5.878  -4.901
  324   2HG   ARG  39          1HG       ARG  39  -0.391  -4.563  -5.714
  325   1HD   ARG  39          2HD       ARG  39   2.282  -5.710  -6.506
  326   2HD   ARG  39          1HD       ARG  39   0.747  -6.005  -7.320
  327    HE   ARG  39           HE       ARG  39   2.334  -3.555  -7.396
  328   1HH1  ARG  39          1HH1      ARG  39  -0.547  -5.291  -8.334
  329   2HH1  ARG  39          2HH1      ARG  39  -1.013  -4.153  -9.558
  330   1HH2  ARG  39          1HH2      ARG  39   1.739  -2.016  -8.977
  331   2HH2  ARG  39          2HH2      ARG  39   0.272  -2.244  -9.898
  332    H    ILE  40           H        ILE  40   0.215  -1.044  -3.429
  333    HA   ILE  40           HA       ILE  40  -2.617  -1.258  -4.151
  334    HB   ILE  40           HB       ILE  40  -1.054   1.190  -3.295
  335   1HG1  ILE  40          2HG1      ILE  40  -3.029  -0.497  -1.739
  336   2HG1  ILE  40          1HG1      ILE  40  -1.288  -0.455  -1.479
  337   1HG2  ILE  40          1HG2      ILE  40  -4.015   0.794  -3.703
  338   2HG2  ILE  40          2HG2      ILE  40  -2.933   1.740  -4.726
  339   3HG2  ILE  40          3HG2      ILE  40  -3.246   2.248  -3.067
  340   1HD1  ILE  40          1HD1      ILE  40  -3.190   1.847  -1.097
  341   2HD1  ILE  40          2HD1      ILE  40  -1.444   1.897  -0.838
  342   3HD1  ILE  40          3HD1      ILE  40  -2.460   0.872   0.177
  343    H    ASP  41           H        ASP  41  -3.112  -1.103  -6.235
  344    HA   ASP  41           HA       ASP  41  -1.092  -0.048  -8.070
  345   1HB   ASP  41          2HB       ASP  41  -2.080  -2.327  -8.446
  346   2HB   ASP  41          1HB       ASP  41  -3.637  -1.555  -8.712
  347    H    ASP  42           H        ASP  42  -1.326   2.113  -7.890
  348    HA   ASP  42           HA       ASP  42  -2.198   4.196  -8.017
  349   1HB   ASP  42          2HB       ASP  42  -2.050   3.490 -10.417
  350   2HB   ASP  42          1HB       ASP  42  -3.760   3.077 -10.344
  351    H    GLY  43           H        GLY  43  -3.317   3.735  -5.968
  352   1HA   GLY  43          2HA       GLY  43  -5.121   4.490  -4.731
  353   2HA   GLY  43          1HA       GLY  43  -6.003   4.749  -6.228
  354    H    ILE  44           H        ILE  44  -5.085   1.680  -6.615
  355    HA   ILE  44           HA       ILE  44  -7.455   0.667  -5.181
  356    HB   ILE  44           HB       ILE  44  -6.349  -0.309  -7.825
  357   1HG1  ILE  44          2HG1      ILE  44  -8.899   1.185  -7.152
  358   2HG1  ILE  44          1HG1      ILE  44  -7.511   1.852  -8.002
  359   1HG2  ILE  44          1HG2      ILE  44  -8.335  -1.757  -7.880
  360   2HG2  ILE  44          2HG2      ILE  44  -8.770  -1.210  -6.260
  361   3HG2  ILE  44          3HG2      ILE  44  -7.289  -2.135  -6.510
  362   1HD1  ILE  44          1HD1      ILE  44  -7.896   0.304  -9.845
  363   2HD1  ILE  44          2HD1      ILE  44  -9.314   1.305  -9.530
  364   3HD1  ILE  44          3HD1      ILE  44  -9.280  -0.371  -8.986
  365    HA   PRO  45           HA       PRO  45  -4.163  -1.686  -3.190
  366   1HB   PRO  45          2HB       PRO  45  -5.711  -2.549  -1.124
  367   2HB   PRO  45          1HB       PRO  45  -4.962  -0.951  -1.170
  368   1HG   PRO  45          2HG       PRO  45  -7.771  -1.748  -1.800
  369   2HG   PRO  45          1HG       PRO  45  -7.181  -0.330  -0.912
  370   1HD   PRO  45          2HD       PRO  45  -7.972  -0.219  -3.510
  371   2HD   PRO  45          1HD       PRO  45  -6.716   0.838  -2.838
  372    H    VAL  46           H        VAL  46  -3.619  -3.626  -3.940
  373    HA   VAL  46           HA       VAL  46  -5.662  -5.505  -4.785
  374    HB   VAL  46           HB       VAL  46  -2.651  -5.812  -4.851
  375   1HG1  VAL  46          1HG1      VAL  46  -4.837  -7.322  -6.282
  376   2HG1  VAL  46          2HG1      VAL  46  -3.828  -7.934  -4.971
  377   3HG1  VAL  46          3HG1      VAL  46  -3.103  -7.542  -6.531
  378   1HG2  VAL  46          1HG2      VAL  46  -4.522  -4.911  -7.040
  379   2HG2  VAL  46          2HG2      VAL  46  -2.785  -5.168  -7.194
  380   3HG2  VAL  46          3HG2      VAL  46  -3.398  -3.878  -6.161
  381    H    LEU  47           H        LEU  47  -6.610  -6.133  -2.852
  382    HA   LEU  47           HA       LEU  47  -4.965  -7.145  -0.703
  383   1HB   LEU  47          2HB       LEU  47  -7.964  -6.985  -1.010
  384   2HB   LEU  47          1HB       LEU  47  -7.144  -7.537   0.437
  385    HG   LEU  47           HG       LEU  47  -6.961  -4.761  -0.738
  386   1HD1  LEU  47          1HD1      LEU  47  -9.143  -5.219   0.245
  387   2HD1  LEU  47          2HD1      LEU  47  -8.226  -4.097   1.253
  388   3HD1  LEU  47          3HD1      LEU  47  -8.370  -5.792   1.723
  389   1HD2  LEU  47          1HD2      LEU  47  -5.811  -5.907   1.803
  390   2HD2  LEU  47          2HD2      LEU  47  -5.771  -4.208   1.328
  391   3HD2  LEU  47          3HD2      LEU  47  -4.897  -5.411   0.379
  392    H    LEU  48           H        LEU  48  -4.094  -8.785  -2.277
  393    HA   LEU  48           HA       LEU  48  -5.770 -11.204  -2.152
  394   1HB   LEU  48          2HB       LEU  48  -3.741 -10.425  -4.250
  395   2HB   LEU  48          1HB       LEU  48  -4.485 -12.010  -4.137
  396    HG   LEU  48           HG       LEU  48  -5.950  -9.419  -4.652
  397   1HD1  LEU  48          1HD1      LEU  48  -4.611 -10.102  -6.556
  398   2HD1  LEU  48          2HD1      LEU  48  -6.325 -10.362  -6.882
  399   3HD1  LEU  48          3HD1      LEU  48  -5.291 -11.728  -6.470
  400   1HD2  LEU  48          1HD2      LEU  48  -7.891 -10.836  -5.056
  401   2HD2  LEU  48          2HD2      LEU  48  -7.305 -11.023  -3.399
  402   3HD2  LEU  48          3HD2      LEU  48  -6.955 -12.262  -4.608
  403    H    ILE  49           H        ILE  49  -5.027 -12.695  -0.861
  404    HA   ILE  49           HA       ILE  49  -2.722 -12.416   0.692
  405    HB   ILE  49           HB       ILE  49  -4.138 -15.022   0.110
  406   1HG1  ILE  49          2HG1      ILE  49  -4.776 -13.003   2.272
  407   2HG1  ILE  49          1HG1      ILE  49  -5.696 -13.179   0.780
  408   1HG2  ILE  49          1HG2      ILE  49  -2.035 -15.277   1.296
  409   2HG2  ILE  49          2HG2      ILE  49  -3.391 -15.627   2.368
  410   3HG2  ILE  49          3HG2      ILE  49  -2.547 -14.083   2.489
  411   1HD1  ILE  49          1HD1      ILE  49  -5.347 -15.292   2.895
  412   2HD1  ILE  49          2HD1      ILE  49  -6.277 -15.463   1.407
  413   3HD1  ILE  49          3HD1      ILE  49  -6.786 -14.305   2.636
  414    H    ASP  50           H        ASP  50  -3.295 -14.266  -2.244
  415    HA   ASP  50           HA       ASP  50  -0.827 -15.685  -2.199
  416   1HB   ASP  50          2HB       ASP  50  -2.898 -16.408  -3.412
  417   2HB   ASP  50          1HB       ASP  50  -2.613 -15.113  -4.569
  418    H    GLU  51           H        GLU  51  -1.548 -12.467  -2.905
  419    HA   GLU  51           HA       GLU  51   0.770 -12.174  -4.685
  420   1HB   GLU  51          2HB       GLU  51  -1.794 -11.020  -4.711
  421   2HB   GLU  51          1HB       GLU  51  -0.705  -9.730  -4.220
  422   1HG   GLU  51          2HG       GLU  51  -0.398 -11.425  -6.685
  423   2HG   GLU  51          1HG       GLU  51  -1.053  -9.790  -6.640
  424    H    ALA  52           H        ALA  52   0.045 -12.062  -1.474
  425    HA   ALA  52           HA       ALA  52   1.320  -9.654  -0.663
  426   1HB   ALA  52          1HB       ALA  52  -0.306 -10.819   0.750
  427   2HB   ALA  52          2HB       ALA  52   1.232 -10.585   1.582
  428   3HB   ALA  52          3HB       ALA  52   0.819 -12.168   0.921
  429    H    THR  53           H        THR  53   3.388  -9.268  -1.029
  430    HA   THR  53           HA       THR  53   5.302 -11.477  -1.028
  431    HB   THR  53           HB       THR  53   5.391  -9.950  -2.936
  432    HG1  THR  53           1HG      THR  53   7.736  -9.171  -2.343
  433   1HG2  THR  53          1HG2      THR  53   6.116  -7.824  -0.923
  434   2HG2  THR  53          2HG2      THR  53   4.613  -7.904  -1.842
  435   3HG2  THR  53          3HG2      THR  53   6.144  -7.637  -2.676
  436    H    GLU  54           H        GLU  54   7.399 -11.109   0.022
  437    HA   GLU  54           HA       GLU  54   6.975 -10.258   2.750
  438   1HB   GLU  54          2HB       GLU  54   9.396 -11.411   1.350
  439   2HB   GLU  54          1HB       GLU  54   9.352 -11.008   3.062
  440   1HG   GLU  54          2HG       GLU  54   7.556 -12.615   3.403
  441   2HG   GLU  54          1HG       GLU  54   7.575 -13.008   1.686
  442    H    TRP  55           H        TRP  55   7.616  -8.397   3.652
  443    HA   TRP  55           HA       TRP  55   9.096  -6.546   1.908
  444   1HB   TRP  55          2HB       TRP  55   6.662  -5.998   2.283
  445   2HB   TRP  55          1HB       TRP  55   7.047  -5.761   3.985
  446    HD1  TRP  55           HD       TRP  55   7.179  -3.246   4.476
  447    HE1  TRP  55           1HE      TRP  55   8.123  -1.165   3.272
  448    HE3  TRP  55           3HE      TRP  55   8.808  -5.470   0.169
  449    HZ2  TRP  55           2HZ      TRP  55   9.389  -0.559   0.827
  450    HZ3  TRP  55           3HZ      TRP  55   9.871  -4.070  -1.553
  451    HH2  TRP  55           HH       TRP  55  10.154  -1.663  -1.230
  452    H    THR  56           H        THR  56  10.566  -5.132   2.867
  453    HA   THR  56           HA       THR  56  11.908  -6.194   5.166
  454    HB   THR  56           HB       THR  56  13.344  -4.055   4.759
  455    HG1  THR  56           1HG      THR  56  12.025  -2.891   3.394
  456   1HG2  THR  56          1HG2      THR  56  13.175  -6.227   2.667
  457   2HG2  THR  56          2HG2      THR  56  14.070  -6.322   4.185
  458   3HG2  THR  56          3HG2      THR  56  14.557  -5.167   2.944
  459    HA   PRO  57           HA       PRO  57  10.110  -3.635   8.313
  460   1HB   PRO  57          2HB       PRO  57  12.774  -3.508   9.563
  461   2HB   PRO  57          1HB       PRO  57  11.277  -4.212  10.181
  462   1HG   PRO  57          2HG       PRO  57  13.330  -5.750   9.392
  463   2HG   PRO  57          1HG       PRO  57  11.642  -6.237   9.142
  464   1HD   PRO  57          2HD       PRO  57  13.584  -5.056   7.191
  465   2HD   PRO  57          1HD       PRO  57  12.422  -6.380   6.960
  466    H    ASN  58           H        ASN  58  10.689  -1.565   9.590
  467    HA   ASN  58           HA       ASN  58  11.462   0.445   7.649
  468   1HB   ASN  58          2HB       ASN  58   9.506   0.633   9.274
  469   2HB   ASN  58          1HB       ASN  58  10.701   0.893  10.540
  470   1HD2  ASN  58          1HD2      ASN  58  11.611   2.875  10.771
  471   2HD2  ASN  58          2HD2      ASN  58  11.216   4.241   9.790
  472    H    ASN  59           H        ASN  59  13.331  -1.517   9.137
  473    HA   ASN  59           HA       ASN  59  15.401   0.469   9.757
  474   1HB   ASN  59          2HB       ASN  59  14.431  -0.531  11.847
  475   2HB   ASN  59          1HB       ASN  59  14.962  -2.111  11.284
  476   1HD2  ASN  59          1HD2      ASN  59  15.989   1.033  12.372
  477   2HD2  ASN  59          2HD2      ASN  59  17.582   0.560  12.852
  478    H    LEU  60           H        LEU  60  17.219   0.139   8.601
  479    HA   LEU  60           HA       LEU  60  17.216  -2.126   6.784
  480   1HB   LEU  60          2HB       LEU  60  19.030   0.276   6.961
  481   2HB   LEU  60          1HB       LEU  60  19.118  -0.949   5.710
  482    HG   LEU  60           HG       LEU  60  16.787   0.907   6.204
  483   1HD1  LEU  60          1HD1      LEU  60  18.718   2.030   5.216
  484   2HD1  LEU  60          2HD1      LEU  60  17.401   1.880   4.051
  485   3HD1  LEU  60          3HD1      LEU  60  18.792   0.800   3.955
  486   1HD2  LEU  60          1HD2      LEU  60  17.199  -1.172   4.059
  487   2HD2  LEU  60          2HD2      LEU  60  15.853  -0.037   4.157
  488   3HD2  LEU  60          3HD2      LEU  60  16.052  -1.278   5.394
  489    H    GLU  61           H        GLU  61  18.644  -3.749   6.717
  490    HA   GLU  61           HA       GLU  61  19.965  -5.373   7.585
  491   1HB   GLU  61          2HB       GLU  61  21.584  -2.940   8.355
  492   2HB   GLU  61          1HB       GLU  61  22.143  -4.580   8.635
  493   1HG   GLU  61          2HG       GLU  61  23.184  -3.945   6.663
  494   2HG   GLU  61          1HG       GLU  61  21.824  -4.932   6.133
  Start of MODEL   16
    1   1H    MET   1          1HT       MET   1 -13.039  18.972   3.883
    2   2H    MET   1          2HT       MET   1 -12.327  20.273   4.703
    3   3H    MET   1          3HT       MET   1 -13.773  19.606   5.276
    4    HA   MET   1           HA       MET   1 -11.921  18.884   6.629
    5   1HB   MET   1          2HB       MET   1 -13.043  16.701   4.855
    6   2HB   MET   1          1HB       MET   1 -12.249  16.433   6.401
    7   1HG   MET   1          2HG       MET   1 -14.010  17.652   7.537
    8   2HG   MET   1          1HG       MET   1 -14.787  17.997   5.995
    9   1HE   MET   1          1HE       MET   1 -15.881  16.117   4.439
   10   2HE   MET   1          2HE       MET   1 -15.864  14.397   4.832
   11   3HE   MET   1          3HE       MET   1 -14.354  15.229   4.450
   12    H    SER   2           H        SER   2  -9.868  18.011   6.809
   13    HA   SER   2           HA       SER   2  -8.349  17.871   4.301
   14   1HB   SER   2          2HB       SER   2  -6.350  18.083   5.819
   15   2HB   SER   2          1HB       SER   2  -7.436  19.470   5.848
   16    HG   SER   2           HG       SER   2  -7.390  19.154   7.924
   17    H    LEU   3           H        LEU   3  -7.194  16.097   3.733
   18    HA   LEU   3           HA       LEU   3  -6.584  13.923   3.576
   19   1HB   LEU   3          2HB       LEU   3  -5.553  14.181   5.777
   20   2HB   LEU   3          1HB       LEU   3  -7.092  13.861   6.555
   21    HG   LEU   3           HG       LEU   3  -7.058  11.575   5.567
   22   1HD1  LEU   3          1HD1      LEU   3  -4.930  10.710   4.702
   23   2HD1  LEU   3          2HD1      LEU   3  -4.253  12.336   4.770
   24   3HD1  LEU   3          3HD1      LEU   3  -5.590  11.986   3.676
   25   1HD2  LEU   3          1HD2      LEU   3  -4.709  12.305   7.309
   26   2HD2  LEU   3          2HD2      LEU   3  -5.379  10.684   7.112
   27   3HD2  LEU   3          3HD2      LEU   3  -6.348  11.954   7.862
   28    H    ASP   4           H        ASP   4  -7.905  12.660   2.468
   29    HA   ASP   4           HA       ASP   4 -10.612  12.233   3.534
   30   1HB   ASP   4          2HB       ASP   4 -10.578  13.407   1.382
   31   2HB   ASP   4          1HB       ASP   4  -9.697  12.061   0.660
   32    HA   PRO   5           HA       PRO   5  -8.896   8.003   3.802
   33   1HB   PRO   5          2HB       PRO   5 -10.335   7.280   5.971
   34   2HB   PRO   5          1HB       PRO   5  -8.827   8.192   6.101
   35   1HG   PRO   5          2HG       PRO   5 -11.651   9.167   6.236
   36   2HG   PRO   5          1HG       PRO   5 -10.259   9.626   7.234
   37   1HD   PRO   5          2HD       PRO   5 -11.167  11.132   5.148
   38   2HD   PRO   5          1HD       PRO   5  -9.473  11.112   5.671
   39    H    GLN   6           H        GLN   6 -11.671   9.390   2.799
   40    HA   GLN   6           HA       GLN   6 -13.524   7.215   2.934
   41   1HB   GLN   6          2HB       GLN   6 -14.269   9.550   2.793
   42   2HB   GLN   6          1HB       GLN   6 -13.510   9.706   1.216
   43   1HG   GLN   6          2HG       GLN   6 -15.315   7.487   1.195
   44   2HG   GLN   6          1HG       GLN   6 -16.137   8.920   1.809
   45   1HE2  GLN   6          1HE2      GLN   6 -16.350  10.723   0.476
   46   2HE2  GLN   6          2HE2      GLN   6 -16.136  10.628  -1.236
   47    H    LEU   7           H        LEU   7 -11.257   8.463   0.538
   48    HA   LEU   7           HA       LEU   7 -12.020   6.572  -1.484
   49   1HB   LEU   7          2HB       LEU   7  -9.601   8.356  -1.223
   50   2HB   LEU   7          1HB       LEU   7  -9.963   7.385  -2.637
   51    HG   LEU   7           HG       LEU   7 -11.678   9.632  -1.573
   52   1HD1  LEU   7          1HD1      LEU   7 -10.959  10.829  -3.581
   53   2HD1  LEU   7          2HD1      LEU   7  -9.882   9.494  -3.991
   54   3HD1  LEU   7          3HD1      LEU   7  -9.594  10.445  -2.532
   55   1HD2  LEU   7          1HD2      LEU   7 -11.939   7.930  -4.046
   56   2HD2  LEU   7          2HD2      LEU   7 -12.911   9.354  -3.684
   57   3HD2  LEU   7          3HD2      LEU   7 -13.019   7.927  -2.653
   58    H    LEU   8           H        LEU   8 -10.583   6.037   1.364
   59    HA   LEU   8           HA       LEU   8  -8.864   3.901   0.288
   60   1HB   LEU   8          2HB       LEU   8  -8.471   5.494   2.825
   61   2HB   LEU   8          1HB       LEU   8  -7.495   4.119   2.343
   62    HG   LEU   8           HG       LEU   8  -7.699   6.727   0.833
   63   1HD1  LEU   8          1HD1      LEU   8  -6.507   6.996   2.932
   64   2HD1  LEU   8          2HD1      LEU   8  -5.387   7.071   1.572
   65   3HD1  LEU   8          3HD1      LEU   8  -5.486   5.609   2.552
   66   1HD2  LEU   8          1HD2      LEU   8  -5.867   5.854  -0.513
   67   2HD2  LEU   8          2HD2      LEU   8  -7.283   4.810  -0.629
   68   3HD2  LEU   8          3HD2      LEU   8  -5.918   4.334   0.381
   69    H    GLU   9           H        GLU   9 -10.847   4.901   3.054
   70    HA   GLU   9           HA       GLU   9 -12.156   3.782   4.508
   71   1HB   GLU   9          2HB       GLU   9 -12.141   1.760   2.275
   72   2HB   GLU   9          1HB       GLU   9 -13.081   1.543   3.746
   73   1HG   GLU   9          2HG       GLU   9 -14.199   3.728   3.248
   74   2HG   GLU   9          1HG       GLU   9 -13.375   3.719   1.690
   75    H    VAL  10           H        VAL  10 -12.334   1.090   5.221
   76    HA   VAL  10           HA       VAL  10  -9.761   0.784   6.568
   77    HB   VAL  10           HB       VAL  10 -12.345  -0.720   7.018
   78   1HG1  VAL  10          1HG1      VAL  10  -9.817  -0.615   8.661
   79   2HG1  VAL  10          2HG1      VAL  10 -10.383  -1.990   7.713
   80   3HG1  VAL  10          3HG1      VAL  10 -11.306  -1.446   9.114
   81   1HG2  VAL  10          1HG2      VAL  10 -12.570   1.651   7.551
   82   2HG2  VAL  10          2HG2      VAL  10 -11.137   1.565   8.572
   83   3HG2  VAL  10          3HG2      VAL  10 -12.589   0.670   9.015
   84    H    LEU  11           H        LEU  11  -8.292  -0.389   5.579
   85    HA   LEU  11           HA       LEU  11  -9.127  -2.491   3.729
   86   1HB   LEU  11          2HB       LEU  11  -6.419  -1.220   4.140
   87   2HB   LEU  11          1HB       LEU  11  -6.819  -2.395   2.901
   88    HG   LEU  11           HG       LEU  11  -8.031   0.360   3.124
   89   1HD1  LEU  11          1HD1      LEU  11  -5.675   0.461   2.528
   90   2HD1  LEU  11          2HD1      LEU  11  -6.696   0.904   1.161
   91   3HD1  LEU  11          3HD1      LEU  11  -5.948  -0.692   1.222
   92   1HD2  LEU  11          1HD2      LEU  11  -8.953  -0.101   0.920
   93   2HD2  LEU  11          2HD2      LEU  11  -9.527  -1.279   2.102
   94   3HD2  LEU  11          3HD2      LEU  11  -8.259  -1.723   0.956
   95    H    ALA  12           H        ALA  12  -8.968  -4.557   4.244
   96    HA   ALA  12           HA       ALA  12  -7.264  -5.301   6.524
   97   1HB   ALA  12          1HB       ALA  12  -9.915  -6.512   5.733
   98   2HB   ALA  12          2HB       ALA  12  -9.638  -5.436   7.104
   99   3HB   ALA  12          3HB       ALA  12  -8.899  -7.039   7.076
  100    H    CYS  13           H        CYS  13  -6.793  -7.719   6.498
  101    HA   CYS  13           HA       CYS  13  -5.600  -8.295   3.915
  102   1HB   CYS  13          2HB       CYS  13  -5.348  -9.848   6.493
  103   2HB   CYS  13          1HB       CYS  13  -4.280  -9.923   5.093
  104    HG   CYS  13           HG       CYS  13  -4.659  -7.071   6.949
  105    HA   PRO  14           HA       PRO  14  -8.658 -11.325   2.796
  106   1HB   PRO  14          2HB       PRO  14  -7.245 -12.709   0.951
  107   2HB   PRO  14          1HB       PRO  14  -7.876 -11.087   0.648
  108   1HG   PRO  14          2HG       PRO  14  -5.110 -11.925   1.442
  109   2HG   PRO  14          1HG       PRO  14  -5.613 -10.743   0.218
  110   1HD   PRO  14          2HD       PRO  14  -4.771 -10.021   2.689
  111   2HD   PRO  14          1HD       PRO  14  -5.985  -9.096   1.784
  112    H    LYS  15           H        LYS  15  -5.805 -12.033   4.449
  113    HA   LYS  15           HA       LYS  15  -6.265 -14.906   4.533
  114   1HB   LYS  15          2HB       LYS  15  -4.071 -13.130   5.566
  115   2HB   LYS  15          1HB       LYS  15  -4.215 -14.799   6.099
  116   1HG   LYS  15          2HG       LYS  15  -3.992 -15.573   3.810
  117   2HG   LYS  15          1HG       LYS  15  -3.900 -13.903   3.242
  118   1HD   LYS  15          2HD       LYS  15  -1.829 -13.552   4.372
  119   2HD   LYS  15          1HD       LYS  15  -1.963 -15.090   5.222
  120   1HE   LYS  15          2HE       LYS  15  -1.768 -14.866   2.226
  121   2HE   LYS  15          1HE       LYS  15  -0.362 -15.044   3.275
  122   1HZ   LYS  15          1HZ       LYS  15  -1.064 -17.176   2.404
  123   2HZ   LYS  15          2HZ       LYS  15  -2.617 -16.970   3.054
  124   3HZ   LYS  15          3HZ       LYS  15  -1.290 -17.135   4.086
  125    H    ASP  16           H        ASP  16  -5.592 -12.505   7.098
  126    HA   ASP  16           HA       ASP  16  -7.534 -13.953   8.779
  127   1HB   ASP  16          2HB       ASP  16  -5.118 -14.302   9.396
  128   2HB   ASP  16          1HB       ASP  16  -5.014 -12.581   9.747
  129    H    LYS  17           H        LYS  17  -7.459 -11.360   7.070
  130    HA   LYS  17           HA       LYS  17  -8.221  -9.226   7.122
  131   1HB   LYS  17          2HB       LYS  17  -9.982 -10.583   9.145
  132   2HB   LYS  17          1HB       LYS  17 -10.233  -8.905   8.671
  133   1HG   LYS  17          2HG       LYS  17 -10.402  -9.666   6.308
  134   2HG   LYS  17          1HG       LYS  17 -10.324 -11.330   6.887
  135   1HD   LYS  17          2HD       LYS  17 -12.372 -11.071   8.098
  136   2HD   LYS  17          1HD       LYS  17 -12.405  -9.336   7.770
  137   1HE   LYS  17          2HE       LYS  17 -12.627  -9.803   5.373
  138   2HE   LYS  17          1HE       LYS  17 -12.614 -11.533   5.711
  139   1HZ   LYS  17          1HZ       LYS  17 -14.857 -10.609   5.378
  140   2HZ   LYS  17          2HZ       LYS  17 -14.653  -9.641   6.757
  141   3HZ   LYS  17          3HZ       LYS  17 -14.663 -11.331   6.903
  142    H    GLY  18           H        GLY  18  -5.908  -9.692   8.703
  143   1HA   GLY  18          2HA       GLY  18  -6.106  -8.176  11.128
  144   2HA   GLY  18          1HA       GLY  18  -4.622  -8.709  10.345
  145    HA   PRO  19           HA       PRO  19  -5.571  -4.069   9.744
  146   1HB   PRO  19          2HB       PRO  19  -3.328  -3.558  11.557
  147   2HB   PRO  19          1HB       PRO  19  -4.974  -2.924  11.610
  148   1HG   PRO  19          2HG       PRO  19  -4.063  -4.712  13.412
  149   2HG   PRO  19          1HG       PRO  19  -5.753  -4.679  12.880
  150   1HD   PRO  19          2HD       PRO  19  -3.532  -6.501  12.034
  151   2HD   PRO  19          1HD       PRO  19  -5.235  -6.880  12.374
  152    H    LEU  20           H        LEU  20  -4.531  -2.874   8.261
  153    HA   LEU  20           HA       LEU  20  -1.810  -3.681   7.468
  154   1HB   LEU  20          2HB       LEU  20  -4.096  -2.569   5.838
  155   2HB   LEU  20          1HB       LEU  20  -2.455  -2.685   5.235
  156    HG   LEU  20           HG       LEU  20  -4.071  -5.063   6.156
  157   1HD1  LEU  20          1HD1      LEU  20  -5.125  -4.030   4.212
  158   2HD1  LEU  20          2HD1      LEU  20  -4.363  -5.562   3.778
  159   3HD1  LEU  20          3HD1      LEU  20  -3.581  -4.037   3.361
  160   1HD2  LEU  20          1HD2      LEU  20  -1.656  -5.364   6.274
  161   2HD2  LEU  20          2HD2      LEU  20  -1.494  -4.816   4.604
  162   3HD2  LEU  20          3HD2      LEU  20  -2.339  -6.324   4.960
  163    H    ARG  21           H        ARG  21  -0.252  -2.166   7.615
  164    HA   ARG  21           HA       ARG  21  -1.058   0.561   8.292
  165   1HB   ARG  21          2HB       ARG  21   0.706  -0.688   9.624
  166   2HB   ARG  21          1HB       ARG  21   1.752  -0.542   8.218
  167   1HG   ARG  21          2HG       ARG  21   1.619   1.888   8.357
  168   2HG   ARG  21          1HG       ARG  21   0.548   1.754   9.749
  169   1HD   ARG  21          2HD       ARG  21   3.411   0.815   9.596
  170   2HD   ARG  21          1HD       ARG  21   2.829   2.249  10.437
  171    HE   ARG  21           HE       ARG  21   2.490  -0.538  11.277
  172   1HH1  ARG  21          1HH1      ARG  21   1.829   2.870  11.890
  173   2HH1  ARG  21          2HH1      ARG  21   1.475   2.612  13.571
  174   1HH2  ARG  21          1HH2      ARG  21   2.042  -0.848  13.488
  175   2HH2  ARG  21          2HH2      ARG  21   1.616   0.524  14.483
  176    H    TYR  22           H        TYR  22  -0.741   2.281   6.985
  177    HA   TYR  22           HA       TYR  22  -0.147   1.636   4.209
  178   1HB   TYR  22          2HB       TYR  22  -2.222   2.754   4.486
  179   2HB   TYR  22          1HB       TYR  22  -1.517   3.964   5.548
  180    HD1  TYR  22           1HD      TYR  22  -0.989   2.705   2.050
  181    HD2  TYR  22           2HD      TYR  22  -1.270   6.054   4.660
  182    HE1  TYR  22           1HE      TYR  22  -0.698   4.222   0.133
  183    HE2  TYR  22           2HE      TYR  22  -0.973   7.575   2.756
  184    HH   TYR  22           HH       TYR  22  -0.201   7.654   0.560
  185    H    LEU  23           H        LEU  23   1.740   2.043   3.347
  186    HA   LEU  23           HA       LEU  23   3.411   4.186   4.474
  187   1HB   LEU  23          2HB       LEU  23   4.056   1.704   2.916
  188   2HB   LEU  23          1HB       LEU  23   5.171   3.057   2.924
  189    HG   LEU  23           HG       LEU  23   5.256   2.893   5.421
  190   1HD1  LEU  23          1HD1      LEU  23   4.491   0.832   6.484
  191   2HD1  LEU  23          2HD1      LEU  23   3.753   0.318   4.967
  192   3HD1  LEU  23          3HD1      LEU  23   3.141   1.743   5.806
  193   1HD2  LEU  23          1HD2      LEU  23   7.002   1.928   4.031
  194   2HD2  LEU  23          2HD2      LEU  23   6.074   0.436   3.879
  195   3HD2  LEU  23          3HD2      LEU  23   6.708   0.925   5.451
  196    H    GLU  24           H        GLU  24   3.876   5.945   3.319
  197    HA   GLU  24           HA       GLU  24   2.270   6.410   0.971
  198   1HB   GLU  24          2HB       GLU  24   4.243   8.243   2.331
  199   2HB   GLU  24          1HB       GLU  24   3.019   8.716   1.162
  200   1HG   GLU  24          2HG       GLU  24   1.282   7.941   2.763
  201   2HG   GLU  24          1HG       GLU  24   2.565   7.665   3.942
  202    H    SER  25           H        SER  25   5.320   5.172   1.410
  203    HA   SER  25           HA       SER  25   6.988   6.425  -0.370
  204   1HB   SER  25          2HB       SER  25   6.850   3.437   0.050
  205   2HB   SER  25          1HB       SER  25   8.263   4.381  -0.426
  206    HG   SER  25           HG       SER  25   7.992   5.504   1.630
  207    H    GLU  26           H        GLU  26   4.998   3.554  -1.169
  208    HA   GLU  26           HA       GLU  26   4.746   4.594  -3.907
  209   1HB   GLU  26          2HB       GLU  26   5.323   1.698  -3.239
  210   2HB   GLU  26          1HB       GLU  26   5.053   2.356  -4.844
  211   1HG   GLU  26          2HG       GLU  26   7.099   3.798  -4.430
  212   2HG   GLU  26          1HG       GLU  26   7.413   2.755  -3.042
  213    H    GLN  27           H        GLN  27   2.998   4.517  -1.532
  214    HA   GLN  27           HA       GLN  27   0.948   3.896  -0.788
  215   1HB   GLN  27          2HB       GLN  27   0.608   3.405  -3.744
  216   2HB   GLN  27          1HB       GLN  27  -0.682   3.053  -2.607
  217   1HG   GLN  27          2HG       GLN  27  -0.977   5.225  -3.669
  218   2HG   GLN  27          1HG       GLN  27  -0.767   5.374  -1.928
  219   1HE2  GLN  27          1HE2      GLN  27   0.984   6.439  -1.126
  220   2HE2  GLN  27          2HE2      GLN  27   2.105   7.316  -2.109
  221    H    LEU  28           H        LEU  28   2.064   2.270   0.411
  222    HA   LEU  28           HA       LEU  28   1.638  -0.448  -0.641
  223   1HB   LEU  28          2HB       LEU  28   3.902   0.530   1.101
  224   2HB   LEU  28          1HB       LEU  28   3.635  -1.139   0.639
  225    HG   LEU  28           HG       LEU  28   4.230   1.110  -1.283
  226   1HD1  LEU  28          1HD1      LEU  28   5.996  -1.089  -0.216
  227   2HD1  LEU  28          2HD1      LEU  28   6.143   0.635   0.131
  228   3HD1  LEU  28          3HD1      LEU  28   6.425   0.037  -1.505
  229   1HD2  LEU  28          1HD2      LEU  28   2.907  -0.661  -2.303
  230   2HD2  LEU  28          2HD2      LEU  28   4.041  -1.872  -1.704
  231   3HD2  LEU  28          3HD2      LEU  28   4.565  -0.696  -2.909
  232    H    LEU  29           H        LEU  29   0.851  -1.971   0.734
  233    HA   LEU  29           HA       LEU  29   0.020  -1.031   3.400
  234   1HB   LEU  29          2HB       LEU  29  -1.140  -3.208   1.651
  235   2HB   LEU  29          1HB       LEU  29  -1.663  -2.863   3.287
  236    HG   LEU  29           HG       LEU  29  -1.847  -0.909   0.994
  237   1HD1  LEU  29          1HD1      LEU  29  -3.956  -2.670   2.233
  238   2HD1  LEU  29          2HD1      LEU  29  -3.315  -2.789   0.593
  239   3HD1  LEU  29          3HD1      LEU  29  -4.259  -1.379   1.074
  240   1HD2  LEU  29          1HD2      LEU  29  -3.290   0.348   2.517
  241   2HD2  LEU  29          2HD2      LEU  29  -1.667   0.149   3.183
  242   3HD2  LEU  29          3HD2      LEU  29  -2.994  -0.847   3.784
  243    H    VAL  30           H        VAL  30   1.093  -1.887   5.055
  244    HA   VAL  30           HA       VAL  30   2.539  -4.409   4.600
  245    HB   VAL  30           HB       VAL  30   3.117  -2.241   6.630
  246   1HG1  VAL  30          1HG1      VAL  30   5.144  -3.516   7.125
  247   2HG1  VAL  30          2HG1      VAL  30   4.641  -4.769   5.993
  248   3HG1  VAL  30          3HG1      VAL  30   3.700  -4.471   7.456
  249   1HG2  VAL  30          1HG2      VAL  30   4.633  -3.059   4.151
  250   2HG2  VAL  30          2HG2      VAL  30   5.109  -1.807   5.301
  251   3HG2  VAL  30          3HG2      VAL  30   3.656  -1.600   4.320
  252    H    ASN  31           H        ASN  31   1.753  -6.123   5.522
  253    HA   ASN  31           HA       ASN  31  -0.237  -5.983   7.599
  254   1HB   ASN  31          2HB       ASN  31  -0.487  -7.719   5.946
  255   2HB   ASN  31          1HB       ASN  31   1.153  -8.297   6.225
  256   1HD2  ASN  31          1HD2      ASN  31  -2.113  -8.276   7.402
  257   2HD2  ASN  31          2HD2      ASN  31  -1.887  -9.497   8.605
  258    H    GLU  32           H        GLU  32   0.225  -5.775   9.662
  259    HA   GLU  32           HA       GLU  32   2.981  -6.111  10.544
  260   1HB   GLU  32          2HB       GLU  32   1.451  -4.051  10.927
  261   2HB   GLU  32          1HB       GLU  32   0.718  -5.019  12.197
  262   1HG   GLU  32          2HG       GLU  32   2.710  -5.080  13.441
  263   2HG   GLU  32          1HG       GLU  32   3.668  -4.484  12.085
  264    H    ARG  33           H        ARG  33   1.154  -8.387  10.061
  265    HA   ARG  33           HA       ARG  33   1.138  -9.583  12.758
  266   1HB   ARG  33          2HB       ARG  33  -0.694  -9.835  10.419
  267   2HB   ARG  33          1HB       ARG  33  -0.476 -11.234  11.459
  268   1HG   ARG  33          2HG       ARG  33  -1.273  -8.536  12.506
  269   2HG   ARG  33          1HG       ARG  33  -2.439  -9.755  11.979
  270   1HD   ARG  33          2HD       ARG  33  -1.176 -11.330  13.583
  271   2HD   ARG  33          1HD       ARG  33  -0.516  -9.850  14.278
  272    HE   ARG  33           HE       ARG  33  -2.566  -9.386  15.210
  273   1HH1  ARG  33          1HH1      ARG  33  -2.878 -12.001  12.886
  274   2HH1  ARG  33          2HH1      ARG  33  -4.521 -12.371  13.319
  275   1HH2  ARG  33          1HH2      ARG  33  -4.707  -9.920  15.837
  276   2HH2  ARG  33          2HH2      ARG  33  -5.551 -11.206  15.029
  277    H    LEU  34           H        LEU  34   1.339 -10.517   9.348
  278    HA   LEU  34           HA       LEU  34   3.036 -12.802  10.061
  279   1HB   LEU  34          2HB       LEU  34   1.714 -12.150   7.423
  280   2HB   LEU  34          1HB       LEU  34   2.443 -13.675   7.889
  281    HG   LEU  34           HG       LEU  34   0.060 -12.554   9.346
  282   1HD1  LEU  34          1HD1      LEU  34   0.088 -14.335   6.914
  283   2HD1  LEU  34          2HD1      LEU  34  -0.592 -12.711   7.030
  284   3HD1  LEU  34          3HD1      LEU  34  -1.318 -14.040   7.934
  285   1HD2  LEU  34          1HD2      LEU  34  -0.269 -14.893   9.963
  286   2HD2  LEU  34          2HD2      LEU  34   1.324 -14.317  10.465
  287   3HD2  LEU  34          3HD2      LEU  34   1.164 -15.343   9.038
  288    H    ASN  35           H        ASN  35   3.261  -9.668   9.072
  289    HA   ASN  35           HA       ASN  35   4.863  -8.335   8.207
  290   1HB   ASN  35          2HB       ASN  35   6.341  -9.667   9.725
  291   2HB   ASN  35          1HB       ASN  35   6.686 -10.747   8.377
  292   1HD2  ASN  35          1HD2      ASN  35   8.052 -10.099   6.784
  293   2HD2  ASN  35          2HD2      ASN  35   8.995  -8.653   6.862
  294    H    LEU  36           H        LEU  36   3.338  -8.639   6.364
  295    HA   LEU  36           HA       LEU  36   4.841  -9.494   3.993
  296   1HB   LEU  36          2HB       LEU  36   1.928 -10.089   4.541
  297   2HB   LEU  36          1HB       LEU  36   2.711 -10.324   2.993
  298    HG   LEU  36           HG       LEU  36   3.444 -11.778   5.539
  299   1HD1  LEU  36          1HD1      LEU  36   2.420 -13.720   4.471
  300   2HD1  LEU  36          2HD1      LEU  36   1.927 -12.718   3.106
  301   3HD1  LEU  36          3HD1      LEU  36   1.241 -12.428   4.705
  302   1HD2  LEU  36          1HD2      LEU  36   4.797 -13.185   4.065
  303   2HD2  LEU  36          2HD2      LEU  36   5.335 -11.505   4.017
  304   3HD2  LEU  36          3HD2      LEU  36   4.373 -12.163   2.693
  305    H    ALA  37           H        ALA  37   3.974  -8.446   1.987
  306    HA   ALA  37           HA       ALA  37   2.835  -5.809   2.656
  307   1HB   ALA  37          1HB       ALA  37   4.254  -4.822   0.927
  308   2HB   ALA  37          2HB       ALA  37   4.983  -6.399   0.624
  309   3HB   ALA  37          3HB       ALA  37   5.215  -5.604   2.181
  310    H    TYR  38           H        TYR  38   1.251  -5.054   1.450
  311    HA   TYR  38           HA       TYR  38   0.520  -6.501  -1.011
  312   1HB   TYR  38          2HB       TYR  38  -1.237  -5.017   0.961
  313   2HB   TYR  38          1HB       TYR  38  -1.793  -5.585  -0.607
  314    HD1  TYR  38           1HD      TYR  38  -1.098  -6.489   2.819
  315    HD2  TYR  38           2HD      TYR  38  -1.839  -8.043  -1.073
  316    HE1  TYR  38           1HE      TYR  38  -1.650  -8.673   3.803
  317    HE2  TYR  38           2HE      TYR  38  -2.396 -10.229  -0.097
  318    HH   TYR  38           HH       TYR  38  -1.917 -11.496   1.962
  319    H    ARG  39           H        ARG  39  -0.071  -5.245  -2.806
  320    HA   ARG  39           HA       ARG  39   1.244  -2.623  -2.774
  321   1HB   ARG  39          2HB       ARG  39   0.486  -4.277  -5.189
  322   2HB   ARG  39          1HB       ARG  39   1.641  -2.950  -5.112
  323   1HG   ARG  39          2HG       ARG  39   3.190  -4.260  -3.876
  324   2HG   ARG  39          1HG       ARG  39   2.001  -5.537  -3.625
  325   1HD   ARG  39          2HD       ARG  39   1.957  -5.757  -6.169
  326   2HD   ARG  39          1HD       ARG  39   3.423  -4.775  -6.158
  327    HE   ARG  39           HE       ARG  39   3.922  -6.769  -4.359
  328   1HH1  ARG  39          1HH1      ARG  39   3.084  -6.654  -7.759
  329   2HH1  ARG  39          2HH1      ARG  39   3.826  -8.182  -8.115
  330   1HH2  ARG  39          1HH2      ARG  39   4.882  -8.784  -4.833
  331   2HH2  ARG  39          2HH2      ARG  39   4.839  -9.383  -6.465
  332    H    ILE  40           H        ILE  40   0.192  -0.778  -3.432
  333    HA   ILE  40           HA       ILE  40  -2.680  -1.074  -4.008
  334    HB   ILE  40           HB       ILE  40  -1.179   1.349  -2.994
  335   1HG1  ILE  40          2HG1      ILE  40  -3.166  -0.470  -1.613
  336   2HG1  ILE  40          1HG1      ILE  40  -1.430  -0.459  -1.326
  337   1HG2  ILE  40          1HG2      ILE  40  -3.408   2.349  -2.708
  338   2HG2  ILE  40          2HG2      ILE  40  -4.127   0.936  -3.485
  339   3HG2  ILE  40          3HG2      ILE  40  -3.054   1.995  -4.401
  340   1HD1  ILE  40          1HD1      ILE  40  -3.336   1.799  -0.776
  341   2HD1  ILE  40          2HD1      ILE  40  -1.593   1.843  -0.515
  342   3HD1  ILE  40          3HD1      ILE  40  -2.597   0.733   0.419
  343    H    ASP  41           H        ASP  41  -3.331  -0.717  -6.025
  344    HA   ASP  41           HA       ASP  41  -1.449   0.486  -7.908
  345   1HB   ASP  41          2HB       ASP  41  -2.517  -1.686  -8.470
  346   2HB   ASP  41          1HB       ASP  41  -4.088  -0.891  -8.456
  347    H    ASP  42           H        ASP  42  -1.578   2.635  -7.501
  348    HA   ASP  42           HA       ASP  42  -2.275   4.775  -7.769
  349   1HB   ASP  42          2HB       ASP  42  -2.701   3.798 -10.065
  350   2HB   ASP  42          1HB       ASP  42  -4.395   3.673  -9.606
  351    H    GLY  43           H        GLY  43  -3.776   2.906  -5.823
  352   1HA   GLY  43          2HA       GLY  43  -5.070   4.229  -4.112
  353   2HA   GLY  43          1HA       GLY  43  -6.120   4.665  -5.451
  354    H    ILE  44           H        ILE  44  -5.578   1.763  -6.411
  355    HA   ILE  44           HA       ILE  44  -7.677   0.569  -4.734
  356    HB   ILE  44           HB       ILE  44  -6.860  -0.094  -7.575
  357   1HG1  ILE  44          2HG1      ILE  44  -9.356   0.494  -7.940
  358   2HG1  ILE  44          1HG1      ILE  44  -9.255   1.277  -6.369
  359   1HG2  ILE  44          1HG2      ILE  44  -8.729  -1.698  -7.555
  360   2HG2  ILE  44          2HG2      ILE  44  -8.944  -1.392  -5.832
  361   3HG2  ILE  44          3HG2      ILE  44  -7.454  -2.130  -6.415
  362   1HD1  ILE  44          1HD1      ILE  44  -8.966   2.881  -8.149
  363   2HD1  ILE  44          2HD1      ILE  44  -7.614   1.954  -8.797
  364   3HD1  ILE  44          3HD1      ILE  44  -7.475   2.727  -7.219
  365    HA   PRO  45           HA       PRO  45  -4.288  -1.881  -3.169
  366   1HB   PRO  45          2HB       PRO  45  -6.410  -3.295  -1.709
  367   2HB   PRO  45          1HB       PRO  45  -5.038  -2.378  -1.086
  368   1HG   PRO  45          2HG       PRO  45  -7.558  -1.465  -0.903
  369   2HG   PRO  45          1HG       PRO  45  -6.177  -0.377  -1.140
  370   1HD   PRO  45          2HD       PRO  45  -8.173  -1.379  -3.134
  371   2HD   PRO  45          1HD       PRO  45  -7.472   0.245  -2.955
  372    H    VAL  46           H        VAL  46  -3.403  -3.567  -4.131
  373    HA   VAL  46           HA       VAL  46  -5.039  -5.520  -5.524
  374    HB   VAL  46           HB       VAL  46  -2.027  -5.406  -5.241
  375   1HG1  VAL  46          1HG1      VAL  46  -3.786  -6.955  -7.140
  376   2HG1  VAL  46          2HG1      VAL  46  -2.800  -7.620  -5.835
  377   3HG1  VAL  46          3HG1      VAL  46  -2.024  -6.865  -7.229
  378   1HG2  VAL  46          1HG2      VAL  46  -2.868  -3.401  -6.333
  379   2HG2  VAL  46          2HG2      VAL  46  -3.790  -4.390  -7.465
  380   3HG2  VAL  46          3HG2      VAL  46  -2.025  -4.428  -7.495
  381    H    LEU  47           H        LEU  47  -6.080  -6.476  -3.762
  382    HA   LEU  47           HA       LEU  47  -4.444  -7.742  -1.723
  383   1HB   LEU  47          2HB       LEU  47  -7.445  -7.591  -2.019
  384   2HB   LEU  47          1HB       LEU  47  -6.606  -8.324  -0.664
  385    HG   LEU  47           HG       LEU  47  -6.473  -5.402  -1.427
  386   1HD1  LEU  47          1HD1      LEU  47  -8.655  -6.063  -0.535
  387   2HD1  LEU  47          2HD1      LEU  47  -7.778  -5.019   0.583
  388   3HD1  LEU  47          3HD1      LEU  47  -7.866  -6.756   0.883
  389   1HD2  LEU  47          1HD2      LEU  47  -5.302  -5.128   0.700
  390   2HD2  LEU  47          2HD2      LEU  47  -4.412  -6.190  -0.391
  391   3HD2  LEU  47          3HD2      LEU  47  -5.335  -6.873   0.946
  392    H    LEU  48           H        LEU  48  -3.463  -9.195  -3.255
  393    HA   LEU  48           HA       LEU  48  -5.163 -11.538  -3.777
  394   1HB   LEU  48          2HB       LEU  48  -2.646 -10.678  -5.207
  395   2HB   LEU  48          1HB       LEU  48  -3.534 -12.156  -5.528
  396    HG   LEU  48           HG       LEU  48  -4.574  -9.352  -5.966
  397   1HD1  LEU  48          1HD1      LEU  48  -2.832 -10.001  -7.556
  398   2HD1  LEU  48          2HD1      LEU  48  -4.410  -9.889  -8.331
  399   3HD1  LEU  48          3HD1      LEU  48  -3.731 -11.468  -7.941
  400   1HD2  LEU  48          1HD2      LEU  48  -6.465 -10.449  -7.056
  401   2HD2  LEU  48          2HD2      LEU  48  -6.354 -10.906  -5.357
  402   3HD2  LEU  48          3HD2      LEU  48  -5.815 -12.028  -6.609
  403    H    ILE  49           H        ILE  49  -4.470 -13.507  -3.052
  404    HA   ILE  49           HA       ILE  49  -2.660 -13.444  -0.831
  405    HB   ILE  49           HB       ILE  49  -3.954 -15.840  -2.155
  406   1HG1  ILE  49          2HG1      ILE  49  -4.899 -14.190   0.204
  407   2HG1  ILE  49          1HG1      ILE  49  -5.598 -14.144  -1.411
  408   1HG2  ILE  49          1HG2      ILE  49  -2.775 -15.510   0.604
  409   2HG2  ILE  49          2HG2      ILE  49  -2.072 -16.437  -0.723
  410   3HG2  ILE  49          3HG2      ILE  49  -3.600 -16.947  -0.002
  411   1HD1  ILE  49          1HD1      ILE  49  -5.530 -16.556   0.382
  412   2HD1  ILE  49          2HD1      ILE  49  -6.294 -16.448  -1.203
  413   3HD1  ILE  49          3HD1      ILE  49  -6.915 -15.492   0.142
  414    H    ASP  50           H        ASP  50  -2.521 -14.503  -4.157
  415    HA   ASP  50           HA       ASP  50  -0.041 -15.893  -3.926
  416   1HB   ASP  50          2HB       ASP  50  -1.594 -16.426  -5.723
  417   2HB   ASP  50          1HB       ASP  50  -1.484 -14.781  -6.343
  418    H    GLU  51           H        GLU  51  -0.949 -12.580  -4.358
  419    HA   GLU  51           HA       GLU  51   1.711 -11.810  -5.274
  420   1HB   GLU  51          2HB       GLU  51  -0.847 -10.253  -4.909
  421   2HB   GLU  51          1HB       GLU  51   0.681  -9.498  -5.345
  422   1HG   GLU  51          2HG       GLU  51  -0.640 -11.678  -6.944
  423   2HG   GLU  51          1HG       GLU  51  -0.831  -9.955  -7.259
  424    H    ALA  52           H        ALA  52   0.453 -12.536  -2.380
  425    HA   ALA  52           HA       ALA  52   1.225 -10.396  -0.718
  426   1HB   ALA  52          1HB       ALA  52   1.204 -12.018   1.101
  427   2HB   ALA  52          2HB       ALA  52   1.176 -13.345  -0.060
  428   3HB   ALA  52          3HB       ALA  52  -0.199 -12.246   0.057
  429    H    THR  53           H        THR  53   3.198  -9.538  -0.750
  430    HA   THR  53           HA       THR  53   5.472 -11.265  -1.403
  431    HB   THR  53           HB       THR  53   5.550  -8.261  -1.226
  432    HG1  THR  53           1HG      THR  53   3.920  -9.533  -2.798
  433   1HG2  THR  53          1HG2      THR  53   7.690  -9.417  -1.420
  434   2HG2  THR  53          2HG2      THR  53   7.338  -8.529  -2.903
  435   3HG2  THR  53          3HG2      THR  53   7.112 -10.277  -2.846
  436    H    GLU  54           H        GLU  54   7.325 -11.311  -0.127
  437    HA   GLU  54           HA       GLU  54   6.878 -10.827   2.685
  438   1HB   GLU  54          2HB       GLU  54   8.039 -12.870   1.796
  439   2HB   GLU  54          1HB       GLU  54   9.373 -11.837   1.307
  440   1HG   GLU  54          2HG       GLU  54   9.800 -11.236   3.609
  441   2HG   GLU  54          1HG       GLU  54   8.409 -12.182   4.139
  442    H    TRP  55           H        TRP  55   7.536  -9.070   3.766
  443    HA   TRP  55           HA       TRP  55   9.156  -7.105   2.281
  444   1HB   TRP  55          2HB       TRP  55   6.688  -6.610   2.642
  445   2HB   TRP  55          1HB       TRP  55   7.042  -6.509   4.361
  446    HD1  TRP  55           HD       TRP  55   7.554  -4.156   5.209
  447    HE1  TRP  55           1HE      TRP  55   8.279  -1.927   4.146
  448    HE3  TRP  55           3HE      TRP  55   8.226  -5.730   0.395
  449    HZ2  TRP  55           2HZ      TRP  55   9.035  -0.963   1.608
  450    HZ3  TRP  55           3HZ      TRP  55   8.953  -4.092  -1.290
  451    HH2  TRP  55           HH       TRP  55   9.347  -1.758  -0.694
  452    H    THR  56           H        THR  56  10.185  -5.449   3.821
  453    HA   THR  56           HA       THR  56  11.687  -6.826   5.840
  454    HB   THR  56           HB       THR  56  12.579  -4.447   6.249
  455    HG1  THR  56           1HG      THR  56  11.144  -3.096   5.343
  456   1HG2  THR  56          1HG2      THR  56  13.771  -6.139   4.921
  457   2HG2  THR  56          2HG2      THR  56  13.983  -4.521   4.252
  458   3HG2  THR  56          3HG2      THR  56  12.861  -5.648   3.491
  459    HA   PRO  57           HA       PRO  57   9.085  -6.164   9.301
  460   1HB   PRO  57          2HB       PRO  57  10.940  -5.563  11.244
  461   2HB   PRO  57          1HB       PRO  57  10.566  -7.199  10.694
  462   1HG   PRO  57          2HG       PRO  57  12.825  -5.404   9.915
  463   2HG   PRO  57          1HG       PRO  57  12.835  -7.151  10.214
  464   1HD   PRO  57          2HD       PRO  57  12.849  -6.142   7.726
  465   2HD   PRO  57          1HD       PRO  57  11.980  -7.640   8.118
  466    H    ASN  58           H        ASN  58   7.863  -4.495   9.888
  467    HA   ASN  58           HA       ASN  58   8.548  -1.804   9.369
  468   1HB   ASN  58          2HB       ASN  58   6.210  -2.557   9.445
  469   2HB   ASN  58          1HB       ASN  58   6.369  -2.927  11.157
  470   1HD2  ASN  58          1HD2      ASN  58   4.724  -1.511  11.753
  471   2HD2  ASN  58          2HD2      ASN  58   4.933   0.206  11.702
  472    H    ASN  59           H        ASN  59   9.841  -0.510  10.493
  473    HA   ASN  59           HA       ASN  59  10.898  -1.402  13.007
  474   1HB   ASN  59          2HB       ASN  59  12.336   0.595  12.906
  475   2HB   ASN  59          1HB       ASN  59  12.403  -0.329  11.413
  476   1HD2  ASN  59          1HD2      ASN  59  11.588   0.564   9.528
  477   2HD2  ASN  59          2HD2      ASN  59  11.160   2.240   9.408
  478    H    LEU  60           H        LEU  60   9.962  -1.083  14.862
  479    HA   LEU  60           HA       LEU  60   8.333   1.337  15.234
  480   1HB   LEU  60          2HB       LEU  60   8.149  -1.338  16.632
  481   2HB   LEU  60          1HB       LEU  60   7.227   0.083  17.086
  482    HG   LEU  60           HG       LEU  60   7.035  -1.351  14.436
  483   1HD1  LEU  60          1HD1      LEU  60   5.155  -1.259  16.791
  484   2HD1  LEU  60          2HD1      LEU  60   6.077  -2.657  16.244
  485   3HD1  LEU  60          3HD1      LEU  60   4.799  -1.991  15.229
  486   1HD2  LEU  60          1HD2      LEU  60   5.442   0.965  15.541
  487   2HD2  LEU  60          2HD2      LEU  60   5.132   0.131  14.019
  488   3HD2  LEU  60          3HD2      LEU  60   6.619   1.054  14.232
  489    H    GLU  61           H        GLU  61   9.388   2.831  16.321
  490    HA   GLU  61           HA       GLU  61  11.750   2.286  17.805
  491   1HB   GLU  61          2HB       GLU  61  10.811   4.479  16.606
  492   2HB   GLU  61          1HB       GLU  61  10.220   4.812  18.226
  493   1HG   GLU  61          2HG       GLU  61  13.095   4.214  17.583
  494   2HG   GLU  61          1HG       GLU  61  12.421   5.839  17.659
  Start of MODEL   17
    1   1H    MET   1          1HT       MET   1  -2.331  19.442   7.620
    2   2H    MET   1          2HT       MET   1  -0.970  19.189   6.637
    3   3H    MET   1          3HT       MET   1  -1.005  18.570   8.216
    4    HA   MET   1           HA       MET   1  -2.769  17.749   5.985
    5   1HB   MET   1          2HB       MET   1  -1.566  15.632   6.031
    6   2HB   MET   1          1HB       MET   1  -0.444  16.951   5.740
    7   1HG   MET   1          2HG       MET   1   0.239  16.887   8.090
    8   2HG   MET   1          1HG       MET   1  -0.880  15.553   8.368
    9   1HE   MET   1          1HE       MET   1   2.206  15.431   9.130
   10   2HE   MET   1          2HE       MET   1   2.617  13.807   8.574
   11   3HE   MET   1          3HE       MET   1   1.084  14.096   9.396
   12    H    SER   2           H        SER   2  -4.072  15.864   6.509
   13    HA   SER   2           HA       SER   2  -4.656  15.621   9.379
   14   1HB   SER   2          2HB       SER   2  -6.734  15.944   7.201
   15   2HB   SER   2          1HB       SER   2  -7.051  15.734   8.925
   16    HG   SER   2           HG       SER   2  -5.728  17.718   9.165
   17    H    LEU   3           H        LEU   3  -4.331  13.561   9.903
   18    HA   LEU   3           HA       LEU   3  -4.624  11.412   8.015
   19   1HB   LEU   3          2HB       LEU   3  -3.045  11.546  10.051
   20   2HB   LEU   3          1HB       LEU   3  -4.447  11.124  11.011
   21    HG   LEU   3           HG       LEU   3  -2.915   9.209  10.449
   22   1HD1  LEU   3          1HD1      LEU   3  -5.229   8.813  11.123
   23   2HD1  LEU   3          2HD1      LEU   3  -4.699   7.635   9.923
   24   3HD1  LEU   3          3HD1      LEU   3  -5.750   8.969   9.445
   25   1HD2  LEU   3          1HD2      LEU   3  -4.022   9.635   7.676
   26   2HD2  LEU   3          2HD2      LEU   3  -3.062   8.252   8.200
   27   3HD2  LEU   3          3HD2      LEU   3  -2.347   9.863   8.175
   28    H    ASP   4           H        ASP   4  -6.561  10.723   7.390
   29    HA   ASP   4           HA       ASP   4  -8.811  10.972   9.263
   30   1HB   ASP   4          2HB       ASP   4  -8.948  12.442   7.257
   31   2HB   ASP   4          1HB       ASP   4  -8.952  11.000   6.244
   32    HA   PRO   5           HA       PRO   5  -8.520   6.456   8.611
   33   1HB   PRO   5          2HB       PRO   5  -9.359   5.775  11.078
   34   2HB   PRO   5          1HB       PRO   5  -7.686   6.242  10.747
   35   1HG   PRO   5          2HG       PRO   5  -9.913   7.873  11.906
   36   2HG   PRO   5          1HG       PRO   5  -8.216   7.777  12.413
   37   1HD   PRO   5          2HD       PRO   5  -9.197   9.800  10.878
   38   2HD   PRO   5          1HD       PRO   5  -7.517   9.239  10.789
   39    H    GLN   6           H        GLN   6 -10.918   8.638   8.624
   40    HA   GLN   6           HA       GLN   6 -13.153   6.843   9.096
   41   1HB   GLN   6          2HB       GLN   6 -13.292   9.610   7.900
   42   2HB   GLN   6          1HB       GLN   6 -14.557   8.733   8.746
   43   1HG   GLN   6          2HG       GLN   6 -13.278   8.925  10.828
   44   2HG   GLN   6          1HG       GLN   6 -12.044   9.846   9.969
   45   1HE2  GLN   6          1HE2      GLN   6 -12.575  11.938   9.180
   46   2HE2  GLN   6          2HE2      GLN   6 -13.881  12.836   9.886
   47    H    LEU   7           H        LEU   7 -11.836   8.741   6.399
   48    HA   LEU   7           HA       LEU   7 -13.415   7.470   4.396
   49   1HB   LEU   7          2HB       LEU   7 -10.805   8.968   4.143
   50   2HB   LEU   7          1HB       LEU   7 -11.878   8.562   2.817
   51    HG   LEU   7           HG       LEU   7 -12.594  10.391   5.109
   52   1HD1  LEU   7          1HD1      LEU   7 -10.869  11.389   3.736
   53   2HD1  LEU   7          2HD1      LEU   7 -12.415  12.185   3.438
   54   3HD1  LEU   7          3HD1      LEU   7 -11.783  11.022   2.273
   55   1HD2  LEU   7          1HD2      LEU   7 -14.528   9.274   4.160
   56   2HD2  LEU   7          2HD2      LEU   7 -14.029   9.744   2.536
   57   3HD2  LEU   7          3HD2      LEU   7 -14.518  10.976   3.701
   58    H    LEU   8           H        LEU   8 -10.394   6.753   5.935
   59    HA   LEU   8           HA       LEU   8  -9.608   4.781   3.969
   60   1HB   LEU   8          2HB       LEU   8  -8.463   5.432   6.686
   61   2HB   LEU   8          1HB       LEU   8  -7.747   4.321   5.534
   62    HG   LEU   8           HG       LEU   8  -8.127   7.286   5.095
   63   1HD1  LEU   8          1HD1      LEU   8  -6.431   6.844   6.764
   64   2HD1  LEU   8          2HD1      LEU   8  -5.682   7.377   5.260
   65   3HD1  LEU   8          3HD1      LEU   8  -5.658   5.670   5.699
   66   1HD2  LEU   8          1HD2      LEU   8  -6.774   6.947   3.094
   67   2HD2  LEU   8          2HD2      LEU   8  -8.256   5.995   3.021
   68   3HD2  LEU   8          3HD2      LEU   8  -6.726   5.212   3.410
   69    H    GLU   9           H        GLU   9 -11.107   4.896   7.117
   70    HA   GLU   9           HA       GLU   9 -12.151   3.381   8.426
   71   1HB   GLU   9          2HB       GLU   9 -13.200   2.880   6.093
   72   2HB   GLU   9          1HB       GLU   9 -12.206   1.432   6.140
   73   1HG   GLU   9          2HG       GLU   9 -13.302   0.743   8.215
   74   2HG   GLU   9          1HG       GLU   9 -14.293   2.200   8.173
   75    H    VAL  10           H        VAL  10 -11.984   0.582   8.545
   76    HA   VAL  10           HA       VAL  10  -9.203   0.294   9.394
   77    HB   VAL  10           HB       VAL  10 -11.563  -1.494  10.009
   78   1HG1  VAL  10          1HG1      VAL  10 -10.132  -2.427  11.749
   79   2HG1  VAL  10          2HG1      VAL  10  -8.808  -1.383  11.231
   80   3HG1  VAL  10          3HG1      VAL  10  -9.412  -2.641  10.153
   81   1HG2  VAL  10          1HG2      VAL  10 -10.276   0.653  11.693
   82   2HG2  VAL  10          2HG2      VAL  10 -11.535  -0.460  12.230
   83   3HG2  VAL  10          3HG2      VAL  10 -11.883   0.722  10.967
   84    H    LEU  11           H        LEU  11  -7.936  -0.457   7.816
   85    HA   LEU  11           HA       LEU  11  -8.934  -2.639   6.123
   86   1HB   LEU  11          2HB       LEU  11  -6.473  -0.917   5.841
   87   2HB   LEU  11          1HB       LEU  11  -6.958  -2.175   4.720
   88    HG   LEU  11           HG       LEU  11  -8.509   0.356   5.298
   89   1HD1  LEU  11          1HD1      LEU  11  -6.908  -0.484   2.888
   90   2HD1  LEU  11          2HD1      LEU  11  -6.479   0.782   4.040
   91   3HD1  LEU  11          3HD1      LEU  11  -7.899   0.969   3.012
   92   1HD2  LEU  11          1HD2      LEU  11  -9.978  -1.521   4.758
   93   2HD2  LEU  11          2HD2      LEU  11  -9.036  -1.847   3.303
   94   3HD2  LEU  11          3HD2      LEU  11  -9.943  -0.340   3.448
   95    H    ALA  12           H        ALA  12  -8.488  -4.623   6.782
   96    HA   ALA  12           HA       ALA  12  -6.015  -5.038   8.337
   97   1HB   ALA  12          1HB       ALA  12  -8.656  -6.456   8.676
   98   2HB   ALA  12          2HB       ALA  12  -7.985  -5.234   9.754
   99   3HB   ALA  12          3HB       ALA  12  -7.181  -6.793   9.583
  100    H    CYS  13           H        CYS  13  -4.897  -6.954   8.039
  101    HA   CYS  13           HA       CYS  13  -4.874  -8.068   5.447
  102   1HB   CYS  13          2HB       CYS  13  -2.851  -8.055   6.734
  103   2HB   CYS  13          1HB       CYS  13  -3.612  -8.930   8.054
  104    HG   CYS  13           HG       CYS  13  -2.623 -10.155   5.021
  105    HA   PRO  14           HA       PRO  14  -8.327 -10.840   5.906
  106   1HB   PRO  14          2HB       PRO  14  -7.188 -12.258   3.589
  107   2HB   PRO  14          1HB       PRO  14  -8.753 -11.455   3.757
  108   1HG   PRO  14          2HG       PRO  14  -6.774 -10.425   2.250
  109   2HG   PRO  14          1HG       PRO  14  -7.911  -9.397   3.142
  110   1HD   PRO  14          2HD       PRO  14  -5.086 -10.119   3.798
  111   2HD   PRO  14          1HD       PRO  14  -5.938  -8.577   4.016
  112    H    LYS  15           H        LYS  15  -5.031 -11.757   5.987
  113    HA   LYS  15           HA       LYS  15  -5.530 -14.572   6.362
  114   1HB   LYS  15          2HB       LYS  15  -3.541 -13.992   5.186
  115   2HB   LYS  15          1HB       LYS  15  -3.039 -12.883   6.449
  116   1HG   LYS  15          2HG       LYS  15  -1.718 -14.928   6.457
  117   2HG   LYS  15          1HG       LYS  15  -2.630 -14.737   7.955
  118   1HD   LYS  15          2HD       LYS  15  -4.284 -16.332   7.180
  119   2HD   LYS  15          1HD       LYS  15  -3.443 -16.480   5.633
  120   1HE   LYS  15          2HE       LYS  15  -1.534 -17.463   6.687
  121   2HE   LYS  15          1HE       LYS  15  -2.179 -17.117   8.292
  122   1HZ   LYS  15          1HZ       LYS  15  -3.901 -18.706   7.971
  123   2HZ   LYS  15          2HZ       LYS  15  -2.438 -19.456   7.572
  124   3HZ   LYS  15          3HZ       LYS  15  -3.486 -18.937   6.343
  125    H    ASP  16           H        ASP  16  -4.667 -11.811   8.435
  126    HA   ASP  16           HA       ASP  16  -5.063 -13.605  10.735
  127   1HB   ASP  16          2HB       ASP  16  -2.625 -13.174  10.240
  128   2HB   ASP  16          1HB       ASP  16  -2.917 -11.487  10.659
  129    H    LYS  17           H        LYS  17  -6.103 -10.884   9.225
  130    HA   LYS  17           HA       LYS  17  -7.461  -9.166   9.785
  131   1HB   LYS  17          2HB       LYS  17  -7.648 -10.666  12.397
  132   2HB   LYS  17          1HB       LYS  17  -8.577  -9.214  12.045
  133   1HG   LYS  17          2HG       LYS  17  -8.682 -11.727  10.394
  134   2HG   LYS  17          1HG       LYS  17  -9.819 -11.332  11.684
  135   1HD   LYS  17          2HD       LYS  17 -10.497  -9.321  10.495
  136   2HD   LYS  17          1HD       LYS  17  -9.315  -9.652   9.229
  137   1HE   LYS  17          2HE       LYS  17 -10.480 -11.615   8.550
  138   2HE   LYS  17          1HE       LYS  17 -11.549 -11.536   9.949
  139   1HZ   LYS  17          1HZ       LYS  17 -11.451  -9.524   7.762
  140   2HZ   LYS  17          2HZ       LYS  17 -12.518  -9.523   9.080
  141   3HZ   LYS  17          3HZ       LYS  17 -12.614 -10.751   7.912
  142    H    GLY  18           H        GLY  18  -4.488  -9.309  10.499
  143   1HA   GLY  18          2HA       GLY  18  -4.195  -7.345  12.576
  144   2HA   GLY  18          1HA       GLY  18  -2.925  -7.936  11.512
  145    HA   PRO  19           HA       PRO  19  -5.092  -3.750  10.190
  146   1HB   PRO  19          2HB       PRO  19  -3.508  -1.964  11.574
  147   2HB   PRO  19          1HB       PRO  19  -5.124  -2.470  12.073
  148   1HG   PRO  19          2HG       PRO  19  -2.458  -3.442  13.005
  149   2HG   PRO  19          1HG       PRO  19  -3.930  -3.133  13.943
  150   1HD   PRO  19          2HD       PRO  19  -3.179  -5.621  13.269
  151   2HD   PRO  19          1HD       PRO  19  -4.891  -5.152  13.335
  152    H    LEU  20           H        LEU  20  -4.303  -2.959   8.354
  153    HA   LEU  20           HA       LEU  20  -1.620  -3.662   7.565
  154   1HB   LEU  20          2HB       LEU  20  -3.784  -2.137   6.112
  155   2HB   LEU  20          1HB       LEU  20  -2.277  -2.678   5.396
  156    HG   LEU  20           HG       LEU  20  -4.385  -4.511   6.535
  157   1HD1  LEU  20          1HD1      LEU  20  -3.760  -3.809   3.673
  158   2HD1  LEU  20          2HD1      LEU  20  -5.221  -3.369   4.560
  159   3HD1  LEU  20          3HD1      LEU  20  -4.880  -5.064   4.205
  160   1HD2  LEU  20          1HD2      LEU  20  -1.899  -5.068   4.929
  161   2HD2  LEU  20          2HD2      LEU  20  -3.117  -6.260   5.384
  162   3HD2  LEU  20          3HD2      LEU  20  -2.157  -5.461   6.629
  163    H    ARG  21           H        ARG  21   0.111  -2.393   7.640
  164    HA   ARG  21           HA       ARG  21  -0.164   0.296   8.684
  165   1HB   ARG  21          2HB       ARG  21   1.595  -1.368   9.443
  166   2HB   ARG  21          1HB       ARG  21   2.377  -1.138   7.886
  167   1HG   ARG  21          2HG       ARG  21   2.777   1.179   8.372
  168   2HG   ARG  21          1HG       ARG  21   1.842   1.064   9.864
  169   1HD   ARG  21          2HD       ARG  21   3.480  -0.597  10.704
  170   2HD   ARG  21          1HD       ARG  21   4.446  -0.335   9.251
  171    HE   ARG  21           HE       ARG  21   4.184   2.163  10.213
  172   1HH1  ARG  21          1HH1      ARG  21   5.242  -0.847  11.710
  173   2HH1  ARG  21          2HH1      ARG  21   6.185  -0.042  12.924
  174   1HH2  ARG  21          1HH2      ARG  21   5.443   3.198  11.831
  175   2HH2  ARG  21          2HH2      ARG  21   6.285   2.239  13.012
  176    H    TYR  22           H        TYR  22  -0.110   2.093   7.511
  177    HA   TYR  22           HA       TYR  22  -0.012   1.850   4.624
  178   1HB   TYR  22          2HB       TYR  22  -1.783   3.129   5.894
  179   2HB   TYR  22          1HB       TYR  22  -0.546   4.306   6.311
  180    HD1  TYR  22           1HD      TYR  22  -3.026   3.378   3.949
  181    HD2  TYR  22           2HD      TYR  22   0.663   5.467   4.317
  182    HE1  TYR  22           1HE      TYR  22  -3.524   4.616   1.886
  183    HE2  TYR  22           2HE      TYR  22   0.171   6.707   2.253
  184    HH   TYR  22           HH       TYR  22  -2.805   6.939   0.923
  185    H    LEU  23           H        LEU  23   1.842   2.069   3.568
  186    HA   LEU  23           HA       LEU  23   3.863   3.951   4.603
  187   1HB   LEU  23          2HB       LEU  23   4.080   1.475   2.922
  188   2HB   LEU  23          1HB       LEU  23   5.336   2.694   2.866
  189    HG   LEU  23           HG       LEU  23   5.605   2.408   5.354
  190   1HD1  LEU  23          1HD1      LEU  23   3.438   1.415   5.849
  191   2HD1  LEU  23          2HD1      LEU  23   4.750   0.357   6.365
  192   3HD1  LEU  23          3HD1      LEU  23   3.856  -0.002   4.889
  193   1HD2  LEU  23          1HD2      LEU  23   6.890   0.339   5.142
  194   2HD2  LEU  23          2HD2      LEU  23   7.137   1.400   3.755
  195   3HD2  LEU  23          3HD2      LEU  23   6.081  -0.004   3.614
  196    H    GLU  24           H        GLU  24   3.903   5.851   3.622
  197    HA   GLU  24           HA       GLU  24   2.507   6.349   1.185
  198   1HB   GLU  24          2HB       GLU  24   4.392   8.095   2.776
  199   2HB   GLU  24          1HB       GLU  24   3.453   8.651   1.401
  200   1HG   GLU  24          2HG       GLU  24   2.222   9.354   3.227
  201   2HG   GLU  24          1HG       GLU  24   1.408   7.880   2.720
  202    H    SER  25           H        SER  25   5.664   5.259   1.823
  203    HA   SER  25           HA       SER  25   7.290   6.455  -0.015
  204   1HB   SER  25          2HB       SER  25   7.234   3.501   0.637
  205   2HB   SER  25          1HB       SER  25   8.605   4.395  -0.021
  206    HG   SER  25           HG       SER  25   9.073   5.042   1.909
  207    H    GLU  26           H        GLU  26   5.365   3.516  -0.652
  208    HA   GLU  26           HA       GLU  26   5.175   4.371  -3.456
  209   1HB   GLU  26          2HB       GLU  26   5.774   1.573  -2.472
  210   2HB   GLU  26          1HB       GLU  26   5.359   1.970  -4.134
  211   1HG   GLU  26          2HG       GLU  26   7.350   3.429  -4.242
  212   2HG   GLU  26          1HG       GLU  26   7.777   2.914  -2.611
  213    H    GLN  27           H        GLN  27   3.448   4.435  -1.014
  214    HA   GLN  27           HA       GLN  27   1.342   4.020  -0.305
  215   1HB   GLN  27          2HB       GLN  27   1.065   3.996  -3.279
  216   2HB   GLN  27          1HB       GLN  27  -0.307   3.490  -2.305
  217   1HG   GLN  27          2HG       GLN  27  -0.559   5.801  -2.806
  218   2HG   GLN  27          1HG       GLN  27  -0.185   5.649  -1.096
  219   1HE2  GLN  27          1HE2      GLN  27   2.214   5.348  -3.611
  220   2HE2  GLN  27          2HE2      GLN  27   3.047   6.824  -3.270
  221    H    LEU  28           H        LEU  28   2.206   2.143   0.737
  222    HA   LEU  28           HA       LEU  28   1.239  -0.378  -0.440
  223   1HB   LEU  28          2HB       LEU  28   3.660   0.017   1.326
  224   2HB   LEU  28          1HB       LEU  28   3.094  -1.516   0.694
  225    HG   LEU  28           HG       LEU  28   4.140   0.772  -0.975
  226   1HD1  LEU  28          1HD1      LEU  28   5.873  -0.296   0.401
  227   2HD1  LEU  28          2HD1      LEU  28   6.091  -0.635  -1.316
  228   3HD1  LEU  28          3HD1      LEU  28   5.411  -1.869  -0.253
  229   1HD2  LEU  28          1HD2      LEU  28   4.084  -0.820  -2.813
  230   2HD2  LEU  28          2HD2      LEU  28   2.469  -0.614  -2.131
  231   3HD2  LEU  28          3HD2      LEU  28   3.414  -2.055  -1.746
  232    H    LEU  29           H        LEU  29   0.245  -1.829   0.925
  233    HA   LEU  29           HA       LEU  29  -0.258  -0.894   3.676
  234   1HB   LEU  29          2HB       LEU  29  -1.890  -2.752   1.929
  235   2HB   LEU  29          1HB       LEU  29  -2.251  -2.390   3.605
  236    HG   LEU  29           HG       LEU  29  -2.250  -0.381   1.353
  237   1HD1  LEU  29          1HD1      LEU  29  -4.535  -1.661   2.845
  238   2HD1  LEU  29          2HD1      LEU  29  -4.075  -1.990   1.174
  239   3HD1  LEU  29          3HD1      LEU  29  -4.669  -0.393   1.627
  240   1HD2  LEU  29          1HD2      LEU  29  -3.072  -0.120   4.242
  241   2HD2  LEU  29          2HD2      LEU  29  -3.260   1.116   2.997
  242   3HD2  LEU  29          3HD2      LEU  29  -1.647   0.605   3.498
  243    H    VAL  30           H        VAL  30   1.047  -1.910   5.056
  244    HA   VAL  30           HA       VAL  30   1.988  -4.602   4.325
  245    HB   VAL  30           HB       VAL  30   3.323  -2.556   6.106
  246   1HG1  VAL  30          1HG1      VAL  30   5.271  -4.050   5.994
  247   2HG1  VAL  30          2HG1      VAL  30   4.301  -5.227   5.109
  248   3HG1  VAL  30          3HG1      VAL  30   3.885  -4.816   6.772
  249   1HG2  VAL  30          1HG2      VAL  30   4.016  -3.417   3.298
  250   2HG2  VAL  30          2HG2      VAL  30   4.935  -2.289   4.293
  251   3HG2  VAL  30          3HG2      VAL  30   3.309  -1.869   3.759
  252    H    ASN  31           H        ASN  31   1.295  -6.248   5.524
  253    HA   ASN  31           HA       ASN  31   0.212  -5.787   8.180
  254   1HB   ASN  31          2HB       ASN  31  -0.915  -7.466   6.827
  255   2HB   ASN  31          1HB       ASN  31   0.600  -8.331   6.576
  256   1HD2  ASN  31          1HD2      ASN  31  -0.306 -10.213   7.436
  257   2HD2  ASN  31          2HD2      ASN  31  -0.541 -10.414   9.136
  258    H    GLU  32           H        GLU  32   1.512  -5.644   9.857
  259    HA   GLU  32           HA       GLU  32   4.307  -6.263   9.486
  260   1HB   GLU  32          2HB       GLU  32   3.408  -4.117  10.462
  261   2HB   GLU  32          1HB       GLU  32   2.981  -5.035  11.899
  262   1HG   GLU  32          2HG       GLU  32   5.233  -5.451  12.429
  263   2HG   GLU  32          1HG       GLU  32   5.779  -4.963  10.825
  264    H    ARG  33           H        ARG  33   1.638  -7.859  10.751
  265    HA   ARG  33           HA       ARG  33   2.939  -9.293  12.851
  266   1HB   ARG  33          2HB       ARG  33   0.420  -9.916  11.304
  267   2HB   ARG  33          1HB       ARG  33   0.966 -10.804  12.720
  268   1HG   ARG  33          2HG       ARG  33   0.775  -8.767  14.066
  269   2HG   ARG  33          1HG       ARG  33   0.200  -7.891  12.644
  270   1HD   ARG  33          2HD       ARG  33  -1.720  -9.392  12.487
  271   2HD   ARG  33          1HD       ARG  33  -1.135 -10.297  13.882
  272    HE   ARG  33           HE       ARG  33  -1.470  -7.556  14.529
  273   1HH1  ARG  33          1HH1      ARG  33  -3.256 -10.522  13.976
  274   2HH1  ARG  33          2HH1      ARG  33  -4.594 -10.048  14.993
  275   1HH2  ARG  33          1HH2      ARG  33  -3.230  -6.927  15.873
  276   2HH2  ARG  33          2HH2      ARG  33  -4.570  -8.013  16.071
  277    H    LEU  34           H        LEU  34   2.474  -9.783   9.414
  278    HA   LEU  34           HA       LEU  34   3.968 -12.316   9.614
  279   1HB   LEU  34          2HB       LEU  34   2.019 -11.438   7.484
  280   2HB   LEU  34          1HB       LEU  34   2.907 -12.949   7.488
  281    HG   LEU  34           HG       LEU  34   0.825 -12.136   9.518
  282   1HD1  LEU  34          1HD1      LEU  34   0.719 -14.192   7.320
  283   2HD1  LEU  34          2HD1      LEU  34  -0.103 -12.632   7.308
  284   3HD1  LEU  34          3HD1      LEU  34  -0.550 -13.856   8.498
  285   1HD2  LEU  34          1HD2      LEU  34   2.590 -13.565  10.460
  286   2HD2  LEU  34          2HD2      LEU  34   2.296 -14.750   9.184
  287   3HD2  LEU  34          3HD2      LEU  34   1.037 -14.398  10.370
  288    H    ASN  35           H        ASN  35   4.398  -9.193   8.889
  289    HA   ASN  35           HA       ASN  35   5.887  -7.969   7.691
  290   1HB   ASN  35          2HB       ASN  35   7.413  -9.682   8.801
  291   2HB   ASN  35          1HB       ASN  35   7.406 -10.544   7.265
  292   1HD2  ASN  35          1HD2      ASN  35   9.565 -10.255   6.877
  293   2HD2  ASN  35          2HD2      ASN  35  10.242  -8.720   6.464
  294    H    LEU  36           H        LEU  36   3.691  -8.694   6.277
  295    HA   LEU  36           HA       LEU  36   4.726  -9.349   3.592
  296   1HB   LEU  36          2HB       LEU  36   1.961  -9.859   4.708
  297   2HB   LEU  36          1HB       LEU  36   2.460 -10.173   3.058
  298    HG   LEU  36           HG       LEU  36   3.572 -11.551   5.504
  299   1HD1  LEU  36          1HD1      LEU  36   2.363 -13.507   4.669
  300   2HD1  LEU  36          2HD1      LEU  36   1.680 -12.534   3.366
  301   3HD1  LEU  36          3HD1      LEU  36   1.258 -12.184   5.043
  302   1HD2  LEU  36          1HD2      LEU  36   5.214 -11.372   3.709
  303   2HD2  LEU  36          2HD2      LEU  36   4.048 -12.034   2.563
  304   3HD2  LEU  36          3HD2      LEU  36   4.653 -13.035   3.883
  305    H    ALA  37           H        ALA  37   3.968  -8.085   1.863
  306    HA   ALA  37           HA       ALA  37   2.640  -5.594   2.719
  307   1HB   ALA  37          1HB       ALA  37   5.028  -5.244   2.262
  308   2HB   ALA  37          2HB       ALA  37   4.010  -4.386   1.105
  309   3HB   ALA  37          3HB       ALA  37   4.802  -5.892   0.636
  310    H    TYR  38           H        TYR  38   0.878  -5.082   1.717
  311    HA   TYR  38           HA       TYR  38   0.150  -6.442  -0.781
  312   1HB   TYR  38          2HB       TYR  38  -1.563  -4.907   1.196
  313   2HB   TYR  38          1HB       TYR  38  -2.158  -5.714  -0.251
  314    HD1  TYR  38           1HD      TYR  38  -2.375  -8.124  -0.325
  315    HD2  TYR  38           2HD      TYR  38  -0.847  -6.195   3.141
  316    HE1  TYR  38           1HE      TYR  38  -2.667 -10.203   0.951
  317    HE2  TYR  38           2HE      TYR  38  -1.136  -8.269   4.431
  318    HH   TYR  38           HH       TYR  38  -1.761 -11.264   2.963
  319    H    ARG  39           H        ARG  39  -0.247  -5.252  -2.615
  320    HA   ARG  39           HA       ARG  39   0.864  -2.554  -2.464
  321   1HB   ARG  39          2HB       ARG  39   0.549  -4.470  -4.774
  322   2HB   ARG  39          1HB       ARG  39   1.166  -2.833  -4.942
  323   1HG   ARG  39          2HG       ARG  39   3.002  -3.404  -3.394
  324   2HG   ARG  39          1HG       ARG  39   2.402  -5.063  -3.345
  325   1HD   ARG  39          2HD       ARG  39   4.263  -4.778  -4.935
  326   2HD   ARG  39          1HD       ARG  39   2.776  -5.305  -5.722
  327    HE   ARG  39           HE       ARG  39   2.545  -2.723  -6.122
  328   1HH1  ARG  39          1HH1      ARG  39   5.475  -4.640  -6.272
  329   2HH1  ARG  39          2HH1      ARG  39   6.226  -3.629  -7.476
  330   1HH2  ARG  39          1HH2      ARG  39   3.519  -1.412  -7.731
  331   2HH2  ARG  39          2HH2      ARG  39   5.102  -1.817  -8.325
  332    H    ILE  40           H        ILE  40  -0.172  -0.780  -3.101
  333    HA   ILE  40           HA       ILE  40  -2.895  -1.072  -4.161
  334    HB   ILE  40           HB       ILE  40  -1.524   1.400  -3.058
  335   1HG1  ILE  40          2HG1      ILE  40  -3.643  -0.354  -1.795
  336   2HG1  ILE  40          1HG1      ILE  40  -1.944  -0.323  -1.333
  337   1HG2  ILE  40          1HG2      ILE  40  -3.242   1.924  -4.705
  338   2HG2  ILE  40          2HG2      ILE  40  -3.756   2.398  -3.087
  339   3HG2  ILE  40          3HG2      ILE  40  -4.404   0.932  -3.823
  340   1HD1  ILE  40          1HD1      ILE  40  -2.169   1.983  -0.613
  341   2HD1  ILE  40          2HD1      ILE  40  -3.346   0.953   0.203
  342   3HD1  ILE  40          3HD1      ILE  40  -3.856   1.994  -1.128
  343    H    ASP  41           H        ASP  41  -2.958  -1.047  -6.324
  344    HA   ASP  41           HA       ASP  41  -0.830   0.340  -7.777
  345   1HB   ASP  41          2HB       ASP  41  -1.364  -2.048  -8.333
  346   2HB   ASP  41          1HB       ASP  41  -2.944  -1.512  -8.888
  347    H    ASP  42           H        ASP  42  -1.313   2.396  -7.860
  348    HA   ASP  42           HA       ASP  42  -2.406   4.357  -8.202
  349   1HB   ASP  42          2HB       ASP  42  -1.865   3.384 -10.511
  350   2HB   ASP  42          1HB       ASP  42  -3.583   3.008 -10.622
  351    H    GLY  43           H        GLY  43  -3.802   3.234  -6.277
  352   1HA   GLY  43          2HA       GLY  43  -5.835   4.079  -5.363
  353   2HA   GLY  43          1HA       GLY  43  -6.520   4.092  -6.977
  354    H    ILE  44           H        ILE  44  -5.234   1.223  -7.151
  355    HA   ILE  44           HA       ILE  44  -7.577  -0.078  -5.928
  356    HB   ILE  44           HB       ILE  44  -5.855  -1.056  -8.215
  357   1HG1  ILE  44          2HG1      ILE  44  -8.688   0.019  -8.183
  358   2HG1  ILE  44          1HG1      ILE  44  -7.277   0.862  -8.818
  359   1HG2  ILE  44          1HG2      ILE  44  -8.356  -2.227  -6.997
  360   2HG2  ILE  44          2HG2      ILE  44  -6.731  -2.908  -6.911
  361   3HG2  ILE  44          3HG2      ILE  44  -7.565  -2.810  -8.462
  362   1HD1  ILE  44          1HD1      ILE  44  -7.017  -0.884 -10.517
  363   2HD1  ILE  44          2HD1      ILE  44  -8.589  -0.091 -10.611
  364   3HD1  ILE  44          3HD1      ILE  44  -8.454  -1.697  -9.892
  365    HA   PRO  45           HA       PRO  45  -4.389  -1.889  -3.315
  366   1HB   PRO  45          2HB       PRO  45  -5.972  -2.405  -1.219
  367   2HB   PRO  45          1HB       PRO  45  -5.439  -0.761  -1.590
  368   1HG   PRO  45          2HG       PRO  45  -8.077  -2.059  -2.087
  369   2HG   PRO  45          1HG       PRO  45  -7.717  -0.391  -1.611
  370   1HD   PRO  45          2HD       PRO  45  -8.299  -1.252  -4.197
  371   2HD   PRO  45          1HD       PRO  45  -7.521   0.283  -3.772
  372    H    VAL  46           H        VAL  46  -3.736  -3.903  -3.771
  373    HA   VAL  46           HA       VAL  46  -5.713  -6.032  -4.126
  374    HB   VAL  46           HB       VAL  46  -2.719  -6.126  -4.565
  375   1HG1  VAL  46          1HG1      VAL  46  -3.217  -8.139  -5.867
  376   2HG1  VAL  46          2HG1      VAL  46  -4.917  -8.004  -5.418
  377   3HG1  VAL  46          3HG1      VAL  46  -3.700  -8.314  -4.179
  378   1HG2  VAL  46          1HG2      VAL  46  -3.764  -4.499  -6.059
  379   2HG2  VAL  46          2HG2      VAL  46  -4.935  -5.716  -6.575
  380   3HG2  VAL  46          3HG2      VAL  46  -3.224  -5.924  -6.949
  381    H    LEU  47           H        LEU  47  -6.243  -7.221  -2.405
  382    HA   LEU  47           HA       LEU  47  -4.317  -7.356  -0.182
  383   1HB   LEU  47          2HB       LEU  47  -7.326  -7.537  -0.083
  384   2HB   LEU  47          1HB       LEU  47  -6.253  -7.626   1.300
  385    HG   LEU  47           HG       LEU  47  -6.663  -5.213  -0.470
  386   1HD1  LEU  47          1HD1      LEU  47  -7.682  -4.222   1.508
  387   2HD1  LEU  47          2HD1      LEU  47  -7.464  -5.735   2.388
  388   3HD1  LEU  47          3HD1      LEU  47  -8.554  -5.670   1.003
  389   1HD2  LEU  47          1HD2      LEU  47  -4.373  -5.316   0.331
  390   2HD2  LEU  47          2HD2      LEU  47  -4.944  -5.576   1.979
  391   3HD2  LEU  47          3HD2      LEU  47  -5.261  -4.043   1.168
  392    H    LEU  48           H        LEU  48  -4.369  -9.127  -2.412
  393    HA   LEU  48           HA       LEU  48  -5.537 -11.601  -1.421
  394   1HB   LEU  48          2HB       LEU  48  -4.023 -10.960  -3.948
  395   2HB   LEU  48          1HB       LEU  48  -4.618 -12.560  -3.541
  396    HG   LEU  48           HG       LEU  48  -6.343 -10.113  -3.958
  397   1HD1  LEU  48          1HD1      LEU  48  -5.335 -10.916  -6.035
  398   2HD1  LEU  48          2HD1      LEU  48  -7.070 -11.228  -5.999
  399   3HD1  LEU  48          3HD1      LEU  48  -5.932 -12.540  -5.696
  400   1HD2  LEU  48          1HD2      LEU  48  -8.215 -11.673  -3.827
  401   2HD2  LEU  48          2HD2      LEU  48  -7.285 -11.686  -2.328
  402   3HD2  LEU  48          3HD2      LEU  48  -7.100 -12.997  -3.493
  403    H    ILE  49           H        ILE  49  -4.448 -13.235  -0.523
  404    HA   ILE  49           HA       ILE  49  -1.943 -12.847   0.635
  405    HB   ILE  49           HB       ILE  49  -3.449 -15.413   0.111
  406   1HG1  ILE  49          2HG1      ILE  49  -3.694 -15.284   2.656
  407   2HG1  ILE  49          1HG1      ILE  49  -3.137 -13.622   2.520
  408   1HG2  ILE  49          1HG2      ILE  49  -1.089 -15.945   0.263
  409   2HG2  ILE  49          2HG2      ILE  49  -1.939 -16.502   1.704
  410   3HG2  ILE  49          3HG2      ILE  49  -0.959 -15.038   1.770
  411   1HD1  ILE  49          1HD1      ILE  49  -5.577 -13.808   2.665
  412   2HD1  ILE  49          2HD1      ILE  49  -5.586 -14.746   1.172
  413   3HD1  ILE  49          3HD1      ILE  49  -5.056 -13.064   1.154
  414    H    ASP  50           H        ASP  50  -2.820 -14.703  -2.267
  415    HA   ASP  50           HA       ASP  50  -0.240 -15.621  -2.893
  416   1HB   ASP  50          2HB       ASP  50  -2.730 -15.211  -4.535
  417   2HB   ASP  50          1HB       ASP  50  -1.237 -15.782  -5.268
  418    H    GLU  51           H        GLU  51  -1.777 -12.561  -3.433
  419    HA   GLU  51           HA       GLU  51   0.247 -11.738  -5.369
  420   1HB   GLU  51          2HB       GLU  51  -2.330 -10.491  -4.438
  421   2HB   GLU  51          1HB       GLU  51  -1.173  -9.620  -5.433
  422   1HG   GLU  51          2HG       GLU  51  -2.491 -12.217  -6.190
  423   2HG   GLU  51          1HG       GLU  51  -2.999 -10.618  -6.733
  424    H    ALA  52           H        ALA  52   0.128 -11.916  -2.155
  425    HA   ALA  52           HA       ALA  52   1.218  -9.287  -1.562
  426   1HB   ALA  52          1HB       ALA  52   0.833 -11.669   0.250
  427   2HB   ALA  52          2HB       ALA  52  -0.316 -10.347   0.038
  428   3HB   ALA  52          3HB       ALA  52   1.268 -10.035   0.750
  429    H    THR  53           H        THR  53   3.335  -8.894  -1.000
  430    HA   THR  53           HA       THR  53   5.218 -11.119  -1.484
  431    HB   THR  53           HB       THR  53   5.920  -8.203  -1.803
  432    HG1  THR  53           1HG      THR  53   4.274  -9.703  -3.373
  433   1HG2  THR  53          1HG2      THR  53   7.666  -9.088  -3.270
  434   2HG2  THR  53          2HG2      THR  53   7.066 -10.725  -3.008
  435   3HG2  THR  53          3HG2      THR  53   7.766  -9.818  -1.667
  436    H    GLU  54           H        GLU  54   7.049 -11.238  -0.081
  437    HA   GLU  54           HA       GLU  54   6.550 -10.300   2.576
  438   1HB   GLU  54          2HB       GLU  54   9.042 -11.627   1.488
  439   2HB   GLU  54          1HB       GLU  54   8.598 -11.465   3.184
  440   1HG   GLU  54          2HG       GLU  54   6.501 -12.782   2.578
  441   2HG   GLU  54          1HG       GLU  54   7.333 -13.180   1.077
  442    H    TRP  55           H        TRP  55   7.475  -8.608   3.646
  443    HA   TRP  55           HA       TRP  55   8.706  -6.669   1.830
  444   1HB   TRP  55          2HB       TRP  55   6.533  -6.106   2.900
  445   2HB   TRP  55          1HB       TRP  55   7.318  -6.189   4.472
  446    HD1  TRP  55           HD       TRP  55   7.837  -3.855   5.359
  447    HE1  TRP  55           1HE      TRP  55   8.511  -1.592   4.336
  448    HE3  TRP  55           3HE      TRP  55   7.967  -5.185   0.422
  449    HZ2  TRP  55           2HZ      TRP  55   9.051  -0.516   1.794
  450    HZ3  TRP  55           3HZ      TRP  55   8.578  -3.475  -1.239
  451    HH2  TRP  55           HH       TRP  55   9.107  -1.192  -0.564
  452    H    THR  56           H        THR  56  10.559  -5.577   2.319
  453    HA   THR  56           HA       THR  56  12.061  -6.517   4.652
  454    HB   THR  56           HB       THR  56  13.984  -5.353   3.344
  455    HG1  THR  56           1HG      THR  56  13.439  -4.592   1.458
  456   1HG2  THR  56          1HG2      THR  56  14.393  -7.403   2.045
  457   2HG2  THR  56          2HG2      THR  56  12.730  -7.909   2.336
  458   3HG2  THR  56          3HG2      THR  56  13.854  -7.764   3.686
  459    HA   PRO  57           HA       PRO  57  11.212  -2.658   6.709
  460   1HB   PRO  57          2HB       PRO  57  13.645  -2.779   8.149
  461   2HB   PRO  57          1HB       PRO  57  12.054  -3.303   8.697
  462   1HG   PRO  57          2HG       PRO  57  14.290  -4.899   7.580
  463   2HG   PRO  57          1HG       PRO  57  13.043  -5.366   8.750
  464   1HD   PRO  57          2HD       PRO  57  12.986  -6.226   6.205
  465   2HD   PRO  57          1HD       PRO  57  11.497  -5.851   7.097
  466    H    ASN  58           H        ASN  58  11.925  -0.537   6.641
  467    HA   ASN  58           HA       ASN  58  13.195   0.162   4.259
  468   1HB   ASN  58          2HB       ASN  58  13.087   2.494   5.093
  469   2HB   ASN  58          1HB       ASN  58  11.562   1.635   5.242
  470   1HD2  ASN  58          1HD2      ASN  58  14.103   3.238   6.885
  471   2HD2  ASN  58          2HD2      ASN  58  13.454   3.115   8.479
  472    H    ASN  59           H        ASN  59  15.182   0.331   3.684
  473    HA   ASN  59           HA       ASN  59  17.436   0.275   3.675
  474   1HB   ASN  59          2HB       ASN  59  17.105   2.626   4.291
  475   2HB   ASN  59          1HB       ASN  59  17.136   2.187   5.993
  476   1HD2  ASN  59          1HD2      ASN  59  19.210   0.770   3.530
  477   2HD2  ASN  59          2HD2      ASN  59  20.691   1.418   4.149
  478    H    LEU  60           H        LEU  60  17.893  -1.806   4.165
  479    HA   LEU  60           HA       LEU  60  18.319  -2.608   6.918
  480   1HB   LEU  60          2HB       LEU  60  18.878  -4.027   4.309
  481   2HB   LEU  60          1HB       LEU  60  19.130  -4.729   5.895
  482    HG   LEU  60           HG       LEU  60  16.459  -3.840   4.805
  483   1HD1  LEU  60          1HD1      LEU  60  17.316  -5.789   3.624
  484   2HD1  LEU  60          2HD1      LEU  60  15.975  -6.237   4.677
  485   3HD1  LEU  60          3HD1      LEU  60  17.631  -6.593   5.159
  486   1HD2  LEU  60          1HD2      LEU  60  17.193  -5.332   7.323
  487   2HD2  LEU  60          2HD2      LEU  60  15.555  -4.997   6.762
  488   3HD2  LEU  60          3HD2      LEU  60  16.611  -3.669   7.240
  489    H    GLU  61           H        GLU  61  20.307  -2.822   7.916
  490    HA   GLU  61           HA       GLU  61  22.499  -1.398   6.672
  491   1HB   GLU  61          2HB       GLU  61  23.652  -1.633   8.794
  492   2HB   GLU  61          1HB       GLU  61  22.004  -1.101   9.089
  493   1HG   GLU  61          2HG       GLU  61  22.651  -4.008   9.212
  494   2HG   GLU  61          1HG       GLU  61  23.089  -2.957  10.556
  Start of MODEL   18
    1   1H    MET   1          1HT       MET   1 -11.399  18.150  12.135
    2   2H    MET   1          2HT       MET   1 -10.877  18.487  10.557
    3   3H    MET   1          3HT       MET   1  -9.754  18.023  11.744
    4    HA   MET   1           HA       MET   1 -10.822  15.852  11.907
    5   1HB   MET   1          2HB       MET   1 -12.389  16.861   9.521
    6   2HB   MET   1          1HB       MET   1 -12.402  15.208  10.114
    7   1HG   MET   1          2HG       MET   1 -13.393  15.942  12.204
    8   2HG   MET   1          1HG       MET   1 -13.340  17.616  11.656
    9   1HE   MET   1          1HE       MET   1 -15.882  17.559   8.660
   10   2HE   MET   1          2HE       MET   1 -14.128  17.363   8.611
   11   3HE   MET   1          3HE       MET   1 -14.853  18.579   9.664
   12    H    SER   2           H        SER   2  -9.020  14.791  11.351
   13    HA   SER   2           HA       SER   2  -7.503  15.715   9.072
   14   1HB   SER   2          2HB       SER   2  -6.876  13.619  11.160
   15   2HB   SER   2          1HB       SER   2  -5.760  14.160   9.908
   16    HG   SER   2           HG       SER   2  -6.269  15.276  12.283
   17    H    LEU   3           H        LEU   3  -7.544  14.881   7.150
   18    HA   LEU   3           HA       LEU   3  -7.684  13.455   5.403
   19   1HB   LEU   3          2HB       LEU   3  -7.263  11.447   7.598
   20   2HB   LEU   3          1HB       LEU   3  -7.493  10.952   5.934
   21    HG   LEU   3           HG       LEU   3  -5.491  12.380   5.339
   22   1HD1  LEU   3          1HD1      LEU   3  -3.925  12.935   7.114
   23   2HD1  LEU   3          2HD1      LEU   3  -5.084  12.380   8.323
   24   3HD1  LEU   3          3HD1      LEU   3  -5.453  13.790   7.330
   25   1HD2  LEU   3          1HD2      LEU   3  -5.053  10.087   7.239
   26   2HD2  LEU   3          2HD2      LEU   3  -3.890  10.700   6.064
   27   3HD2  LEU   3          3HD2      LEU   3  -5.388   9.951   5.513
   28    H    ASP   4           H        ASP   4  -8.935  11.246   4.765
   29    HA   ASP   4           HA       ASP   4 -11.685  11.530   5.757
   30   1HB   ASP   4          2HB       ASP   4 -11.408  12.478   3.454
   31   2HB   ASP   4          1HB       ASP   4 -10.947  10.869   2.899
   32    HA   PRO   5           HA       PRO   5 -10.347   7.244   6.617
   33   1HB   PRO   5          2HB       PRO   5 -12.538   7.428   8.572
   34   2HB   PRO   5          1HB       PRO   5 -10.841   7.008   8.821
   35   1HG   PRO   5          2HG       PRO   5 -11.835   9.355   9.653
   36   2HG   PRO   5          1HG       PRO   5 -10.184   9.216   9.017
   37   1HD   PRO   5          2HD       PRO   5 -12.659  10.219   7.663
   38   2HD   PRO   5          1HD       PRO   5 -11.008  10.875   7.621
   39    H    GLN   6           H        GLN   6 -13.047   8.501   5.130
   40    HA   GLN   6           HA       GLN   6 -14.495   5.952   5.108
   41   1HB   GLN   6          2HB       GLN   6 -15.458   8.480   5.201
   42   2HB   GLN   6          1HB       GLN   6 -15.460   8.223   3.464
   43   1HG   GLN   6          2HG       GLN   6 -16.827   6.453   5.480
   44   2HG   GLN   6          1HG       GLN   6 -17.616   7.705   4.524
   45   1HE2  GLN   6          1HE2      GLN   6 -16.262   4.522   4.531
   46   2HE2  GLN   6          2HE2      GLN   6 -16.809   4.064   2.956
   47    H    LEU   7           H        LEU   7 -12.701   8.150   3.014
   48    HA   LEU   7           HA       LEU   7 -12.932   6.500   0.689
   49   1HB   LEU   7          2HB       LEU   7 -10.944   8.651   1.418
   50   2HB   LEU   7          1HB       LEU   7 -11.013   7.868  -0.150
   51    HG   LEU   7           HG       LEU   7 -13.208   9.540   1.074
   52   1HD1  LEU   7          1HD1      LEU   7 -11.265  10.857   0.397
   53   2HD1  LEU   7          2HD1      LEU   7 -12.643  11.155  -0.660
   54   3HD1  LEU   7          3HD1      LEU   7 -11.323  10.121  -1.204
   55   1HD2  LEU   7          1HD2      LEU   7 -14.281   9.342  -1.110
   56   2HD2  LEU   7          2HD2      LEU   7 -14.075   7.759  -0.359
   57   3HD2  LEU   7          3HD2      LEU   7 -12.992   8.271  -1.654
   58    H    LEU   8           H        LEU   8 -10.950   6.508   3.503
   59    HA   LEU   8           HA       LEU   8  -9.045   4.621   2.336
   60   1HB   LEU   8          2HB       LEU   8  -9.122   5.860   5.095
   61   2HB   LEU   8          1HB       LEU   8  -7.831   4.858   4.459
   62    HG   LEU   8           HG       LEU   8  -8.624   7.565   3.372
   63   1HD1  LEU   8          1HD1      LEU   8  -6.226   6.737   5.002
   64   2HD1  LEU   8          2HD1      LEU   8  -7.583   7.705   5.579
   65   3HD1  LEU   8          3HD1      LEU   8  -6.521   8.339   4.322
   66   1HD2  LEU   8          1HD2      LEU   8  -7.728   6.105   1.643
   67   2HD2  LEU   8          2HD2      LEU   8  -6.338   5.725   2.659
   68   3HD2  LEU   8          3HD2      LEU   8  -6.564   7.365   2.051
   69    H    GLU   9           H        GLU   9 -11.355   4.840   5.002
   70    HA   GLU   9           HA       GLU   9 -12.432   3.322   6.263
   71   1HB   GLU   9          2HB       GLU   9 -11.946   1.548   3.871
   72   2HB   GLU   9          1HB       GLU   9 -12.995   1.133   5.220
   73   1HG   GLU   9          2HG       GLU   9 -14.297   3.212   4.717
   74   2HG   GLU   9          1HG       GLU   9 -13.337   3.368   3.248
   75    H    VAL  10           H        VAL  10 -12.108   0.593   6.636
   76    HA   VAL  10           HA       VAL  10  -9.494   0.551   7.946
   77    HB   VAL  10           HB       VAL  10 -11.850  -1.293   8.366
   78   1HG1  VAL  10          1HG1      VAL  10 -10.675  -1.984  10.396
   79   2HG1  VAL  10          2HG1      VAL  10  -9.329  -0.922   9.983
   80   3HG1  VAL  10          3HG1      VAL  10  -9.705  -2.306   8.957
   81   1HG2  VAL  10          1HG2      VAL  10 -10.940   1.064  10.014
   82   2HG2  VAL  10          2HG2      VAL  10 -12.238  -0.054  10.437
   83   3HG2  VAL  10          3HG2      VAL  10 -12.398   0.990   9.023
   84    H    LEU  11           H        LEU  11  -7.967  -0.303   6.693
   85    HA   LEU  11           HA       LEU  11  -8.640  -2.429   4.816
   86   1HB   LEU  11          2HB       LEU  11  -6.098  -0.846   5.210
   87   2HB   LEU  11          1HB       LEU  11  -6.328  -2.072   3.976
   88    HG   LEU  11           HG       LEU  11  -7.891   0.505   4.193
   89   1HD1  LEU  11          1HD1      LEU  11  -5.572   0.873   3.514
   90   2HD1  LEU  11          2HD1      LEU  11  -6.693   1.175   2.186
   91   3HD1  LEU  11          3HD1      LEU  11  -5.758  -0.321   2.228
   92   1HD2  LEU  11          1HD2      LEU  11  -9.221  -1.301   3.237
   93   2HD2  LEU  11          2HD2      LEU  11  -7.935  -1.649   2.079
   94   3HD2  LEU  11          3HD2      LEU  11  -8.798  -0.112   2.006
   95    H    ALA  12           H        ALA  12  -8.259  -4.488   5.224
   96    HA   ALA  12           HA       ALA  12  -6.344  -5.184   7.346
   97   1HB   ALA  12          1HB       ALA  12  -8.620  -5.363   8.208
   98   2HB   ALA  12          2HB       ALA  12  -7.847  -6.946   8.103
   99   3HB   ALA  12          3HB       ALA  12  -9.037  -6.461   6.891
  100    H    CYS  13           H        CYS  13  -5.435  -7.289   7.188
  101    HA   CYS  13           HA       CYS  13  -4.891  -8.099   4.471
  102   1HB   CYS  13          2HB       CYS  13  -3.061  -8.027   6.059
  103   2HB   CYS  13          1HB       CYS  13  -3.916  -9.103   7.157
  104    HG   CYS  13           HG       CYS  13  -2.934 -10.117   4.035
  105    HA   PRO  14           HA       PRO  14  -8.170 -11.138   4.478
  106   1HB   PRO  14          2HB       PRO  14  -7.516 -12.363   2.141
  107   2HB   PRO  14          1HB       PRO  14  -8.317 -10.789   2.215
  108   1HG   PRO  14          2HG       PRO  14  -5.416 -11.421   1.804
  109   2HG   PRO  14          1HG       PRO  14  -6.433 -10.237   0.961
  110   1HD   PRO  14          2HD       PRO  14  -4.730  -9.531   2.932
  111   2HD   PRO  14          1HD       PRO  14  -6.276  -8.697   2.668
  112    H    LYS  15           H        LYS  15  -5.091 -11.702   5.325
  113    HA   LYS  15           HA       LYS  15  -5.061 -14.583   5.046
  114   1HB   LYS  15          2HB       LYS  15  -3.044 -12.874   5.114
  115   2HB   LYS  15          1HB       LYS  15  -3.194 -13.099   6.851
  116   1HG   LYS  15          2HG       LYS  15  -1.560 -14.624   6.122
  117   2HG   LYS  15          1HG       LYS  15  -3.014 -15.575   6.430
  118   1HD   LYS  15          2HD       LYS  15  -3.536 -15.578   4.046
  119   2HD   LYS  15          1HD       LYS  15  -2.111 -14.588   3.722
  120   1HE   LYS  15          2HE       LYS  15  -1.576 -16.858   3.200
  121   2HE   LYS  15          1HE       LYS  15  -0.713 -16.419   4.671
  122   1HZ   LYS  15          1HZ       LYS  15  -2.530 -17.505   5.933
  123   2HZ   LYS  15          2HZ       LYS  15  -1.640 -18.570   4.959
  124   3HZ   LYS  15          3HZ       LYS  15  -3.179 -18.056   4.464
  125    H    ASP  16           H        ASP  16  -5.513 -12.173   7.612
  126    HA   ASP  16           HA       ASP  16  -6.990 -14.123   9.179
  127   1HB   ASP  16          2HB       ASP  16  -4.611 -14.433   9.869
  128   2HB   ASP  16          1HB       ASP  16  -4.568 -12.745  10.366
  129    H    LYS  17           H        LYS  17  -7.055 -11.279   7.851
  130    HA   LYS  17           HA       LYS  17  -8.254  -9.381   8.135
  131   1HB   LYS  17          2HB       LYS  17  -9.949 -11.041   8.986
  132   2HB   LYS  17          1HB       LYS  17  -9.402 -10.674  10.614
  133   1HG   LYS  17          2HG       LYS  17 -10.166  -8.413  10.431
  134   2HG   LYS  17          1HG       LYS  17 -10.520  -8.622   8.713
  135   1HD   LYS  17          2HD       LYS  17 -12.248 -10.237   9.232
  136   2HD   LYS  17          1HD       LYS  17 -11.854 -10.147  10.949
  137   1HE   LYS  17          2HE       LYS  17 -12.596  -7.869  11.059
  138   2HE   LYS  17          1HE       LYS  17 -12.811  -7.806   9.308
  139   1HZ   LYS  17          1HZ       LYS  17 -14.306  -9.702  11.032
  140   2HZ   LYS  17          2HZ       LYS  17 -14.637  -9.268   9.424
  141   3HZ   LYS  17          3HZ       LYS  17 -14.890  -8.153  10.674
  142    H    GLY  18           H        GLY  18  -5.632  -9.688   9.262
  143   1HA   GLY  18          2HA       GLY  18  -5.627  -8.056  11.665
  144   2HA   GLY  18          1HA       GLY  18  -4.213  -8.683  10.824
  145    HA   PRO  19           HA       PRO  19  -5.591  -4.139   9.732
  146   1HB   PRO  19          2HB       PRO  19  -3.839  -2.757  11.330
  147   2HB   PRO  19          1HB       PRO  19  -5.512  -3.114  11.769
  148   1HG   PRO  19          2HG       PRO  19  -3.001  -4.531  12.564
  149   2HG   PRO  19          1HG       PRO  19  -4.415  -4.118  13.550
  150   1HD   PRO  19          2HD       PRO  19  -4.034  -6.599  12.603
  151   2HD   PRO  19          1HD       PRO  19  -5.657  -5.894  12.738
  152    H    LEU  20           H        LEU  20  -4.555  -3.042   8.155
  153    HA   LEU  20           HA       LEU  20  -1.808  -3.845   7.525
  154   1HB   LEU  20          2HB       LEU  20  -3.919  -2.455   5.871
  155   2HB   LEU  20          1HB       LEU  20  -2.286  -2.770   5.316
  156    HG   LEU  20           HG       LEU  20  -4.286  -4.895   6.093
  157   1HD1  LEU  20          1HD1      LEU  20  -4.451  -5.360   3.726
  158   2HD1  LEU  20          2HD1      LEU  20  -3.321  -4.054   3.366
  159   3HD1  LEU  20          3HD1      LEU  20  -4.907  -3.686   4.046
  160   1HD2  LEU  20          1HD2      LEU  20  -1.962  -5.559   6.466
  161   2HD2  LEU  20          2HD2      LEU  20  -1.567  -5.110   4.806
  162   3HD2  LEU  20          3HD2      LEU  20  -2.678  -6.443   5.118
  163    H    ARG  21           H        ARG  21  -0.156  -2.475   7.686
  164    HA   ARG  21           HA       ARG  21  -0.709   0.236   8.625
  165   1HB   ARG  21          2HB       ARG  21   0.836  -1.263   9.902
  166   2HB   ARG  21          1HB       ARG  21   1.914  -1.275   8.515
  167   1HG   ARG  21          2HG       ARG  21   2.390   1.040   8.767
  168   2HG   ARG  21          1HG       ARG  21   1.120   1.230   9.977
  169   1HD   ARG  21          2HD       ARG  21   2.340  -0.232  11.507
  170   2HD   ARG  21          1HD       ARG  21   3.587  -0.484  10.287
  171    HE   ARG  21           HE       ARG  21   3.786   2.097  10.501
  172   1HH1  ARG  21          1HH1      ARG  21   3.202  -0.164  13.129
  173   2HH1  ARG  21          2HH1      ARG  21   4.043   0.813  14.304
  174   1HH2  ARG  21          1HH2      ARG  21   4.867   3.370  12.042
  175   2HH2  ARG  21          2HH2      ARG  21   4.962   2.842  13.694
  176    H    TYR  22           H        TYR  22  -0.567   1.901   7.275
  177    HA   TYR  22           HA       TYR  22   0.224   1.380   4.541
  178   1HB   TYR  22          2HB       TYR  22  -1.868   2.596   5.072
  179   2HB   TYR  22          1HB       TYR  22  -0.915   3.886   5.793
  180    HD1  TYR  22           1HD      TYR  22   0.007   5.606   4.454
  181    HD2  TYR  22           2HD      TYR  22  -1.661   2.155   2.609
  182    HE1  TYR  22           1HE      TYR  22   0.135   6.720   2.264
  183    HE2  TYR  22           2HE      TYR  22  -1.533   3.254   0.418
  184    HH   TYR  22           HH       TYR  22  -1.432   5.488  -0.519
  185    H    LEU  23           H        LEU  23   2.095   1.907   3.664
  186    HA   LEU  23           HA       LEU  23   3.855   3.746   5.136
  187   1HB   LEU  23          2HB       LEU  23   4.388   1.421   3.326
  188   2HB   LEU  23          1HB       LEU  23   5.587   2.692   3.462
  189    HG   LEU  23           HG       LEU  23   6.170   0.884   4.935
  190   1HD1  LEU  23          1HD1      LEU  23   6.672   3.127   5.715
  191   2HD1  LEU  23          2HD1      LEU  23   6.292   2.063   7.068
  192   3HD1  LEU  23          3HD1      LEU  23   5.093   3.221   6.499
  193   1HD2  LEU  23          1HD2      LEU  23   4.005  -0.150   5.241
  194   2HD2  LEU  23          2HD2      LEU  23   3.444   1.240   6.168
  195   3HD2  LEU  23          3HD2      LEU  23   4.727   0.214   6.809
  196    H    GLU  24           H        GLU  24   3.738   5.745   4.389
  197    HA   GLU  24           HA       GLU  24   3.033   6.522   1.771
  198   1HB   GLU  24          2HB       GLU  24   4.305   7.872   4.110
  199   2HB   GLU  24          1HB       GLU  24   4.368   8.676   2.549
  200   1HG   GLU  24          2HG       GLU  24   1.775   7.682   3.665
  201   2HG   GLU  24          1HG       GLU  24   2.446   9.239   4.156
  202    H    SER  25           H        SER  25   5.850   5.126   2.947
  203    HA   SER  25           HA       SER  25   7.853   6.343   1.423
  204   1HB   SER  25          2HB       SER  25   7.830   3.431   2.198
  205   2HB   SER  25          1HB       SER  25   9.209   4.528   2.092
  206    HG   SER  25           HG       SER  25   8.797   5.257   4.035
  207    H    GLU  26           H        GLU  26   5.820   3.492   0.725
  208    HA   GLU  26           HA       GLU  26   6.704   3.647  -2.074
  209   1HB   GLU  26          2HB       GLU  26   6.746   1.278  -0.245
  210   2HB   GLU  26          1HB       GLU  26   6.501   1.041  -1.969
  211   1HG   GLU  26          2HG       GLU  26   8.826   2.562  -0.836
  212   2HG   GLU  26          1HG       GLU  26   8.862   0.826  -1.146
  213    H    GLN  27           H        GLN  27   4.089   4.026  -0.247
  214    HA   GLN  27           HA       GLN  27   1.838   3.889  -0.579
  215   1HB   GLN  27          2HB       GLN  27   2.950   3.690  -3.318
  216   2HB   GLN  27          1HB       GLN  27   1.297   3.130  -3.122
  217   1HG   GLN  27          2HG       GLN  27   1.613   5.532  -3.814
  218   2HG   GLN  27          1HG       GLN  27   0.543   5.238  -2.446
  219   1HE2  GLN  27          1HE2      GLN  27   1.106   5.955  -0.442
  220   2HE2  GLN  27          2HE2      GLN  27   2.416   7.054  -0.167
  221    H    LEU  28           H        LEU  28   3.037   1.682   0.555
  222    HA   LEU  28           HA       LEU  28   1.564  -0.567  -0.643
  223   1HB   LEU  28          2HB       LEU  28   4.127  -0.656   0.953
  224   2HB   LEU  28          1HB       LEU  28   3.250  -2.057   0.373
  225    HG   LEU  28           HG       LEU  28   4.558   0.031  -1.372
  226   1HD1  LEU  28          1HD1      LEU  28   5.356  -2.807  -0.738
  227   2HD1  LEU  28          2HD1      LEU  28   6.186  -1.343  -0.207
  228   3HD1  LEU  28          3HD1      LEU  28   6.137  -1.756  -1.921
  229   1HD2  LEU  28          1HD2      LEU  28   4.053  -1.512  -3.204
  230   2HD2  LEU  28          2HD2      LEU  28   2.584  -0.931  -2.419
  231   3HD2  LEU  28          3HD2      LEU  28   3.181  -2.556  -2.082
  232    H    LEU  29           H        LEU  29   0.735  -2.147   0.829
  233    HA   LEU  29           HA       LEU  29   0.101  -1.042   3.489
  234   1HB   LEU  29          2HB       LEU  29  -1.362  -3.079   1.801
  235   2HB   LEU  29          1HB       LEU  29  -1.822  -2.632   3.432
  236    HG   LEU  29           HG       LEU  29  -1.726  -0.676   1.138
  237   1HD1  LEU  29          1HD1      LEU  29  -4.096  -2.142   2.290
  238   2HD1  LEU  29          2HD1      LEU  29  -3.379  -2.432   0.705
  239   3HD1  LEU  29          3HD1      LEU  29  -4.148  -0.885   1.056
  240   1HD2  LEU  29          1HD2      LEU  29  -3.094   0.697   2.634
  241   2HD2  LEU  29          2HD2      LEU  29  -1.525   0.326   3.351
  242   3HD2  LEU  29          3HD2      LEU  29  -2.967  -0.538   3.883
  243    H    VAL  30           H        VAL  30   1.351  -1.924   5.030
  244    HA   VAL  30           HA       VAL  30   2.297  -4.685   4.608
  245    HB   VAL  30           HB       VAL  30   3.576  -2.519   6.292
  246   1HG1  VAL  30          1HG1      VAL  30   4.576  -5.255   5.521
  247   2HG1  VAL  30          2HG1      VAL  30   4.034  -4.761   7.124
  248   3HG1  VAL  30          3HG1      VAL  30   5.480  -4.039   6.421
  249   1HG2  VAL  30          1HG2      VAL  30   4.399  -3.588   3.589
  250   2HG2  VAL  30          2HG2      VAL  30   5.301  -2.422   4.559
  251   3HG2  VAL  30          3HG2      VAL  30   3.719  -1.991   3.907
  252    H    ASN  31           H        ASN  31   1.437  -6.162   5.888
  253    HA   ASN  31           HA       ASN  31  -0.109  -5.453   8.195
  254   1HB   ASN  31          2HB       ASN  31  -0.681  -7.417   6.816
  255   2HB   ASN  31          1HB       ASN  31   0.840  -8.176   7.274
  256   1HD2  ASN  31          1HD2      ASN  31  -2.323  -7.214   8.351
  257   2HD2  ASN  31          2HD2      ASN  31  -2.327  -8.160   9.797
  258    H    GLU  32           H        GLU  32   0.614  -5.093  10.168
  259    HA   GLU  32           HA       GLU  32   3.397  -4.991  10.636
  260   1HB   GLU  32          2HB       GLU  32   1.568  -3.483  11.575
  261   2HB   GLU  32          1HB       GLU  32   1.248  -4.763  12.734
  262   1HG   GLU  32          2HG       GLU  32   3.538  -4.584  13.570
  263   2HG   GLU  32          1HG       GLU  32   3.856  -3.294  12.410
  264    H    ARG  33           H        ARG  33   1.105  -7.490  11.145
  265    HA   ARG  33           HA       ARG  33   2.645  -8.771  13.252
  266   1HB   ARG  33          2HB       ARG  33   0.105  -9.570  11.826
  267   2HB   ARG  33          1HB       ARG  33   0.878 -10.557  13.057
  268   1HG   ARG  33          2HG       ARG  33   0.548  -8.785  14.700
  269   2HG   ARG  33          1HG       ARG  33  -0.195  -7.769  13.461
  270   1HD   ARG  33          2HD       ARG  33  -2.003  -9.339  13.193
  271   2HD   ARG  33          1HD       ARG  33  -1.232 -10.474  14.298
  272    HE   ARG  33           HE       ARG  33  -1.580  -8.123  15.722
  273   1HH1  ARG  33          1HH1      ARG  33  -3.646 -10.400  14.041
  274   2HH1  ARG  33          2HH1      ARG  33  -4.976 -10.210  15.144
  275   1HH2  ARG  33          1HH2      ARG  33  -3.343  -7.857  17.177
  276   2HH2  ARG  33          2HH2      ARG  33  -4.810  -8.761  16.921
  277    H    LEU  34           H        LEU  34   1.637  -9.508   9.920
  278    HA   LEU  34           HA       LEU  34   3.249 -11.911   9.887
  279   1HB   LEU  34          2HB       LEU  34   1.622 -10.615   7.706
  280   2HB   LEU  34          1HB       LEU  34   2.339 -12.213   7.632
  281    HG   LEU  34           HG       LEU  34   0.180 -11.369   9.571
  282   1HD1  LEU  34          1HD1      LEU  34   0.040 -13.059   7.080
  283   2HD1  LEU  34          2HD1      LEU  34  -0.657 -11.453   7.296
  284   3HD1  LEU  34          3HD1      LEU  34  -1.275 -12.816   8.230
  285   1HD2  LEU  34          1HD2      LEU  34   1.613 -13.109  10.481
  286   2HD2  LEU  34          2HD2      LEU  34   1.413 -14.064   9.011
  287   3HD2  LEU  34          3HD2      LEU  34   0.029 -13.768  10.065
  288    H    ASN  35           H        ASN  35   3.656  -8.625   8.996
  289    HA   ASN  35           HA       ASN  35   5.335  -7.464   8.005
  290   1HB   ASN  35          2HB       ASN  35   6.743  -9.037   9.445
  291   2HB   ASN  35          1HB       ASN  35   6.962 -10.017   8.004
  292   1HD2  ASN  35          1HD2      ASN  35   8.397  -9.383   6.468
  293   2HD2  ASN  35          2HD2      ASN  35   9.399  -7.976   6.601
  294    H    LEU  36           H        LEU  36   3.305  -8.579   6.468
  295    HA   LEU  36           HA       LEU  36   4.681  -9.138   3.924
  296   1HB   LEU  36          2HB       LEU  36   1.921  -9.987   4.817
  297   2HB   LEU  36          1HB       LEU  36   2.571 -10.238   3.209
  298    HG   LEU  36           HG       LEU  36   3.652 -11.461   5.752
  299   1HD1  LEU  36          1HD1      LEU  36   1.512 -12.417   5.075
  300   2HD1  LEU  36          2HD1      LEU  36   2.831 -13.563   4.832
  301   3HD1  LEU  36          3HD1      LEU  36   2.144 -12.701   3.454
  302   1HD2  LEU  36          1HD2      LEU  36   5.422 -11.041   4.142
  303   2HD2  LEU  36          2HD2      LEU  36   4.484 -11.841   2.878
  304   3HD2  LEU  36          3HD2      LEU  36   5.082 -12.770   4.254
  305    H    ALA  37           H        ALA  37   3.864  -8.077   2.052
  306    HA   ALA  37           HA       ALA  37   2.339  -5.645   2.728
  307   1HB   ALA  37          1HB       ALA  37   4.719  -5.153   2.511
  308   2HB   ALA  37          2HB       ALA  37   3.781  -4.382   1.231
  309   3HB   ALA  37          3HB       ALA  37   4.715  -5.838   0.885
  310    H    TYR  38           H        TYR  38   0.792  -5.020   1.409
  311    HA   TYR  38           HA       TYR  38   0.393  -6.499  -1.101
  312   1HB   TYR  38          2HB       TYR  38  -1.568  -4.953   0.607
  313   2HB   TYR  38          1HB       TYR  38  -1.958  -5.641  -0.965
  314    HD1  TYR  38           1HD      TYR  38  -1.409  -6.331   2.561
  315    HD2  TYR  38           2HD      TYR  38  -2.049  -8.089  -1.262
  316    HE1  TYR  38           1HE      TYR  38  -1.974  -8.464   3.643
  317    HE2  TYR  38           2HE      TYR  38  -2.620 -10.226  -0.188
  318    HH   TYR  38           HH       TYR  38  -2.214 -11.390   1.937
  319    H    ARG  39           H        ARG  39  -0.198  -5.305  -2.983
  320    HA   ARG  39           HA       ARG  39   1.160  -2.708  -2.991
  321   1HB   ARG  39          2HB       ARG  39   0.516  -4.474  -5.360
  322   2HB   ARG  39          1HB       ARG  39   1.608  -3.092  -5.325
  323   1HG   ARG  39          2HG       ARG  39   3.086  -4.293  -3.803
  324   2HG   ARG  39          1HG       ARG  39   1.998  -5.679  -3.835
  325   1HD   ARG  39          2HD       ARG  39   2.357  -5.760  -6.327
  326   2HD   ARG  39          1HD       ARG  39   3.623  -4.552  -6.106
  327    HE   ARG  39           HE       ARG  39   3.682  -7.226  -4.855
  328   1HH1  ARG  39          1HH1      ARG  39   5.290  -4.544  -6.435
  329   2HH1  ARG  39          2HH1      ARG  39   6.862  -5.264  -6.333
  330   1HH2  ARG  39          1HH2      ARG  39   5.751  -8.165  -4.690
  331   2HH2  ARG  39          2HH2      ARG  39   7.135  -7.326  -5.337
  332    H    ILE  40           H        ILE  40   0.191  -0.883  -3.819
  333    HA   ILE  40           HA       ILE  40  -2.675  -1.139  -4.462
  334    HB   ILE  40           HB       ILE  40  -1.213   1.319  -3.463
  335   1HG1  ILE  40          2HG1      ILE  40  -3.088  -0.539  -1.982
  336   2HG1  ILE  40          1HG1      ILE  40  -1.343  -0.482  -1.765
  337   1HG2  ILE  40          1HG2      ILE  40  -3.464   2.236  -3.141
  338   2HG2  ILE  40          2HG2      ILE  40  -4.154   0.776  -3.848
  339   3HG2  ILE  40          3HG2      ILE  40  -3.156   1.845  -4.833
  340   1HD1  ILE  40          1HD1      ILE  40  -2.490   0.710   0.005
  341   2HD1  ILE  40          2HD1      ILE  40  -3.268   1.753  -1.185
  342   3HD1  ILE  40          3HD1      ILE  40  -1.520   1.813  -0.969
  343    H    ASP  41           H        ASP  41  -3.405  -0.404  -6.398
  344    HA   ASP  41           HA       ASP  41  -1.476   1.006  -8.118
  345   1HB   ASP  41          2HB       ASP  41  -1.691  -1.423  -8.702
  346   2HB   ASP  41          1HB       ASP  41  -3.394  -1.143  -9.052
  347    H    ASP  42           H        ASP  42  -2.365   2.987  -7.854
  348    HA   ASP  42           HA       ASP  42  -3.777   4.737  -8.098
  349   1HB   ASP  42          2HB       ASP  42  -3.412   4.218 -10.453
  350   2HB   ASP  42          1HB       ASP  42  -4.763   3.090 -10.435
  351    H    GLY  43           H        GLY  43  -4.739   3.971  -6.025
  352   1HA   GLY  43          2HA       GLY  43  -6.689   4.198  -4.797
  353   2HA   GLY  43          1HA       GLY  43  -7.591   4.241  -6.303
  354    H    ILE  44           H        ILE  44  -6.028   1.567  -6.857
  355    HA   ILE  44           HA       ILE  44  -8.074  -0.081  -5.535
  356    HB   ILE  44           HB       ILE  44  -6.533  -0.663  -8.072
  357   1HG1  ILE  44          2HG1      ILE  44  -9.429   0.137  -7.688
  358   2HG1  ILE  44          1HG1      ILE  44  -8.159   1.194  -8.296
  359   1HG2  ILE  44          1HG2      ILE  44  -8.824  -2.136  -6.779
  360   2HG2  ILE  44          2HG2      ILE  44  -7.150  -2.684  -6.862
  361   3HG2  ILE  44          3HG2      ILE  44  -8.100  -2.523  -8.339
  362   1HD1  ILE  44          1HD1      ILE  44  -9.555   0.313 -10.087
  363   2HD1  ILE  44          2HD1      ILE  44  -9.120  -1.332  -9.621
  364   3HD1  ILE  44          3HD1      ILE  44  -7.886  -0.235 -10.239
  365    HA   PRO  45           HA       PRO  45  -4.492  -1.818  -3.446
  366   1HB   PRO  45          2HB       PRO  45  -6.377  -3.081  -1.658
  367   2HB   PRO  45          1HB       PRO  45  -5.280  -1.740  -1.323
  368   1HG   PRO  45          2HG       PRO  45  -8.006  -1.497  -1.405
  369   2HG   PRO  45          1HG       PRO  45  -6.883  -0.164  -1.733
  370   1HD   PRO  45          2HD       PRO  45  -8.376  -1.908  -3.658
  371   2HD   PRO  45          1HD       PRO  45  -8.074  -0.157  -3.722
  372    H    VAL  46           H        VAL  46  -3.577  -3.535  -4.364
  373    HA   VAL  46           HA       VAL  46  -5.089  -5.788  -5.327
  374    HB   VAL  46           HB       VAL  46  -2.095  -5.412  -5.074
  375   1HG1  VAL  46          1HG1      VAL  46  -3.680  -7.452  -6.630
  376   2HG1  VAL  46          2HG1      VAL  46  -2.663  -7.764  -5.221
  377   3HG1  VAL  46          3HG1      VAL  46  -1.935  -7.220  -6.734
  378   1HG2  VAL  46          1HG2      VAL  46  -3.943  -4.991  -7.420
  379   2HG2  VAL  46          2HG2      VAL  46  -2.181  -4.939  -7.492
  380   3HG2  VAL  46          3HG2      VAL  46  -3.060  -3.744  -6.537
  381    H    LEU  47           H        LEU  47  -6.038  -6.907  -3.701
  382    HA   LEU  47           HA       LEU  47  -4.406  -7.566  -1.346
  383   1HB   LEU  47          2HB       LEU  47  -7.406  -7.530  -1.692
  384   2HB   LEU  47          1HB       LEU  47  -6.578  -8.017  -0.225
  385    HG   LEU  47           HG       LEU  47  -6.498  -5.256  -1.450
  386   1HD1  LEU  47          1HD1      LEU  47  -7.873  -6.275   1.035
  387   2HD1  LEU  47          2HD1      LEU  47  -8.664  -5.791  -0.467
  388   3HD1  LEU  47          3HD1      LEU  47  -7.802  -4.594   0.502
  389   1HD2  LEU  47          1HD2      LEU  47  -4.414  -5.762  -0.329
  390   2HD2  LEU  47          2HD2      LEU  47  -5.286  -6.330   1.096
  391   3HD2  LEU  47          3HD2      LEU  47  -5.355  -4.626   0.641
  392    H    LEU  48           H        LEU  48  -4.068  -9.028  -3.718
  393    HA   LEU  48           HA       LEU  48  -5.478 -11.529  -3.409
  394   1HB   LEU  48          2HB       LEU  48  -3.246 -10.634  -5.220
  395   2HB   LEU  48          1HB       LEU  48  -3.757 -12.306  -5.143
  396    HG   LEU  48           HG       LEU  48  -4.816 -11.341  -7.029
  397   1HD1  LEU  48          1HD1      LEU  48  -6.219 -12.838  -5.745
  398   2HD1  LEU  48          2HD1      LEU  48  -7.191 -11.566  -6.485
  399   3HD1  LEU  48          3HD1      LEU  48  -6.801 -11.492  -4.765
  400   1HD2  LEU  48          1HD2      LEU  48  -5.835  -9.149  -5.222
  401   2HD2  LEU  48          2HD2      LEU  48  -6.196  -9.340  -6.939
  402   3HD2  LEU  48          3HD2      LEU  48  -4.551  -8.986  -6.419
  403    H    ILE  49           H        ILE  49  -4.925 -13.089  -2.088
  404    HA   ILE  49           HA       ILE  49  -2.826 -12.932  -0.259
  405    HB   ILE  49           HB       ILE  49  -4.243 -15.442  -1.167
  406   1HG1  ILE  49          2HG1      ILE  49  -4.993 -13.554   1.076
  407   2HG1  ILE  49          1HG1      ILE  49  -5.786 -13.593  -0.496
  408   1HG2  ILE  49          1HG2      ILE  49  -2.833 -14.783   1.416
  409   2HG2  ILE  49          2HG2      ILE  49  -2.265 -15.899   0.175
  410   3HG2  ILE  49          3HG2      ILE  49  -3.728 -16.268   1.088
  411   1HD1  ILE  49          1HD1      ILE  49  -6.506 -15.882  -0.077
  412   2HD1  ILE  49          2HD1      ILE  49  -7.069 -14.790   1.189
  413   3HD1  ILE  49          3HD1      ILE  49  -5.695 -15.855   1.488
  414    H    ASP  50           H        ASP  50  -3.038 -14.521  -3.386
  415    HA   ASP  50           HA       ASP  50  -0.531 -15.892  -3.118
  416   1HB   ASP  50          2HB       ASP  50  -2.384 -16.803  -4.463
  417   2HB   ASP  50          1HB       ASP  50  -2.259 -15.432  -5.558
  418    H    GLU  51           H        GLU  51  -1.337 -12.718  -3.731
  419    HA   GLU  51           HA       GLU  51   1.099 -12.237  -5.312
  420   1HB   GLU  51          2HB       GLU  51  -1.373 -10.556  -4.894
  421   2HB   GLU  51          1HB       GLU  51   0.085  -9.941  -5.657
  422   1HG   GLU  51          2HG       GLU  51  -1.401 -12.347  -6.670
  423   2HG   GLU  51          1HG       GLU  51  -1.746 -10.702  -7.201
  424    H    ALA  52           H        ALA  52   0.291 -12.449  -2.215
  425    HA   ALA  52           HA       ALA  52   1.149  -9.984  -1.088
  426   1HB   ALA  52          1HB       ALA  52   1.213 -11.180   1.032
  427   2HB   ALA  52          2HB       ALA  52   1.079 -12.722   0.185
  428   3HB   ALA  52          3HB       ALA  52  -0.260 -11.573   0.144
  429    H    THR  53           H        THR  53   3.138  -9.221  -0.735
  430    HA   THR  53           HA       THR  53   5.398 -11.024  -1.312
  431    HB   THR  53           HB       THR  53   5.466  -8.018  -1.507
  432    HG1  THR  53           1HG      THR  53   4.116  -9.727  -3.082
  433   1HG2  THR  53          1HG2      THR  53   7.631  -9.164  -1.425
  434   2HG2  THR  53          2HG2      THR  53   7.356  -8.435  -3.008
  435   3HG2  THR  53          3HG2      THR  53   7.150 -10.174  -2.785
  436    H    GLU  54           H        GLU  54   7.232 -10.905   0.033
  437    HA   GLU  54           HA       GLU  54   6.682  -9.956   2.717
  438   1HB   GLU  54          2HB       GLU  54   8.830 -11.003   3.311
  439   2HB   GLU  54          1HB       GLU  54   7.761 -12.123   2.484
  440   1HG   GLU  54          2HG       GLU  54   9.014 -11.931   0.459
  441   2HG   GLU  54          1HG       GLU  54   9.995 -10.629   1.132
  442    H    TRP  55           H        TRP  55   7.453  -8.132   3.601
  443    HA   TRP  55           HA       TRP  55   9.058  -6.430   1.824
  444   1HB   TRP  55          2HB       TRP  55   6.758  -5.653   2.468
  445   2HB   TRP  55          1HB       TRP  55   7.299  -5.588   4.141
  446    HD1  TRP  55           HD       TRP  55   7.850  -3.211   4.850
  447    HE1  TRP  55           1HE      TRP  55   8.816  -1.108   3.721
  448    HE3  TRP  55           3HE      TRP  55   8.549  -5.064   0.134
  449    HZ2  TRP  55           2HZ      TRP  55   9.754  -0.338   1.169
  450    HZ3  TRP  55           3HZ      TRP  55   9.488  -3.581  -1.589
  451    HH2  TRP  55           HH       TRP  55  10.077  -1.269  -1.081
  452    H    THR  56           H        THR  56  10.732  -5.143   2.730
  453    HA   THR  56           HA       THR  56  12.360  -6.363   4.662
  454    HB   THR  56           HB       THR  56  12.405  -3.439   3.925
  455    HG1  THR  56           1HG      THR  56  13.944  -5.356   2.546
  456   1HG2  THR  56          1HG2      THR  56  14.825  -3.672   4.293
  457   2HG2  THR  56          2HG2      THR  56  14.587  -5.362   4.739
  458   3HG2  THR  56          3HG2      THR  56  13.909  -4.081   5.743
  459    HA   PRO  57           HA       PRO  57  10.242  -5.571   8.490
  460   1HB   PRO  57          2HB       PRO  57  13.065  -5.062   9.349
  461   2HB   PRO  57          1HB       PRO  57  11.803  -6.001  10.153
  462   1HG   PRO  57          2HG       PRO  57  13.727  -7.215   8.757
  463   2HG   PRO  57          1HG       PRO  57  12.058  -7.815   8.732
  464   1HD   PRO  57          2HD       PRO  57  13.588  -6.405   6.626
  465   2HD   PRO  57          1HD       PRO  57  12.217  -7.522   6.474
  466    H    ASN  58           H        ASN  58   9.237  -3.776   9.036
  467    HA   ASN  58           HA       ASN  58   9.796  -1.248   8.071
  468   1HB   ASN  58          2HB       ASN  58   7.605  -2.018   9.024
  469   2HB   ASN  58          1HB       ASN  58   8.299  -1.839  10.632
  470   1HD2  ASN  58          1HD2      ASN  58   8.865   0.291   7.885
  471   2HD2  ASN  58          2HD2      ASN  58   8.129   1.684   8.590
  472    H    ASN  59           H        ASN  59  10.792   0.575   8.891
  473    HA   ASN  59           HA       ASN  59  13.065  -0.013  10.513
  474   1HB   ASN  59          2HB       ASN  59  13.694   2.355  10.108
  475   2HB   ASN  59          1HB       ASN  59  13.379   1.451   8.636
  476   1HD2  ASN  59          1HD2      ASN  59  13.383   4.303   9.090
  477   2HD2  ASN  59          2HD2      ASN  59  11.811   4.876   8.642
  478    H    LEU  60           H        LEU  60  12.056  -0.593  12.454
  479    HA   LEU  60           HA       LEU  60  10.889   1.516  14.059
  480   1HB   LEU  60          2HB       LEU  60  11.703  -1.299  14.808
  481   2HB   LEU  60          1HB       LEU  60  10.816  -0.191  15.837
  482    HG   LEU  60           HG       LEU  60   9.824  -1.350  13.230
  483   1HD1  LEU  60          1HD1      LEU  60   9.912  -3.004  15.017
  484   2HD1  LEU  60          2HD1      LEU  60   8.243  -2.573  14.643
  485   3HD1  LEU  60          3HD1      LEU  60   9.022  -1.917  16.082
  486   1HD2  LEU  60          1HD2      LEU  60   7.698  -0.306  13.793
  487   2HD2  LEU  60          2HD2      LEU  60   8.967   0.911  13.643
  488   3HD2  LEU  60          3HD2      LEU  60   8.415   0.404  15.239
  489    H    GLU  61           H        GLU  61  12.233   3.035  14.782
  490    HA   GLU  61           HA       GLU  61  15.038   2.432  15.111
  491   1HB   GLU  61          2HB       GLU  61  15.226   4.871  15.655
  492   2HB   GLU  61          1HB       GLU  61  14.556   4.513  14.071
  493   1HG   GLU  61          2HG       GLU  61  12.292   4.884  14.994
  494   2HG   GLU  61          1HG       GLU  61  13.033   5.367  16.522
  Start of MODEL   19
    1   1H    MET   1          1HT       MET   1 -12.166  10.214  12.351
    2   2H    MET   1          2HT       MET   1 -13.049  11.615  12.037
    3   3H    MET   1          3HT       MET   1 -13.286  10.779  13.491
    4    HA   MET   1           HA       MET   1 -11.990  12.691  13.950
    5   1HB   MET   1          2HB       MET   1 -11.387  10.641  15.156
    6   2HB   MET   1          1HB       MET   1 -10.272  10.201  13.871
    7   1HG   MET   1          2HG       MET   1  -8.915  12.168  14.377
    8   2HG   MET   1          1HG       MET   1 -10.038  12.614  15.658
    9   1HE   MET   1          1HE       MET   1  -7.827  12.760  17.211
   10   2HE   MET   1          2HE       MET   1  -6.804  12.154  15.910
   11   3HE   MET   1          3HE       MET   1  -6.749  11.391  17.496
   12    H    SER   2           H        SER   2 -11.815  14.037  12.173
   13    HA   SER   2           HA       SER   2 -10.823  15.201  10.508
   14   1HB   SER   2          2HB       SER   2  -8.312  13.910  11.590
   15   2HB   SER   2          1HB       SER   2  -8.363  15.320  10.534
   16    HG   SER   2           HG       SER   2  -9.923  16.017  12.431
   17    H    LEU   3           H        LEU   3  -9.007  14.890   8.627
   18    HA   LEU   3           HA       LEU   3  -8.504  13.910   6.650
   19   1HB   LEU   3          2HB       LEU   3  -8.656  11.469   8.398
   20   2HB   LEU   3          1HB       LEU   3  -8.266  11.358   6.696
   21    HG   LEU   3           HG       LEU   3  -6.328  12.934   7.165
   22   1HD1  LEU   3          1HD1      LEU   3  -5.506  13.053   9.447
   23   2HD1  LEU   3          2HD1      LEU   3  -6.926  12.179  10.021
   24   3HD1  LEU   3          3HD1      LEU   3  -7.104  13.790   9.324
   25   1HD2  LEU   3          1HD2      LEU   3  -6.004  10.569   6.775
   26   2HD2  LEU   3          2HD2      LEU   3  -6.367  10.216   8.464
   27   3HD2  LEU   3          3HD2      LEU   3  -4.915  11.126   8.047
   28    H    ASP   4           H        ASP   4  -9.293  11.759   5.292
   29    HA   ASP   4           HA       ASP   4 -12.233  11.794   5.350
   30   1HB   ASP   4          2HB       ASP   4 -11.251  13.034   3.385
   31   2HB   ASP   4          1HB       ASP   4 -10.564  11.503   2.845
   32    HA   PRO   5           HA       PRO   5 -10.831   7.493   6.117
   33   1HB   PRO   5          2HB       PRO   5 -13.460   7.298   7.418
   34   2HB   PRO   5          1HB       PRO   5 -11.853   6.981   8.077
   35   1HG   PRO   5          2HG       PRO   5 -13.291   9.127   8.818
   36   2HG   PRO   5          1HG       PRO   5 -11.523   9.182   8.686
   37   1HD   PRO   5          2HD       PRO   5 -13.602  10.175   6.770
   38   2HD   PRO   5          1HD       PRO   5 -12.083  10.944   7.278
   39    H    GLN   6           H        GLN   6 -13.261   8.859   4.259
   40    HA   GLN   6           HA       GLN   6 -14.563   6.367   3.544
   41   1HB   GLN   6          2HB       GLN   6 -15.885   8.431   3.678
   42   2HB   GLN   6          1HB       GLN   6 -14.885   9.159   2.431
   43   1HG   GLN   6          2HG       GLN   6 -15.671   7.551   0.809
   44   2HG   GLN   6          1HG       GLN   6 -16.602   6.718   2.053
   45   1HE2  GLN   6          1HE2      GLN   6 -17.481   7.992  -0.439
   46   2HE2  GLN   6          2HE2      GLN   6 -18.659   9.176   0.030
   47    H    LEU   7           H        LEU   7 -12.449   8.793   2.044
   48    HA   LEU   7           HA       LEU   7 -12.092   7.269  -0.366
   49   1HB   LEU   7          2HB       LEU   7 -10.531   9.589   0.769
   50   2HB   LEU   7          1HB       LEU   7 -10.280   8.909  -0.828
   51    HG   LEU   7           HG       LEU   7 -12.822  10.239   0.125
   52   1HD1  LEU   7          1HD1      LEU   7 -10.705  11.201  -1.789
   53   2HD1  LEU   7          2HD1      LEU   7 -10.977  11.811  -0.155
   54   3HD1  LEU   7          3HD1      LEU   7 -12.212  12.032  -1.397
   55   1HD2  LEU   7          1HD2      LEU   7 -13.525  10.087  -2.206
   56   2HD2  LEU   7          2HD2      LEU   7 -13.242   8.486  -1.523
   57   3HD2  LEU   7          3HD2      LEU   7 -12.049   9.208  -2.601
   58    H    LEU   8           H        LEU   8 -10.748   7.197   2.757
   59    HA   LEU   8           HA       LEU   8  -8.343   5.782   1.899
   60   1HB   LEU   8          2HB       LEU   8  -9.266   6.589   4.664
   61   2HB   LEU   8          1HB       LEU   8  -7.738   5.812   4.296
   62    HG   LEU   8           HG       LEU   8  -8.577   8.548   3.336
   63   1HD1  LEU   8          1HD1      LEU   8  -6.866   9.358   4.883
   64   2HD1  LEU   8          2HD1      LEU   8  -6.596   7.708   5.449
   65   3HD1  LEU   8          3HD1      LEU   8  -8.148   8.499   5.732
   66   1HD2  LEU   8          1HD2      LEU   8  -5.957   7.080   3.061
   67   2HD2  LEU   8          2HD2      LEU   8  -6.264   8.745   2.570
   68   3HD2  LEU   8          3HD2      LEU   8  -7.095   7.417   1.758
   69    H    GLU   9           H        GLU   9 -11.464   5.202   3.312
   70    HA   GLU   9           HA       GLU   9 -12.616   3.329   3.853
   71   1HB   GLU   9          2HB       GLU   9 -10.503   2.150   2.056
   72   2HB   GLU   9          1HB       GLU   9 -11.732   1.145   2.812
   73   1HG   GLU   9          2HG       GLU   9 -12.438   3.541   1.153
   74   2HG   GLU   9          1HG       GLU   9 -12.167   1.949   0.443
   75    H    VAL  10           H        VAL  10 -12.196   0.933   4.767
   76    HA   VAL  10           HA       VAL  10 -10.062   1.141   6.782
   77    HB   VAL  10           HB       VAL  10 -12.429  -0.743   6.826
   78   1HG1  VAL  10          1HG1      VAL  10 -10.392  -0.015   8.927
   79   2HG1  VAL  10          2HG1      VAL  10 -10.549  -1.567   8.101
   80   3HG1  VAL  10          3HG1      VAL  10 -11.815  -1.020   9.202
   81   1HG2  VAL  10          1HG2      VAL  10 -13.234   1.537   6.996
   82   2HG2  VAL  10          2HG2      VAL  10 -12.069   1.872   8.276
   83   3HG2  VAL  10          3HG2      VAL  10 -13.378   0.722   8.555
   84    H    LEU  11           H        LEU  11  -8.333   0.363   5.661
   85    HA   LEU  11           HA       LEU  11  -8.634  -1.947   3.947
   86   1HB   LEU  11          2HB       LEU  11  -6.199  -0.297   4.611
   87   2HB   LEU  11          1HB       LEU  11  -6.269  -1.551   3.387
   88    HG   LEU  11           HG       LEU  11  -7.889   0.996   3.345
   89   1HD1  LEU  11          1HD1      LEU  11  -5.506   1.414   3.012
   90   2HD1  LEU  11          2HD1      LEU  11  -6.421   1.675   1.527
   91   3HD1  LEU  11          3HD1      LEU  11  -5.471   0.202   1.732
   92   1HD2  LEU  11          1HD2      LEU  11  -9.012  -0.849   2.218
   93   2HD2  LEU  11          2HD2      LEU  11  -7.551  -1.185   1.289
   94   3HD2  LEU  11          3HD2      LEU  11  -8.422   0.330   1.045
   95    H    ALA  12           H        ALA  12  -8.710  -3.860   4.883
   96    HA   ALA  12           HA       ALA  12  -6.623  -4.527   6.851
   97   1HB   ALA  12          1HB       ALA  12  -9.434  -5.644   6.724
   98   2HB   ALA  12          2HB       ALA  12  -8.816  -4.515   7.929
   99   3HB   ALA  12          3HB       ALA  12  -8.170  -6.153   7.846
  100    H    CYS  13           H        CYS  13  -5.693  -6.605   6.648
  101    HA   CYS  13           HA       CYS  13  -5.385  -7.479   3.972
  102   1HB   CYS  13          2HB       CYS  13  -4.111  -9.400   5.120
  103   2HB   CYS  13          1HB       CYS  13  -3.496  -7.766   5.324
  104    HG   CYS  13           HG       CYS  13  -3.974  -7.500   7.909
  105    HA   PRO  14           HA       PRO  14  -8.884 -10.054   3.539
  106   1HB   PRO  14          2HB       PRO  14  -7.984 -11.682   1.538
  107   2HB   PRO  14          1HB       PRO  14  -8.533 -10.020   1.284
  108   1HG   PRO  14          2HG       PRO  14  -5.744 -11.072   1.561
  109   2HG   PRO  14          1HG       PRO  14  -6.377  -9.869   0.423
  110   1HD   PRO  14          2HD       PRO  14  -5.000  -9.154   2.617
  111   2HD   PRO  14          1HD       PRO  14  -6.350  -8.179   1.997
  112    H    LYS  15           H        LYS  15  -5.745 -11.484   4.128
  113    HA   LYS  15           HA       LYS  15  -6.918 -14.084   4.692
  114   1HB   LYS  15          2HB       LYS  15  -4.869 -14.221   3.507
  115   2HB   LYS  15          1HB       LYS  15  -4.075 -13.090   4.594
  116   1HG   LYS  15          2HG       LYS  15  -4.123 -14.711   6.382
  117   2HG   LYS  15          1HG       LYS  15  -5.027 -15.839   5.371
  118   1HD   LYS  15          2HD       LYS  15  -3.181 -16.179   3.937
  119   2HD   LYS  15          1HD       LYS  15  -2.315 -14.791   4.606
  120   1HE   LYS  15          2HE       LYS  15  -1.472 -17.007   5.382
  121   2HE   LYS  15          1HE       LYS  15  -1.961 -15.915   6.677
  122   1HZ   LYS  15          1HZ       LYS  15  -3.542 -18.200   5.611
  123   2HZ   LYS  15          2HZ       LYS  15  -4.088 -17.114   6.793
  124   3HZ   LYS  15          3HZ       LYS  15  -2.766 -18.123   7.116
  125    H    ASP  16           H        ASP  16  -4.901 -11.726   6.440
  126    HA   ASP  16           HA       ASP  16  -5.258 -13.199   8.902
  127   1HB   ASP  16          2HB       ASP  16  -3.064 -12.347   8.404
  128   2HB   ASP  16          1HB       ASP  16  -3.688 -10.716   8.202
  129    H    LYS  17           H        LYS  17  -6.522 -10.350   7.393
  130    HA   LYS  17           HA       LYS  17  -8.195  -8.913   7.908
  131   1HB   LYS  17          2HB       LYS  17  -9.157 -11.230   8.772
  132   2HB   LYS  17          1HB       LYS  17  -8.977 -10.457  10.339
  133   1HG   LYS  17          2HG       LYS  17 -11.201 -10.091   9.622
  134   2HG   LYS  17          1HG       LYS  17 -10.348  -8.552   9.462
  135   1HD   LYS  17          2HD       LYS  17 -10.076  -8.929   7.069
  136   2HD   LYS  17          1HD       LYS  17 -10.849 -10.509   7.216
  137   1HE   LYS  17          2HE       LYS  17 -12.897  -9.357   8.040
  138   2HE   LYS  17          1HE       LYS  17 -12.119  -7.814   7.684
  139   1HZ   LYS  17          1HZ       LYS  17 -11.991  -8.443   5.357
  140   2HZ   LYS  17          2HZ       LYS  17 -13.595  -8.537   5.895
  141   3HZ   LYS  17          3HZ       LYS  17 -12.683  -9.954   5.695
  142    H    GLY  18           H        GLY  18  -5.483  -8.964   9.301
  143   1HA   GLY  18          2HA       GLY  18  -6.078  -7.505  11.766
  144   2HA   GLY  18          1HA       GLY  18  -4.494  -8.058  11.240
  145    HA   PRO  19           HA       PRO  19  -5.203  -3.438  10.444
  146   1HB   PRO  19          2HB       PRO  19  -3.104  -2.547  11.944
  147   2HB   PRO  19          1HB       PRO  19  -4.736  -2.768  12.587
  148   1HG   PRO  19          2HG       PRO  19  -2.360  -4.577  12.782
  149   2HG   PRO  19          1HG       PRO  19  -3.541  -4.141  14.033
  150   1HD   PRO  19          2HD       PRO  19  -3.657  -6.483  12.701
  151   2HD   PRO  19          1HD       PRO  19  -5.119  -5.630  13.239
  152    H    LEU  20           H        LEU  20  -4.204  -2.392   8.829
  153    HA   LEU  20           HA       LEU  20  -1.623  -3.462   7.899
  154   1HB   LEU  20          2HB       LEU  20  -3.820  -2.067   6.374
  155   2HB   LEU  20          1HB       LEU  20  -2.256  -2.479   5.694
  156    HG   LEU  20           HG       LEU  20  -4.301  -4.453   6.719
  157   1HD1  LEU  20          1HD1      LEU  20  -3.420  -3.781   3.922
  158   2HD1  LEU  20          2HD1      LEU  20  -4.986  -3.404   4.640
  159   3HD1  LEU  20          3HD1      LEU  20  -4.520  -5.085   4.369
  160   1HD2  LEU  20          1HD2      LEU  20  -2.823  -6.158   5.813
  161   2HD2  LEU  20          2HD2      LEU  20  -1.990  -5.212   7.046
  162   3HD2  LEU  20          3HD2      LEU  20  -1.658  -4.921   5.339
  163    H    ARG  21           H        ARG  21   0.077  -2.131   7.650
  164    HA   ARG  21           HA       ARG  21  -0.203   0.643   8.501
  165   1HB   ARG  21          2HB       ARG  21   1.697  -0.769   9.314
  166   2HB   ARG  21          1HB       ARG  21   2.283  -0.870   7.660
  167   1HG   ARG  21          2HG       ARG  21   2.548   1.579   7.629
  168   2HG   ARG  21          1HG       ARG  21   2.026   1.639   9.312
  169   1HD   ARG  21          2HD       ARG  21   4.485   0.274   8.222
  170   2HD   ARG  21          1HD       ARG  21   4.434   1.722   9.226
  171    HE   ARG  21           HE       ARG  21   3.132  -0.289  10.636
  172   1HH1  ARG  21          1HH1      ARG  21   6.366   0.427   9.491
  173   2HH1  ARG  21          2HH1      ARG  21   7.152  -0.557  10.684
  174   1HH2  ARG  21          1HH2      ARG  21   4.150  -1.609  12.188
  175   2HH2  ARG  21          2HH2      ARG  21   5.889  -1.745  12.208
  176    H    TYR  22           H        TYR  22  -0.423   2.260   7.110
  177    HA   TYR  22           HA       TYR  22  -0.315   1.666   4.270
  178   1HB   TYR  22          2HB       TYR  22  -2.189   2.991   5.313
  179   2HB   TYR  22          1HB       TYR  22  -1.032   4.281   5.619
  180    HD1  TYR  22           1HD      TYR  22  -3.201   2.736   3.195
  181    HD2  TYR  22           2HD      TYR  22   0.069   5.418   3.649
  182    HE1  TYR  22           1HE      TYR  22  -3.629   3.633   0.946
  183    HE2  TYR  22           2HE      TYR  22  -0.354   6.324   1.403
  184    HH   TYR  22           HH       TYR  22  -3.169   5.808  -0.293
  185    H    LEU  23           H        LEU  23   1.629   1.712   3.377
  186    HA   LEU  23           HA       LEU  23   3.659   3.589   4.256
  187   1HB   LEU  23          2HB       LEU  23   3.846   1.082   3.325
  188   2HB   LEU  23          1HB       LEU  23   3.972   1.931   1.798
  189    HG   LEU  23           HG       LEU  23   6.157   1.337   2.792
  190   1HD1  LEU  23          1HD1      LEU  23   7.222   3.500   2.472
  191   2HD1  LEU  23          2HD1      LEU  23   5.655   4.300   2.599
  192   3HD1  LEU  23          3HD1      LEU  23   5.985   3.218   1.247
  193   1HD2  LEU  23          1HD2      LEU  23   6.954   2.602   4.737
  194   2HD2  LEU  23          2HD2      LEU  23   5.591   1.556   5.133
  195   3HD2  LEU  23          3HD2      LEU  23   5.344   3.291   4.936
  196    H    GLU  24           H        GLU  24   3.045   5.616   3.708
  197    HA   GLU  24           HA       GLU  24   1.436   6.238   1.470
  198   1HB   GLU  24          2HB       GLU  24   3.163   8.295   2.796
  199   2HB   GLU  24          1HB       GLU  24   1.519   8.449   2.195
  200   1HG   GLU  24          2HG       GLU  24   1.065   8.433   4.406
  201   2HG   GLU  24          1HG       GLU  24   1.069   6.690   4.139
  202    H    SER  25           H        SER  25   4.831   5.908   1.841
  203    HA   SER  25           HA       SER  25   5.623   7.730  -0.184
  204   1HB   SER  25          2HB       SER  25   7.182   5.418   0.975
  205   2HB   SER  25          1HB       SER  25   7.842   6.842   0.167
  206    HG   SER  25           HG       SER  25   6.517   7.964   1.976
  207    H    GLU  26           H        GLU  26   4.730   4.326  -0.231
  208    HA   GLU  26           HA       GLU  26   5.238   4.342  -3.128
  209   1HB   GLU  26          2HB       GLU  26   5.940   2.124  -1.205
  210   2HB   GLU  26          1HB       GLU  26   5.907   1.927  -2.952
  211   1HG   GLU  26          2HG       GLU  26   7.633   3.666  -3.157
  212   2HG   GLU  26          1HG       GLU  26   7.694   3.782  -1.399
  213    H    GLN  27           H        GLN  27   2.879   4.346  -1.035
  214    HA   GLN  27           HA       GLN  27   0.764   3.554  -0.860
  215   1HB   GLN  27          2HB       GLN  27   1.347   3.349  -3.775
  216   2HB   GLN  27          1HB       GLN  27  -0.111   2.575  -3.178
  217   1HG   GLN  27          2HG       GLN  27  -0.642   4.764  -3.975
  218   2HG   GLN  27          1HG       GLN  27  -0.838   4.719  -2.226
  219   1HE2  GLN  27          1HE2      GLN  27  -0.653   6.905  -1.990
  220   2HE2  GLN  27          2HE2      GLN  27   0.838   7.759  -2.207
  221    H    LEU  28           H        LEU  28   2.073   1.893   0.450
  222    HA   LEU  28           HA       LEU  28   1.425  -0.796  -0.564
  223   1HB   LEU  28          2HB       LEU  28   3.783  -0.016   1.156
  224   2HB   LEU  28          1HB       LEU  28   3.370  -1.651   0.683
  225    HG   LEU  28           HG       LEU  28   4.203   0.551  -1.207
  226   1HD1  LEU  28          1HD1      LEU  28   6.257  -0.749  -1.455
  227   2HD1  LEU  28          2HD1      LEU  28   5.701  -1.864  -0.208
  228   3HD1  LEU  28          3HD1      LEU  28   6.040  -0.184   0.201
  229   1HD2  LEU  28          1HD2      LEU  28   3.664  -2.376  -1.685
  230   2HD2  LEU  28          2HD2      LEU  28   4.327  -1.249  -2.866
  231   3HD2  LEU  28          3HD2      LEU  28   2.687  -1.028  -2.260
  232    H    LEU  29           H        LEU  29   0.611  -2.259   0.934
  233    HA   LEU  29           HA       LEU  29  -0.069  -1.137   3.577
  234   1HB   LEU  29          2HB       LEU  29  -1.485  -3.247   1.944
  235   2HB   LEU  29          1HB       LEU  29  -1.925  -2.795   3.580
  236    HG   LEU  29           HG       LEU  29  -1.989  -0.917   1.215
  237   1HD1  LEU  29          1HD1      LEU  29  -4.242  -2.352   2.612
  238   2HD1  LEU  29          2HD1      LEU  29  -3.651  -2.691   0.988
  239   3HD1  LEU  29          3HD1      LEU  29  -4.415  -1.143   1.342
  240   1HD2  LEU  29          1HD2      LEU  29  -3.043  -0.621   4.026
  241   2HD2  LEU  29          2HD2      LEU  29  -3.208   0.556   2.723
  242   3HD2  LEU  29          3HD2      LEU  29  -1.614   0.177   3.374
  243    H    VAL  30           H        VAL  30   1.226  -1.941   5.098
  244    HA   VAL  30           HA       VAL  30   2.366  -4.629   4.676
  245    HB   VAL  30           HB       VAL  30   3.477  -2.424   6.420
  246   1HG1  VAL  30          1HG1      VAL  30   4.133  -4.675   7.091
  247   2HG1  VAL  30          2HG1      VAL  30   5.509  -3.779   6.440
  248   3HG1  VAL  30          3HG1      VAL  30   4.705  -5.004   5.453
  249   1HG2  VAL  30          1HG2      VAL  30   5.159  -2.092   4.673
  250   2HG2  VAL  30          2HG2      VAL  30   3.535  -1.722   4.096
  251   3HG2  VAL  30          3HG2      VAL  30   4.310  -3.240   3.639
  252    H    ASN  31           H        ASN  31   1.964  -6.191   6.137
  253    HA   ASN  31           HA       ASN  31   0.724  -5.386   8.692
  254   1HB   ASN  31          2HB       ASN  31  -0.825  -6.646   7.244
  255   2HB   ASN  31          1HB       ASN  31   0.333  -7.965   7.155
  256   1HD2  ASN  31          1HD2      ASN  31  -1.291  -9.340   8.008
  257   2HD2  ASN  31          2HD2      ASN  31  -1.680  -9.340   9.697
  258    H    GLU  32           H        GLU  32   2.052  -5.614  10.324
  259    HA   GLU  32           HA       GLU  32   4.520  -6.963  10.191
  260   1HB   GLU  32          2HB       GLU  32   3.035  -6.194  12.707
  261   2HB   GLU  32          1HB       GLU  32   4.766  -6.440  12.533
  262   1HG   GLU  32          2HG       GLU  32   4.781  -4.196  12.423
  263   2HG   GLU  32          1HG       GLU  32   4.426  -4.503  10.726
  264    H    ARG  33           H        ARG  33   1.356  -8.031  10.986
  265    HA   ARG  33           HA       ARG  33   2.116 -10.301  12.552
  266   1HB   ARG  33          2HB       ARG  33  -0.461  -9.459  11.239
  267   2HB   ARG  33          1HB       ARG  33  -0.309 -10.946  12.166
  268   1HG   ARG  33          2HG       ARG  33   0.015  -9.811  14.165
  269   2HG   ARG  33          1HG       ARG  33   0.460  -8.308  13.354
  270   1HD   ARG  33          2HD       ARG  33  -1.829  -8.366  14.414
  271   2HD   ARG  33          1HD       ARG  33  -1.771  -7.876  12.722
  272    HE   ARG  33           HE       ARG  33  -2.509 -10.167  12.168
  273   1HH1  ARG  33          1HH1      ARG  33  -3.066  -8.934  15.406
  274   2HH1  ARG  33          2HH1      ARG  33  -4.456  -9.950  15.680
  275   1HH2  ARG  33          1HH2      ARG  33  -4.271 -11.522  12.532
  276   2HH2  ARG  33          2HH2      ARG  33  -5.115 -11.459  14.062
  277    H    LEU  34           H        LEU  34   2.142  -9.681   9.217
  278    HA   LEU  34           HA       LEU  34   2.193 -12.578   8.668
  279   1HB   LEU  34          2HB       LEU  34   1.214 -10.329   6.917
  280   2HB   LEU  34          1HB       LEU  34   1.533 -11.943   6.316
  281    HG   LEU  34           HG       LEU  34  -0.528 -11.201   8.388
  282   1HD1  LEU  34          1HD1      LEU  34  -2.140 -11.822   6.669
  283   2HD1  LEU  34          2HD1      LEU  34  -0.821 -12.121   5.535
  284   3HD1  LEU  34          3HD1      LEU  34  -1.116 -10.488   6.135
  285   1HD2  LEU  34          1HD2      LEU  34  -1.243 -13.523   8.245
  286   2HD2  LEU  34          2HD2      LEU  34   0.430 -13.419   8.796
  287   3HD2  LEU  34          3HD2      LEU  34   0.076 -13.874   7.128
  288    H    ASN  35           H        ASN  35   3.895  -9.633   8.559
  289    HA   ASN  35           HA       ASN  35   5.932  -8.987   7.770
  290   1HB   ASN  35          2HB       ASN  35   6.416 -11.473   8.584
  291   2HB   ASN  35          1HB       ASN  35   6.597 -11.765   6.859
  292   1HD2  ASN  35          1HD2      ASN  35   7.664  -9.017   6.438
  293   2HD2  ASN  35          2HD2      ASN  35   9.282  -9.068   7.035
  294    H    LEU  36           H        LEU  36   3.476  -9.455   6.097
  295    HA   LEU  36           HA       LEU  36   4.742  -9.521   3.441
  296   1HB   LEU  36          2HB       LEU  36   1.945 -10.383   4.205
  297   2HB   LEU  36          1HB       LEU  36   2.592 -10.369   2.578
  298    HG   LEU  36           HG       LEU  36   3.619 -12.098   4.833
  299   1HD1  LEU  36          1HD1      LEU  36   1.916 -12.813   2.452
  300   2HD1  LEU  36          2HD1      LEU  36   1.386 -12.760   4.132
  301   3HD1  LEU  36          3HD1      LEU  36   2.588 -13.945   3.626
  302   1HD2  LEU  36          1HD2      LEU  36   5.348 -11.548   3.223
  303   2HD2  LEU  36          2HD2      LEU  36   4.298 -12.052   1.898
  304   3HD2  LEU  36          3HD2      LEU  36   4.871 -13.239   3.071
  305    H    ALA  37           H        ALA  37   3.852  -8.140   1.845
  306    HA   ALA  37           HA       ALA  37   2.204  -5.943   2.904
  307   1HB   ALA  37          1HB       ALA  37   4.555  -5.250   2.722
  308   2HB   ALA  37          2HB       ALA  37   3.503  -4.352   1.630
  309   3HB   ALA  37          3HB       ALA  37   4.522  -5.645   1.001
  310    H    TYR  38           H        TYR  38   0.635  -5.184   1.616
  311    HA   TYR  38           HA       TYR  38   0.228  -6.487  -0.992
  312   1HB   TYR  38          2HB       TYR  38  -1.733  -4.941   0.732
  313   2HB   TYR  38          1HB       TYR  38  -2.113  -5.764  -0.777
  314    HD1  TYR  38           1HD      TYR  38  -2.360  -8.170  -0.846
  315    HD2  TYR  38           2HD      TYR  38  -1.321  -6.209   2.784
  316    HE1  TYR  38           1HE      TYR  38  -2.886 -10.218   0.404
  317    HE2  TYR  38           2HE      TYR  38  -1.839  -8.257   4.044
  318    HH   TYR  38           HH       TYR  38  -2.266 -11.258   2.574
  319    H    ARG  39           H        ARG  39  -0.025  -5.215  -2.831
  320    HA   ARG  39           HA       ARG  39   1.023  -2.511  -2.528
  321   1HB   ARG  39          2HB       ARG  39   0.623  -4.230  -4.978
  322   2HB   ARG  39          1HB       ARG  39   1.254  -2.591  -5.015
  323   1HG   ARG  39          2HG       ARG  39   3.135  -3.314  -3.596
  324   2HG   ARG  39          1HG       ARG  39   2.519  -4.966  -3.670
  325   1HD   ARG  39          2HD       ARG  39   3.318  -3.309  -6.061
  326   2HD   ARG  39          1HD       ARG  39   4.342  -4.517  -5.286
  327    HE   ARG  39           HE       ARG  39   1.753  -5.174  -6.560
  328   1HH1  ARG  39          1HH1      ARG  39   5.150  -5.800  -5.973
  329   2HH1  ARG  39          2HH1      ARG  39   5.145  -7.320  -6.815
  330   1HH2  ARG  39          1HH2      ARG  39   1.753  -7.159  -7.697
  331   2HH2  ARG  39          2HH2      ARG  39   3.218  -8.083  -7.826
  332    H    ILE  40           H        ILE  40  -0.085  -0.702  -2.982
  333    HA   ILE  40           HA       ILE  40  -2.821  -0.997  -4.034
  334    HB   ILE  40           HB       ILE  40  -1.535   1.423  -2.736
  335   1HG1  ILE  40          2HG1      ILE  40  -3.602  -0.493  -1.638
  336   2HG1  ILE  40          1HG1      ILE  40  -1.911  -0.437  -1.151
  337   1HG2  ILE  40          1HG2      ILE  40  -3.824   2.329  -2.683
  338   2HG2  ILE  40          2HG2      ILE  40  -4.385   0.930  -3.597
  339   3HG2  ILE  40          3HG2      ILE  40  -3.248   2.063  -4.328
  340   1HD1  ILE  40          1HD1      ILE  40  -3.370   0.660   0.457
  341   2HD1  ILE  40          2HD1      ILE  40  -3.909   1.781  -0.793
  342   3HD1  ILE  40          3HD1      ILE  40  -2.227   1.796  -0.258
  343    H    ASP  41           H        ASP  41  -2.968  -0.720  -6.164
  344    HA   ASP  41           HA       ASP  41  -0.832   0.819  -7.470
  345   1HB   ASP  41          2HB       ASP  41  -1.062  -1.591  -8.113
  346   2HB   ASP  41          1HB       ASP  41  -2.665  -1.223  -8.741
  347    H    ASP  42           H        ASP  42  -1.610   2.824  -7.387
  348    HA   ASP  42           HA       ASP  42  -2.857   4.650  -7.861
  349   1HB   ASP  42          2HB       ASP  42  -1.956   3.998 -10.077
  350   2HB   ASP  42          1HB       ASP  42  -3.443   3.113 -10.392
  351    H    GLY  43           H        GLY  43  -4.318   3.907  -6.103
  352   1HA   GLY  43          2HA       GLY  43  -6.519   4.352  -5.450
  353   2HA   GLY  43          1HA       GLY  43  -7.037   4.157  -7.114
  354    H    ILE  44           H        ILE  44  -5.430   1.490  -7.040
  355    HA   ILE  44           HA       ILE  44  -7.696  -0.004  -5.900
  356    HB   ILE  44           HB       ILE  44  -5.847  -0.839  -8.140
  357   1HG1  ILE  44          2HG1      ILE  44  -8.740   0.051  -8.194
  358   2HG1  ILE  44          1HG1      ILE  44  -7.369   0.971  -8.798
  359   1HG2  ILE  44          1HG2      ILE  44  -7.385  -2.717  -8.438
  360   2HG2  ILE  44          2HG2      ILE  44  -8.313  -2.184  -7.036
  361   3HG2  ILE  44          3HG2      ILE  44  -6.650  -2.737  -6.833
  362   1HD1  ILE  44          1HD1      ILE  44  -8.282  -1.685  -9.872
  363   2HD1  ILE  44          2HD1      ILE  44  -6.970  -0.689 -10.505
  364   3HD1  ILE  44          3HD1      ILE  44  -8.635  -0.111 -10.587
  365    HA   PRO  45           HA       PRO  45  -4.467  -1.614  -3.174
  366   1HB   PRO  45          2HB       PRO  45  -6.672  -2.576  -1.555
  367   2HB   PRO  45          1HB       PRO  45  -5.480  -1.337  -1.162
  368   1HG   PRO  45          2HG       PRO  45  -8.121  -0.802  -1.589
  369   2HG   PRO  45          1HG       PRO  45  -6.822   0.367  -1.887
  370   1HD   PRO  45          2HD       PRO  45  -8.309  -1.350  -3.835
  371   2HD   PRO  45          1HD       PRO  45  -7.773   0.337  -3.997
  372    H    VAL  46           H        VAL  46  -3.638  -3.406  -4.093
  373    HA   VAL  46           HA       VAL  46  -5.330  -5.563  -4.986
  374    HB   VAL  46           HB       VAL  46  -2.311  -5.497  -4.859
  375   1HG1  VAL  46          1HG1      VAL  46  -2.439  -7.210  -6.604
  376   2HG1  VAL  46          2HG1      VAL  46  -4.199  -7.191  -6.491
  377   3HG1  VAL  46          3HG1      VAL  46  -3.233  -7.737  -5.119
  378   1HG2  VAL  46          1HG2      VAL  46  -3.155  -3.614  -6.169
  379   2HG2  VAL  46          2HG2      VAL  46  -4.130  -4.722  -7.136
  380   3HG2  VAL  46          3HG2      VAL  46  -2.369  -4.810  -7.200
  381    H    LEU  47           H        LEU  47  -6.283  -6.114  -2.977
  382    HA   LEU  47           HA       LEU  47  -4.586  -7.260  -0.926
  383   1HB   LEU  47          2HB       LEU  47  -7.596  -7.070  -1.112
  384   2HB   LEU  47          1HB       LEU  47  -6.706  -7.663   0.276
  385    HG   LEU  47           HG       LEU  47  -6.563  -4.846  -0.805
  386   1HD1  LEU  47          1HD1      LEU  47  -7.924  -5.953   1.644
  387   2HD1  LEU  47          2HD1      LEU  47  -8.729  -5.350   0.194
  388   3HD1  LEU  47          3HD1      LEU  47  -7.803  -4.246   1.214
  389   1HD2  LEU  47          1HD2      LEU  47  -4.487  -5.564   0.267
  390   2HD2  LEU  47          2HD2      LEU  47  -5.394  -6.076   1.688
  391   3HD2  LEU  47          3HD2      LEU  47  -5.331  -4.369   1.252
  392    H    LEU  48           H        LEU  48  -3.698  -8.902  -2.302
  393    HA   LEU  48           HA       LEU  48  -5.436 -11.272  -2.432
  394   1HB   LEU  48          2HB       LEU  48  -3.362 -10.414  -4.455
  395   2HB   LEU  48          1HB       LEU  48  -4.142 -11.984  -4.445
  396    HG   LEU  48           HG       LEU  48  -5.576  -9.352  -4.817
  397   1HD1  LEU  48          1HD1      LEU  48  -4.134  -9.837  -6.714
  398   2HD1  LEU  48          2HD1      LEU  48  -5.825 -10.081  -7.152
  399   3HD1  LEU  48          3HD1      LEU  48  -4.793 -11.469  -6.816
  400   1HD2  LEU  48          1HD2      LEU  48  -6.972 -11.095  -3.805
  401   2HD2  LEU  48          2HD2      LEU  48  -6.537 -12.198  -5.111
  402   3HD2  LEU  48          3HD2      LEU  48  -7.476 -10.748  -5.459
  403    H    ILE  49           H        ILE  49  -4.508 -13.178  -1.775
  404    HA   ILE  49           HA       ILE  49  -2.277 -12.942  -0.013
  405    HB   ILE  49           HB       ILE  49  -3.666 -15.448  -0.978
  406   1HG1  ILE  49          2HG1      ILE  49  -4.168 -13.821   1.527
  407   2HG1  ILE  49          1HG1      ILE  49  -5.189 -13.787   0.093
  408   1HG2  ILE  49          1HG2      ILE  49  -1.909 -14.958   1.427
  409   2HG2  ILE  49          2HG2      ILE  49  -1.502 -15.921   0.009
  410   3HG2  ILE  49          3HG2      ILE  49  -2.788 -16.447   1.092
  411   1HD1  ILE  49          1HD1      ILE  49  -4.671 -16.174   1.844
  412   2HD1  ILE  49          2HD1      ILE  49  -5.678 -16.159   0.393
  413   3HD1  ILE  49          3HD1      ILE  49  -6.143 -15.202   1.800
  414    H    ASP  50           H        ASP  50  -2.839 -14.339  -3.178
  415    HA   ASP  50           HA       ASP  50  -0.296 -15.535  -3.520
  416   1HB   ASP  50          2HB       ASP  50  -2.210 -16.192  -4.875
  417   2HB   ASP  50          1HB       ASP  50  -2.323 -14.572  -5.552
  418    H    GLU  51           H        GLU  51  -1.450 -12.297  -3.864
  419    HA   GLU  51           HA       GLU  51   0.820 -11.469  -5.494
  420   1HB   GLU  51          2HB       GLU  51  -1.708 -10.715  -5.670
  421   2HB   GLU  51          1HB       GLU  51  -1.219  -9.557  -4.441
  422   1HG   GLU  51          2HG       GLU  51  -1.043  -8.510  -6.574
  423   2HG   GLU  51          1HG       GLU  51   0.588  -8.795  -5.964
  424    H    ALA  52           H        ALA  52   0.093 -11.820  -2.253
  425    HA   ALA  52           HA       ALA  52   1.246  -9.461  -1.172
  426   1HB   ALA  52          1HB       ALA  52  -0.337 -10.858   0.078
  427   2HB   ALA  52          2HB       ALA  52   1.174 -10.621   0.958
  428   3HB   ALA  52          3HB       ALA  52   0.865 -12.149   0.132
  429    H    THR  53           H        THR  53   3.298  -8.922  -0.997
  430    HA   THR  53           HA       THR  53   5.345 -10.983  -1.466
  431    HB   THR  53           HB       THR  53   5.707  -7.989  -1.622
  432    HG1  THR  53           1HG      THR  53   4.164  -9.306  -3.183
  433   1HG2  THR  53          1HG2      THR  53   7.307 -10.287  -2.756
  434   2HG2  THR  53          2HG2      THR  53   7.781  -9.252  -1.407
  435   3HG2  THR  53          3HG2      THR  53   7.639  -8.581  -3.033
  436    H    GLU  54           H        GLU  54   7.246 -10.979  -0.135
  437    HA   GLU  54           HA       GLU  54   6.702 -10.368   2.616
  438   1HB   GLU  54          2HB       GLU  54   7.932 -12.407   1.933
  439   2HB   GLU  54          1HB       GLU  54   9.241 -11.400   1.335
  440   1HG   GLU  54          2HG       GLU  54   9.787 -10.659   3.518
  441   2HG   GLU  54          1HG       GLU  54   8.322 -11.372   4.193
  442    H    TRP  55           H        TRP  55   7.250  -8.585   3.697
  443    HA   TRP  55           HA       TRP  55   9.216  -6.751   2.545
  444   1HB   TRP  55          2HB       TRP  55   6.897  -6.255   1.635
  445   2HB   TRP  55          1HB       TRP  55   6.435  -5.830   3.279
  446    HD1  TRP  55           HD       TRP  55   7.145  -3.470   4.169
  447    HE1  TRP  55           1HE      TRP  55   8.252  -1.419   3.075
  448    HE3  TRP  55           3HE      TRP  55   8.714  -5.632  -0.191
  449    HZ2  TRP  55           2HZ      TRP  55   9.608  -0.805   0.677
  450    HZ3  TRP  55           3HZ      TRP  55   9.911  -4.245  -1.833
  451    HH2  TRP  55           HH       TRP  55  10.347  -1.878  -1.403
  452    H    THR  56           H        THR  56  10.017  -5.222   4.024
  453    HA   THR  56           HA       THR  56  10.863  -4.563   6.004
  454    HB   THR  56           HB       THR  56   8.147  -5.320   7.068
  455    HG1  THR  56           1HG      THR  56   9.149  -2.770   6.263
  456   1HG2  THR  56          1HG2      THR  56   8.636  -3.768   8.897
  457   2HG2  THR  56          2HG2      THR  56  10.245  -3.485   8.236
  458   3HG2  THR  56          3HG2      THR  56   9.815  -5.078   8.858
  459    HA   PRO  57           HA       PRO  57  12.015  -8.784   7.376
  460   1HB   PRO  57          2HB       PRO  57  14.745  -7.814   7.137
  461   2HB   PRO  57          1HB       PRO  57  13.964  -9.143   6.279
  462   1HG   PRO  57          2HG       PRO  57  14.712  -6.828   5.061
  463   2HG   PRO  57          1HG       PRO  57  13.344  -7.816   4.517
  464   1HD   PRO  57          2HD       PRO  57  13.341  -5.321   6.175
  465   2HD   PRO  57          1HD       PRO  57  12.261  -5.789   4.843
  466    H    ASN  58           H        ASN  58  11.671  -8.852   9.510
  467    HA   ASN  58           HA       ASN  58  12.571  -6.743  11.263
  468   1HB   ASN  58          2HB       ASN  58  10.359  -7.971  11.482
  469   2HB   ASN  58          1HB       ASN  58  11.273  -9.362  12.044
  470   1HD2  ASN  58          1HD2      ASN  58  12.182  -9.333  14.101
  471   2HD2  ASN  58          2HD2      ASN  58  11.784  -8.121  15.270
  472    H    ASN  59           H        ASN  59  13.819  -7.198  13.232
  473    HA   ASN  59           HA       ASN  59  16.236  -8.542  12.730
  474   1HB   ASN  59          2HB       ASN  59  14.979  -7.347  15.167
  475   2HB   ASN  59          1HB       ASN  59  16.400  -8.372  15.355
  476   1HD2  ASN  59          1HD2      ASN  59  17.653  -6.685  16.085
  477   2HD2  ASN  59          2HD2      ASN  59  18.227  -5.430  15.034
  478    H    LEU  60           H        LEU  60  17.139 -10.359  13.847
  479    HA   LEU  60           HA       LEU  60  15.347 -12.587  13.937
  480   1HB   LEU  60          2HB       LEU  60  18.274 -12.392  14.664
  481   2HB   LEU  60          1HB       LEU  60  17.371 -13.888  14.516
  482    HG   LEU  60           HG       LEU  60  17.905 -11.944  12.264
  483   1HD1  LEU  60          1HD1      LEU  60  19.412 -13.632  11.412
  484   2HD1  LEU  60          2HD1      LEU  60  19.078 -14.664  12.802
  485   3HD1  LEU  60          3HD1      LEU  60  19.912 -13.127  13.027
  486   1HD2  LEU  60          1HD2      LEU  60  15.787 -13.136  12.015
  487   2HD2  LEU  60          2HD2      LEU  60  16.623 -14.673  12.238
  488   3HD2  LEU  60          3HD2      LEU  60  16.974 -13.673  10.828
  489    H    GLU  61           H        GLU  61  13.916 -12.274  15.586
  490    HA   GLU  61           HA       GLU  61  14.754 -11.724  18.273
  491   1HB   GLU  61          2HB       GLU  61  12.101 -12.833  17.336
  492   2HB   GLU  61          1HB       GLU  61  12.433 -12.048  18.873
  493   1HG   GLU  61          2HG       GLU  61  12.946  -9.964  17.646
  494   2HG   GLU  61          1HG       GLU  61  12.466 -10.769  16.152
  Start of MODEL   20
    1   1H    MET   1          1HT       MET   1  -9.432  21.595   9.185
    2   2H    MET   1          2HT       MET   1  -7.853  22.217   9.153
    3   3H    MET   1          3HT       MET   1  -8.248  20.954  10.217
    4    HA   MET   1           HA       MET   1  -8.289  20.798   7.263
    5   1HB   MET   1          2HB       MET   1  -6.005  20.980   8.184
    6   2HB   MET   1          1HB       MET   1  -6.328  19.619   9.248
    7   1HG   MET   1          2HG       MET   1  -6.618  18.164   7.306
    8   2HG   MET   1          1HG       MET   1  -6.307  19.534   6.240
    9   1HE   MET   1          1HE       MET   1  -3.960  21.069   7.773
   10   2HE   MET   1          2HE       MET   1  -3.999  20.765   6.035
   11   3HE   MET   1          3HE       MET   1  -2.564  20.346   6.971
   12    H    SER   2           H        SER   2  -8.007  18.758  10.174
   13    HA   SER   2           HA       SER   2  -8.933  16.786  10.772
   14   1HB   SER   2          2HB       SER   2 -11.007  18.205  10.610
   15   2HB   SER   2          1HB       SER   2 -11.246  17.570   8.983
   16    HG   SER   2           HG       SER   2 -12.332  16.100  10.057
   17    H    LEU   3           H        LEU   3 -10.397  14.872   9.532
   18    HA   LEU   3           HA       LEU   3  -8.893  14.217   7.089
   19   1HB   LEU   3          2HB       LEU   3  -7.953  13.034   9.053
   20   2HB   LEU   3          1HB       LEU   3  -9.531  12.342   9.374
   21    HG   LEU   3           HG       LEU   3  -9.410  11.209   7.138
   22   1HD1  LEU   3          1HD1      LEU   3  -7.250  11.012   6.059
   23   2HD1  LEU   3          2HD1      LEU   3  -6.540  12.117   7.236
   24   3HD1  LEU   3          3HD1      LEU   3  -7.771  12.695   6.111
   25   1HD2  LEU   3          1HD2      LEU   3  -7.866   9.468   7.896
   26   2HD2  LEU   3          2HD2      LEU   3  -8.925  10.016   9.194
   27   3HD2  LEU   3          3HD2      LEU   3  -7.249  10.561   9.136
   28    H    ASP   4           H        ASP   4 -10.024  12.829   5.614
   29    HA   ASP   4           HA       ASP   4 -12.914  12.658   6.151
   30   1HB   ASP   4          2HB       ASP   4 -11.989  14.066   4.150
   31   2HB   ASP   4          1HB       ASP   4 -11.789  12.494   3.380
   32    HA   PRO   5           HA       PRO   5 -11.316   8.402   6.493
   33   1HB   PRO   5          2HB       PRO   5 -13.615   7.472   7.699
   34   2HB   PRO   5          1HB       PRO   5 -12.232   8.161   8.554
   35   1HG   PRO   5          2HG       PRO   5 -14.812   9.447   7.768
   36   2HG   PRO   5          1HG       PRO   5 -13.877   9.626   9.264
   37   1HD   PRO   5          2HD       PRO   5 -13.825  11.495   7.342
   38   2HD   PRO   5          1HD       PRO   5 -12.379  11.107   8.300
   39    H    GLN   6           H        GLN   6 -14.121   9.613   4.874
   40    HA   GLN   6           HA       GLN   6 -15.095   7.125   3.886
   41   1HB   GLN   6          2HB       GLN   6 -16.498   9.124   3.969
   42   2HB   GLN   6          1HB       GLN   6 -15.445   9.929   2.815
   43   1HG   GLN   6          2HG       GLN   6 -16.072   8.379   1.087
   44   2HG   GLN   6          1HG       GLN   6 -17.022   7.434   2.234
   45   1HE2  GLN   6          1HE2      GLN   6 -18.991   8.184   2.916
   46   2HE2  GLN   6          2HE2      GLN   6 -19.817   9.494   2.141
   47    H    LEU   7           H        LEU   7 -12.597   9.326   2.882
   48    HA   LEU   7           HA       LEU   7 -12.288   7.995   0.307
   49   1HB   LEU   7          2HB       LEU   7 -11.028  10.431   1.541
   50   2HB   LEU   7          1HB       LEU   7 -10.391   9.713   0.076
   51    HG   LEU   7           HG       LEU   7 -12.654  10.049  -0.968
   52   1HD1  LEU   7          1HD1      LEU   7 -13.124  11.749   1.471
   53   2HD1  LEU   7          2HD1      LEU   7 -13.980  10.263   1.060
   54   3HD1  LEU   7          3HD1      LEU   7 -14.149  11.689   0.036
   55   1HD2  LEU   7          1HD2      LEU   7 -12.294  12.431  -1.385
   56   2HD2  LEU   7          2HD2      LEU   7 -10.777  11.530  -1.422
   57   3HD2  LEU   7          3HD2      LEU   7 -11.193  12.502  -0.009
   58    H    LEU   8           H        LEU   8 -11.588   6.918   3.113
   59    HA   LEU   8           HA       LEU   8  -9.013   5.781   2.295
   60   1HB   LEU   8          2HB       LEU   8  -9.622   6.986   4.994
   61   2HB   LEU   8          1HB       LEU   8  -8.285   5.887   4.718
   62    HG   LEU   8           HG       LEU   8  -8.622   8.560   3.352
   63   1HD1  LEU   8          1HD1      LEU   8  -6.790   9.295   4.793
   64   2HD1  LEU   8          2HD1      LEU   8  -6.807   7.735   5.617
   65   3HD1  LEU   8          3HD1      LEU   8  -8.198   8.814   5.745
   66   1HD2  LEU   8          1HD2      LEU   8  -6.329   6.600   3.393
   67   2HD2  LEU   8          2HD2      LEU   8  -6.300   8.198   2.646
   68   3HD2  LEU   8          3HD2      LEU   8  -7.374   6.947   2.016
   69    H    GLU   9           H        GLU   9 -11.511   5.662   4.807
   70    HA   GLU   9           HA       GLU   9 -12.708   4.003   5.735
   71   1HB   GLU   9          2HB       GLU   9 -11.850   2.446   3.295
   72   2HB   GLU   9          1HB       GLU   9 -13.051   1.897   4.459
   73   1HG   GLU   9          2HG       GLU   9 -14.426   3.873   3.934
   74   2HG   GLU   9          1HG       GLU   9 -13.238   4.352   2.724
   75    H    VAL  10           H        VAL  10 -12.492   1.547   6.420
   76    HA   VAL  10           HA       VAL  10 -10.004   1.440   7.881
   77    HB   VAL  10           HB       VAL  10 -12.307  -0.514   7.958
   78   1HG1  VAL  10          1HG1      VAL  10 -10.018  -0.045   9.868
   79   2HG1  VAL  10          2HG1      VAL  10 -10.239  -1.447   8.823
   80   3HG1  VAL  10          3HG1      VAL  10 -11.369  -1.144  10.142
   81   1HG2  VAL  10          1HG2      VAL  10 -13.095   1.692   8.577
   82   2HG2  VAL  10          2HG2      VAL  10 -11.750   1.887   9.703
   83   3HG2  VAL  10          3HG2      VAL  10 -12.989   0.670  10.010
   84    H    LEU  11           H        LEU  11  -8.398   0.895   6.515
   85    HA   LEU  11           HA       LEU  11  -8.613  -1.340   4.716
   86   1HB   LEU  11          2HB       LEU  11  -6.197   0.258   5.580
   87   2HB   LEU  11          1HB       LEU  11  -6.230  -0.908   4.269
   88    HG   LEU  11           HG       LEU  11  -7.803   1.669   4.354
   89   1HD1  LEU  11          1HD1      LEU  11  -6.271   2.379   2.567
   90   2HD1  LEU  11          2HD1      LEU  11  -5.341   0.899   2.795
   91   3HD1  LEU  11          3HD1      LEU  11  -5.433   2.091   4.090
   92   1HD2  LEU  11          1HD2      LEU  11  -7.483  -0.367   2.152
   93   2HD2  LEU  11          2HD2      LEU  11  -8.340   1.169   2.031
   94   3HD2  LEU  11          3HD2      LEU  11  -8.943  -0.092   3.105
   95    H    ALA  12           H        ALA  12  -8.779  -3.287   5.584
   96    HA   ALA  12           HA       ALA  12  -7.058  -3.932   7.885
   97   1HB   ALA  12          1HB       ALA  12  -9.456  -3.887   8.437
   98   2HB   ALA  12          2HB       ALA  12  -8.757  -5.495   8.620
   99   3HB   ALA  12          3HB       ALA  12  -9.745  -5.122   7.210
  100    H    CYS  13           H        CYS  13  -6.253  -6.064   8.020
  101    HA   CYS  13           HA       CYS  13  -5.188  -7.084   5.625
  102   1HB   CYS  13          2HB       CYS  13  -5.439  -8.535   8.263
  103   2HB   CYS  13          1HB       CYS  13  -4.240  -8.809   7.002
  104    HG   CYS  13           HG       CYS  13  -4.468  -5.953   8.880
  105    HA   PRO  14           HA       PRO  14  -8.410  -9.694   4.147
  106   1HB   PRO  14          2HB       PRO  14  -6.977 -11.639   2.893
  107   2HB   PRO  14          1HB       PRO  14  -7.182 -10.009   2.242
  108   1HG   PRO  14          2HG       PRO  14  -4.866 -11.176   3.736
  109   2HG   PRO  14          1HG       PRO  14  -4.865 -10.106   2.321
  110   1HD   PRO  14          2HD       PRO  14  -4.406  -9.213   4.834
  111   2HD   PRO  14          1HD       PRO  14  -5.194  -8.221   3.590
  112    H    LYS  15           H        LYS  15  -5.904 -11.140   6.158
  113    HA   LYS  15           HA       LYS  15  -7.622 -13.484   6.567
  114   1HB   LYS  15          2HB       LYS  15  -5.333 -13.962   5.825
  115   2HB   LYS  15          1HB       LYS  15  -4.697 -13.130   7.240
  116   1HG   LYS  15          2HG       LYS  15  -5.470 -14.798   8.701
  117   2HG   LYS  15          1HG       LYS  15  -6.539 -15.488   7.482
  118   1HD   LYS  15          2HD       LYS  15  -3.522 -15.519   7.368
  119   2HD   LYS  15          1HD       LYS  15  -4.540 -16.870   7.877
  120   1HE   LYS  15          2HE       LYS  15  -5.654 -16.743   5.625
  121   2HE   LYS  15          1HE       LYS  15  -4.414 -15.584   5.153
  122   1HZ   LYS  15          1HZ       LYS  15  -2.734 -17.302   5.638
  123   2HZ   LYS  15          2HZ       LYS  15  -3.811 -17.779   4.419
  124   3HZ   LYS  15          3HZ       LYS  15  -3.979 -18.402   5.985
  125    H    ASP  16           H        ASP  16  -5.294 -11.774   8.687
  126    HA   ASP  16           HA       ASP  16  -6.852 -12.383  11.006
  127   1HB   ASP  16          2HB       ASP  16  -5.189 -11.019  12.218
  128   2HB   ASP  16          1HB       ASP  16  -4.432 -12.211  11.167
  129    H    LYS  17           H        LYS  17  -6.670  -9.750   8.800
  130    HA   LYS  17           HA       LYS  17  -7.960  -7.945   8.446
  131   1HB   LYS  17          2HB       LYS  17  -9.728  -9.225  10.521
  132   2HB   LYS  17          1HB       LYS  17 -10.170  -7.794   9.601
  133   1HG   LYS  17          2HG       LYS  17  -9.620  -9.315   7.545
  134   2HG   LYS  17          1HG       LYS  17  -9.894 -10.619   8.704
  135   1HD   LYS  17          2HD       LYS  17 -11.950 -10.093   7.514
  136   2HD   LYS  17          1HD       LYS  17 -12.101  -9.674   9.223
  137   1HE   LYS  17          2HE       LYS  17 -11.592  -7.333   8.673
  138   2HE   LYS  17          1HE       LYS  17 -11.496  -7.761   6.968
  139   1HZ   LYS  17          1HZ       LYS  17 -13.802  -8.353   6.978
  140   2HZ   LYS  17          2HZ       LYS  17 -13.643  -6.790   7.626
  141   3HZ   LYS  17          3HZ       LYS  17 -13.915  -8.103   8.652
  142    H    GLY  18           H        GLY  18  -5.853  -7.949  10.587
  143   1HA   GLY  18          2HA       GLY  18  -6.720  -5.883  12.401
  144   2HA   GLY  18          1HA       GLY  18  -5.061  -6.402  12.122
  145    HA   PRO  19           HA       PRO  19  -6.163  -2.258   9.950
  146   1HB   PRO  19          2HB       PRO  19  -4.673  -0.630  11.577
  147   2HB   PRO  19          1HB       PRO  19  -6.408  -0.900  11.768
  148   1HG   PRO  19          2HG       PRO  19  -4.119  -2.159  13.225
  149   2HG   PRO  19          1HG       PRO  19  -5.676  -1.590  13.857
  150   1HD   PRO  19          2HD       PRO  19  -5.189  -4.202  13.408
  151   2HD   PRO  19          1HD       PRO  19  -6.794  -3.487  13.162
  152    H    LEU  20           H        LEU  20  -4.934  -2.256   8.207
  153    HA   LEU  20           HA       LEU  20  -2.236  -3.137   8.143
  154   1HB   LEU  20          2HB       LEU  20  -3.975  -1.709   6.143
  155   2HB   LEU  20          1HB       LEU  20  -2.320  -2.169   5.795
  156    HG   LEU  20           HG       LEU  20  -4.428  -4.167   6.608
  157   1HD1  LEU  20          1HD1      LEU  20  -3.530  -3.393   3.832
  158   2HD1  LEU  20          2HD1      LEU  20  -5.116  -3.062   4.529
  159   3HD1  LEU  20          3HD1      LEU  20  -4.611  -4.726   4.235
  160   1HD2  LEU  20          1HD2      LEU  20  -2.099  -4.844   6.946
  161   2HD2  LEU  20          2HD2      LEU  20  -1.739  -4.445   5.266
  162   3HD2  LEU  20          3HD2      LEU  20  -2.848  -5.765   5.639
  163    H    ARG  21           H        ARG  21  -0.337  -2.000   8.005
  164    HA   ARG  21           HA       ARG  21  -0.439   0.763   8.887
  165   1HB   ARG  21          2HB       ARG  21   1.237  -0.746   9.879
  166   2HB   ARG  21          1HB       ARG  21   1.948  -0.999   8.289
  167   1HG   ARG  21          2HG       ARG  21   2.565   1.335   8.154
  168   2HG   ARG  21          1HG       ARG  21   1.782   1.652   9.703
  169   1HD   ARG  21          2HD       ARG  21   3.364   0.145  10.808
  170   2HD   ARG  21          1HD       ARG  21   4.148  -0.165   9.258
  171    HE   ARG  21           HE       ARG  21   4.236   2.544   9.492
  172   1HH1  ARG  21          1HH1      ARG  21   5.290  -0.100  11.550
  173   2HH1  ARG  21          2HH1      ARG  21   6.599   0.798  12.253
  174   1HH2  ARG  21          1HH2      ARG  21   5.935   3.727  10.433
  175   2HH2  ARG  21          2HH2      ARG  21   6.941   2.996  11.648
  176    H    TYR  22           H        TYR  22  -0.226   2.465   7.614
  177    HA   TYR  22           HA       TYR  22  -0.048   1.995   4.747
  178   1HB   TYR  22          2HB       TYR  22  -1.885   3.358   5.833
  179   2HB   TYR  22          1HB       TYR  22  -0.669   4.565   6.217
  180    HD1  TYR  22           1HD      TYR  22  -2.989   3.393   3.787
  181    HD2  TYR  22           2HD      TYR  22   0.608   5.622   4.244
  182    HE1  TYR  22           1HE      TYR  22  -3.386   4.478   1.617
  183    HE2  TYR  22           2HE      TYR  22   0.215   6.709   2.077
  184    HH   TYR  22           HH       TYR  22  -2.778   6.444   0.411
  185    H    LEU  23           H        LEU  23   1.790   2.330   3.668
  186    HA   LEU  23           HA       LEU  23   3.821   4.094   4.866
  187   1HB   LEU  23          2HB       LEU  23   4.008   1.740   3.017
  188   2HB   LEU  23          1HB       LEU  23   5.289   2.934   3.047
  189    HG   LEU  23           HG       LEU  23   5.562   2.483   5.499
  190   1HD1  LEU  23          1HD1      LEU  23   4.624   0.417   6.404
  191   2HD1  LEU  23          2HD1      LEU  23   3.700   0.185   4.920
  192   3HD1  LEU  23          3HD1      LEU  23   3.358   1.564   5.964
  193   1HD2  LEU  23          1HD2      LEU  23   5.921   0.129   3.653
  194   2HD2  LEU  23          2HD2      LEU  23   6.750   0.381   5.187
  195   3HD2  LEU  23          3HD2      LEU  23   7.038   1.481   3.840
  196    H    GLU  24           H        GLU  24   3.838   6.064   4.066
  197    HA   GLU  24           HA       GLU  24   2.500   6.888   1.729
  198   1HB   GLU  24          2HB       GLU  24   4.782   8.284   3.134
  199   2HB   GLU  24          1HB       GLU  24   3.634   9.029   2.038
  200   1HG   GLU  24          2HG       GLU  24   2.923   7.802   4.689
  201   2HG   GLU  24          1HG       GLU  24   3.209   9.519   4.413
  202    H    SER  25           H        SER  25   5.714   5.727   2.265
  203    HA   SER  25           HA       SER  25   7.211   6.934   0.325
  204   1HB   SER  25          2HB       SER  25   7.475   4.029   1.108
  205   2HB   SER  25          1HB       SER  25   8.756   5.112   0.557
  206    HG   SER  25           HG       SER  25   8.152   6.413   2.498
  207    H    GLU  26           H        GLU  26   5.924   3.618  -0.145
  208    HA   GLU  26           HA       GLU  26   5.903   4.232  -3.025
  209   1HB   GLU  26          2HB       GLU  26   6.327   1.545  -1.705
  210   2HB   GLU  26          1HB       GLU  26   6.368   1.869  -3.433
  211   1HG   GLU  26          2HG       GLU  26   8.289   3.400  -3.027
  212   2HG   GLU  26          1HG       GLU  26   8.294   2.860  -1.349
  213    H    GLN  27           H        GLN  27   3.746   4.406  -0.865
  214    HA   GLN  27           HA       GLN  27   1.515   3.990  -0.643
  215   1HB   GLN  27          2HB       GLN  27   1.825   3.354  -3.583
  216   2HB   GLN  27          1HB       GLN  27   0.272   3.435  -2.766
  217   1HG   GLN  27          2HG       GLN  27   2.192   5.741  -2.760
  218   2HG   GLN  27          1HG       GLN  27   1.032   5.486  -4.065
  219   1HE2  GLN  27          1HE2      GLN  27   1.270   7.646  -2.057
  220   2HE2  GLN  27          2HE2      GLN  27  -0.263   7.713  -1.260
  221    H    LEU  28           H        LEU  28   2.469   2.147   0.680
  222    HA   LEU  28           HA       LEU  28   1.547  -0.427  -0.402
  223   1HB   LEU  28          2HB       LEU  28   4.066   0.098   1.174
  224   2HB   LEU  28          1HB       LEU  28   3.425  -1.503   0.860
  225    HG   LEU  28           HG       LEU  28   4.360   0.442  -1.257
  226   1HD1  LEU  28          1HD1      LEU  28   6.243  -1.066  -1.532
  227   2HD1  LEU  28          2HD1      LEU  28   5.652  -2.072  -0.211
  228   3HD1  LEU  28          3HD1      LEU  28   6.194  -0.425   0.109
  229   1HD2  LEU  28          1HD2      LEU  28   3.470  -2.434  -1.461
  230   2HD2  LEU  28          2HD2      LEU  28   4.138  -1.463  -2.774
  231   3HD2  LEU  28          3HD2      LEU  28   2.589  -1.026  -2.054
  232    H    LEU  29           H        LEU  29   0.595  -1.825   1.019
  233    HA   LEU  29           HA       LEU  29   0.095  -0.820   3.745
  234   1HB   LEU  29          2HB       LEU  29  -1.544  -2.748   2.088
  235   2HB   LEU  29          1HB       LEU  29  -1.932  -2.211   3.711
  236    HG   LEU  29           HG       LEU  29  -1.810  -0.409   1.289
  237   1HD1  LEU  29          1HD1      LEU  29  -4.184  -1.548   2.761
  238   2HD1  LEU  29          2HD1      LEU  29  -3.665  -1.984   1.134
  239   3HD1  LEU  29          3HD1      LEU  29  -4.250  -0.353   1.461
  240   1HD2  LEU  29          1HD2      LEU  29  -2.882   1.223   2.773
  241   2HD2  LEU  29          2HD2      LEU  29  -1.290   0.748   3.365
  242   3HD2  LEU  29          3HD2      LEU  29  -2.742   0.086   4.117
  243    H    VAL  30           H        VAL  30   1.151  -1.921   5.300
  244    HA   VAL  30           HA       VAL  30   2.214  -4.574   4.566
  245    HB   VAL  30           HB       VAL  30   3.328  -2.621   6.587
  246   1HG1  VAL  30          1HG1      VAL  30   5.290  -4.103   6.585
  247   2HG1  VAL  30          2HG1      VAL  30   4.448  -5.201   5.492
  248   3HG1  VAL  30          3HG1      VAL  30   3.838  -4.944   7.127
  249   1HG2  VAL  30          1HG2      VAL  30   4.285  -3.287   3.806
  250   2HG2  VAL  30          2HG2      VAL  30   5.119  -2.244   4.959
  251   3HG2  VAL  30          3HG2      VAL  30   3.547  -1.765   4.314
  252    H    ASN  31           H        ASN  31   1.749  -6.286   5.771
  253    HA   ASN  31           HA       ASN  31   0.129  -5.856   8.185
  254   1HB   ASN  31          2HB       ASN  31  -1.087  -7.073   6.490
  255   2HB   ASN  31          1HB       ASN  31   0.232  -8.225   6.305
  256   1HD2  ASN  31          1HD2      ASN  31  -1.468  -9.803   6.708
  257   2HD2  ASN  31          2HD2      ASN  31  -1.934 -10.160   8.340
  258    H    GLU  32           H        GLU  32   0.961  -6.297  10.038
  259    HA   GLU  32           HA       GLU  32   3.587  -7.203  10.444
  260   1HB   GLU  32          2HB       GLU  32   2.413  -5.742  12.010
  261   2HB   GLU  32          1HB       GLU  32   1.250  -7.013  12.355
  262   1HG   GLU  32          2HG       GLU  32   3.232  -8.378  13.185
  263   2HG   GLU  32          1HG       GLU  32   4.143  -6.868  13.133
  264    H    ARG  33           H        ARG  33   0.477  -8.867  10.562
  265    HA   ARG  33           HA       ARG  33   1.466 -11.070  12.084
  266   1HB   ARG  33          2HB       ARG  33  -1.120 -10.650  10.590
  267   2HB   ARG  33          1HB       ARG  33  -0.771 -12.101  11.518
  268   1HG   ARG  33          2HG       ARG  33  -2.026 -10.793  12.969
  269   2HG   ARG  33          1HG       ARG  33  -0.364 -10.515  13.488
  270   1HD   ARG  33          2HD       ARG  33  -0.372  -8.452  12.060
  271   2HD   ARG  33          1HD       ARG  33  -2.104  -8.701  11.832
  272    HE   ARG  33           HE       ARG  33  -0.765  -8.051  14.370
  273   1HH1  ARG  33          1HH1      ARG  33  -3.694  -8.362  12.460
  274   2HH1  ARG  33          2HH1      ARG  33  -4.688  -7.584  13.662
  275   1HH2  ARG  33          1HH2      ARG  33  -2.058  -6.990  15.905
  276   2HH2  ARG  33          2HH2      ARG  33  -3.756  -6.760  15.591
  277    H    LEU  34           H        LEU  34   1.546 -10.366   8.739
  278    HA   LEU  34           HA       LEU  34   2.094 -13.205   8.179
  279   1HB   LEU  34          2HB       LEU  34   0.755 -11.165   6.409
  280   2HB   LEU  34          1HB       LEU  34   1.327 -12.720   5.833
  281    HG   LEU  34           HG       LEU  34  -0.808 -12.300   7.934
  282   1HD1  LEU  34          1HD1      LEU  34  -1.551 -11.700   5.690
  283   2HD1  LEU  34          2HD1      LEU  34  -2.323 -13.189   6.239
  284   3HD1  LEU  34          3HD1      LEU  34  -0.994 -13.257   5.082
  285   1HD2  LEU  34          1HD2      LEU  34   0.491 -14.333   8.332
  286   2HD2  LEU  34          2HD2      LEU  34   0.229 -14.834   6.662
  287   3HD2  LEU  34          3HD2      LEU  34  -1.138 -14.720   7.771
  288    H    ASN  35           H        ASN  35   3.487 -10.204   8.392
  289    HA   ASN  35           HA       ASN  35   5.458  -9.287   7.702
  290   1HB   ASN  35          2HB       ASN  35   6.269 -11.551   8.495
  291   2HB   ASN  35          1HB       ASN  35   6.201 -12.092   6.822
  292   1HD2  ASN  35          1HD2      ASN  35   7.195  -8.901   7.882
  293   2HD2  ASN  35          2HD2      ASN  35   8.842  -9.041   7.385
  294    H    LEU  36           H        LEU  36   3.206  -9.483   5.855
  295    HA   LEU  36           HA       LEU  36   4.635  -9.504   3.279
  296   1HB   LEU  36          2HB       LEU  36   1.753 -10.208   3.838
  297   2HB   LEU  36          1HB       LEU  36   2.465 -10.099   2.241
  298    HG   LEU  36           HG       LEU  36   3.262 -12.088   4.373
  299   1HD1  LEU  36          1HD1      LEU  36   1.691 -12.445   1.827
  300   2HD1  LEU  36          2HD1      LEU  36   1.055 -12.556   3.468
  301   3HD1  LEU  36          3HD1      LEU  36   2.230 -13.742   2.893
  302   1HD2  LEU  36          1HD2      LEU  36   4.598 -13.121   2.611
  303   2HD2  LEU  36          2HD2      LEU  36   5.131 -11.468   2.924
  304   3HD2  LEU  36          3HD2      LEU  36   4.151 -11.826   1.501
  305    H    ALA  37           H        ALA  37   3.889  -8.007   1.687
  306    HA   ALA  37           HA       ALA  37   2.422  -5.709   2.806
  307   1HB   ALA  37          1HB       ALA  37   3.733  -4.250   1.362
  308   2HB   ALA  37          2HB       ALA  37   4.629  -5.642   0.753
  309   3HB   ALA  37          3HB       ALA  37   4.780  -5.167   2.445
  310    H    TYR  38           H        TYR  38   0.707  -5.027   1.715
  311    HA   TYR  38           HA       TYR  38  -0.021  -6.526  -0.686
  312   1HB   TYR  38          2HB       TYR  38  -1.727  -4.780   1.111
  313   2HB   TYR  38          1HB       TYR  38  -2.311  -5.774  -0.224
  314    HD1  TYR  38           1HD      TYR  38  -1.235  -5.741   3.240
  315    HD2  TYR  38           2HD      TYR  38  -2.197  -8.250  -0.059
  316    HE1  TYR  38           1HE      TYR  38  -1.417  -7.658   4.760
  317    HE2  TYR  38           2HE      TYR  38  -2.387 -10.180   1.458
  318    HH   TYR  38           HH       TYR  38  -1.539 -10.856   3.672
  319    H    ARG  39           H        ARG  39  -0.505  -5.544  -2.591
  320    HA   ARG  39           HA       ARG  39   0.984  -3.070  -2.912
  321   1HB   ARG  39          2HB       ARG  39  -0.079  -4.941  -5.033
  322   2HB   ARG  39          1HB       ARG  39   1.152  -3.702  -5.235
  323   1HG   ARG  39          2HG       ARG  39   2.720  -4.922  -3.932
  324   2HG   ARG  39          1HG       ARG  39   1.484  -6.066  -3.410
  325   1HD   ARG  39          2HD       ARG  39   2.833  -7.104  -5.106
  326   2HD   ARG  39          1HD       ARG  39   1.231  -6.791  -5.769
  327    HE   ARG  39           HE       ARG  39   2.884  -4.611  -6.385
  328   1HH1  ARG  39          1HH1      ARG  39   2.534  -8.016  -7.206
  329   2HH1  ARG  39          2HH1      ARG  39   3.268  -7.839  -8.773
  330   1HH2  ARG  39          1HH2      ARG  39   3.814  -4.384  -8.446
  331   2HH2  ARG  39          2HH2      ARG  39   4.004  -5.770  -9.476
  332    H    ILE  40           H        ILE  40   0.159  -1.209  -3.722
  333    HA   ILE  40           HA       ILE  40  -2.736  -1.169  -4.299
  334    HB   ILE  40           HB       ILE  40  -0.936   1.149  -3.537
  335   1HG1  ILE  40          2HG1      ILE  40  -3.074  -0.249  -1.914
  336   2HG1  ILE  40          1HG1      ILE  40  -1.342  -0.445  -1.678
  337   1HG2  ILE  40          1HG2      ILE  40  -2.781   1.817  -4.984
  338   2HG2  ILE  40          2HG2      ILE  40  -3.012   2.429  -3.345
  339   3HG2  ILE  40          3HG2      ILE  40  -3.927   1.026  -3.901
  340   1HD1  ILE  40          1HD1      ILE  40  -2.885   2.112  -1.337
  341   2HD1  ILE  40          2HD1      ILE  40  -1.155   1.904  -1.072
  342   3HD1  ILE  40          3HD1      ILE  40  -2.314   1.065  -0.041
  343    H    ASP  41           H        ASP  41  -3.135  -1.195  -6.413
  344    HA   ASP  41           HA       ASP  41  -1.057  -0.139  -8.208
  345   1HB   ASP  41          2HB       ASP  41  -1.675  -2.595  -8.349
  346   2HB   ASP  41          1HB       ASP  41  -3.252  -2.084  -8.940
  347    H    ASP  42           H        ASP  42  -1.594   1.927  -8.415
  348    HA   ASP  42           HA       ASP  42  -2.702   3.817  -8.969
  349   1HB   ASP  42          2HB       ASP  42  -2.508   2.705 -11.188
  350   2HB   ASP  42          1HB       ASP  42  -4.125   2.043 -10.960
  351    H    GLY  43           H        GLY  43  -3.727   3.437  -6.758
  352   1HA   GLY  43          2HA       GLY  43  -5.572   4.242  -5.604
  353   2HA   GLY  43          1HA       GLY  43  -6.487   4.192  -7.099
  354    H    ILE  44           H        ILE  44  -5.380   1.231  -7.162
  355    HA   ILE  44           HA       ILE  44  -7.651   0.193  -5.606
  356    HB   ILE  44           HB       ILE  44  -6.231  -1.084  -7.951
  357   1HG1  ILE  44          2HG1      ILE  44  -8.974   0.187  -7.795
  358   2HG1  ILE  44          1HG1      ILE  44  -7.568   0.917  -8.557
  359   1HG2  ILE  44          1HG2      ILE  44  -7.142  -2.724  -6.388
  360   2HG2  ILE  44          2HG2      ILE  44  -8.056  -2.719  -7.897
  361   3HG2  ILE  44          3HG2      ILE  44  -8.716  -1.933  -6.461
  362   1HD1  ILE  44          1HD1      ILE  44  -9.032  -0.056 -10.212
  363   2HD1  ILE  44          2HD1      ILE  44  -8.919  -1.624  -9.414
  364   3HD1  ILE  44          3HD1      ILE  44  -7.491  -0.916 -10.169
  365    HA   PRO  45           HA       PRO  45  -4.312  -1.621  -3.142
  366   1HB   PRO  45          2HB       PRO  45  -6.364  -2.122  -1.155
  367   2HB   PRO  45          1HB       PRO  45  -4.996  -1.012  -1.067
  368   1HG   PRO  45          2HG       PRO  45  -7.594  -0.194  -1.216
  369   2HG   PRO  45          1HG       PRO  45  -6.227   0.765  -1.813
  370   1HD   PRO  45          2HD       PRO  45  -8.149  -0.952  -3.339
  371   2HD   PRO  45          1HD       PRO  45  -7.475   0.636  -3.762
  372    H    VAL  46           H        VAL  46  -3.807  -3.582  -3.900
  373    HA   VAL  46           HA       VAL  46  -5.837  -5.636  -4.223
  374    HB   VAL  46           HB       VAL  46  -2.861  -5.837  -4.734
  375   1HG1  VAL  46          1HG1      VAL  46  -3.983  -7.987  -4.529
  376   2HG1  VAL  46          2HG1      VAL  46  -3.473  -7.699  -6.193
  377   3HG1  VAL  46          3HG1      VAL  46  -5.168  -7.497  -5.743
  378   1HG2  VAL  46          1HG2      VAL  46  -5.059  -5.118  -6.675
  379   2HG2  VAL  46          2HG2      VAL  46  -3.361  -5.375  -7.079
  380   3HG2  VAL  46          3HG2      VAL  46  -3.827  -4.020  -6.054
  381    H    LEU  47           H        LEU  47  -6.445  -6.389  -2.264
  382    HA   LEU  47           HA       LEU  47  -4.436  -6.967  -0.232
  383   1HB   LEU  47          2HB       LEU  47  -7.446  -7.195  -0.140
  384   2HB   LEU  47          1HB       LEU  47  -6.368  -7.406   1.225
  385    HG   LEU  47           HG       LEU  47  -6.809  -4.842  -0.308
  386   1HD1  LEU  47          1HD1      LEU  47  -7.818  -4.051   1.772
  387   2HD1  LEU  47          2HD1      LEU  47  -7.600  -5.648   2.487
  388   3HD1  LEU  47          3HD1      LEU  47  -8.689  -5.437   1.116
  389   1HD2  LEU  47          1HD2      LEU  47  -5.394  -3.810   1.389
  390   2HD2  LEU  47          2HD2      LEU  47  -4.510  -5.029   0.471
  391   3HD2  LEU  47          3HD2      LEU  47  -5.081  -5.393   2.099
  392    H    LEU  48           H        LEU  48  -4.184  -8.565  -2.445
  393    HA   LEU  48           HA       LEU  48  -5.315 -11.155  -1.680
  394   1HB   LEU  48          2HB       LEU  48  -3.774 -10.326  -4.145
  395   2HB   LEU  48          1HB       LEU  48  -4.373 -11.945  -3.841
  396    HG   LEU  48           HG       LEU  48  -6.083  -9.479  -4.203
  397   1HD1  LEU  48          1HD1      LEU  48  -5.648 -11.858  -6.002
  398   2HD1  LEU  48          2HD1      LEU  48  -5.019 -10.233  -6.271
  399   3HD1  LEU  48          3HD1      LEU  48  -6.758 -10.521  -6.295
  400   1HD2  LEU  48          1HD2      LEU  48  -7.964 -11.040  -4.198
  401   2HD2  LEU  48          2HD2      LEU  48  -7.102 -11.067  -2.658
  402   3HD2  LEU  48          3HD2      LEU  48  -6.864 -12.369  -3.827
  403    H    ILE  49           H        ILE  49  -4.169 -12.569  -0.579
  404    HA   ILE  49           HA       ILE  49  -1.628 -11.936   0.453
  405    HB   ILE  49           HB       ILE  49  -3.021 -14.622   0.400
  406   1HG1  ILE  49          2HG1      ILE  49  -3.040 -12.440   2.496
  407   2HG1  ILE  49          1HG1      ILE  49  -4.370 -12.834   1.414
  408   1HG2  ILE  49          1HG2      ILE  49  -0.662 -14.847   0.918
  409   2HG2  ILE  49          2HG2      ILE  49  -1.645 -15.159   2.350
  410   3HG2  ILE  49          3HG2      ILE  49  -0.806 -13.616   2.173
  411   1HD1  ILE  49          1HD1      ILE  49  -4.565 -15.024   2.443
  412   2HD1  ILE  49          2HD1      ILE  49  -4.719 -13.736   3.639
  413   3HD1  ILE  49          3HD1      ILE  49  -3.214 -14.649   3.513
  414    H    ASP  50           H        ASP  50  -2.638 -13.831  -2.307
  415    HA   ASP  50           HA       ASP  50  -0.115 -15.072  -2.766
  416   1HB   ASP  50          2HB       ASP  50  -2.452 -14.636  -4.631
  417   2HB   ASP  50          1HB       ASP  50  -1.076 -15.684  -4.964
  418    H    GLU  51           H        GLU  51  -1.510 -12.013  -3.604
  419    HA   GLU  51           HA       GLU  51   0.580 -11.420  -5.550
  420   1HB   GLU  51          2HB       GLU  51  -1.796 -10.705  -5.913
  421   2HB   GLU  51          1HB       GLU  51  -1.636  -9.626  -4.534
  422   1HG   GLU  51          2HG       GLU  51  -1.355  -8.349  -6.526
  423   2HG   GLU  51          1HG       GLU  51   0.213  -8.469  -5.729
  424    H    ALA  52           H        ALA  52   0.095 -11.239  -2.243
  425    HA   ALA  52           HA       ALA  52   1.549  -8.830  -1.707
  426   1HB   ALA  52          1HB       ALA  52   0.883 -11.129   0.131
  427   2HB   ALA  52          2HB       ALA  52  -0.113  -9.697  -0.128
  428   3HB   ALA  52          3HB       ALA  52   1.475  -9.543   0.622
  429    H    THR  53           H        THR  53   3.665  -8.589  -1.241
  430    HA   THR  53           HA       THR  53   5.366 -10.965  -1.574
  431    HB   THR  53           HB       THR  53   5.774  -9.323  -3.307
  432    HG1  THR  53           1HG      THR  53   7.976  -9.192  -3.052
  433   1HG2  THR  53          1HG2      THR  53   6.367  -7.379  -1.077
  434   2HG2  THR  53          2HG2      THR  53   4.986  -7.314  -2.172
  435   3HG2  THR  53          3HG2      THR  53   6.619  -7.077  -2.797
  436    H    GLU  54           H        GLU  54   7.390 -10.934  -0.341
  437    HA   GLU  54           HA       GLU  54   6.843 -10.466   2.423
  438   1HB   GLU  54          2HB       GLU  54   9.390 -11.301   1.022
  439   2HB   GLU  54          1HB       GLU  54   9.210 -11.220   2.768
  440   1HG   GLU  54          2HG       GLU  54   8.947 -13.479   2.183
  441   2HG   GLU  54          1HG       GLU  54   7.329 -12.878   2.535
  442    H    TRP  55           H        TRP  55   7.237  -8.708   3.592
  443    HA   TRP  55           HA       TRP  55   9.190  -6.746   2.646
  444   1HB   TRP  55          2HB       TRP  55   6.906  -6.177   1.729
  445   2HB   TRP  55          1HB       TRP  55   6.356  -5.983   3.389
  446    HD1  TRP  55           HD       TRP  55   6.853  -3.707   4.556
  447    HE1  TRP  55           1HE      TRP  55   7.977  -1.518   3.804
  448    HE3  TRP  55           3HE      TRP  55   8.882  -5.317   0.157
  449    HZ2  TRP  55           2HZ      TRP  55   9.521  -0.596   1.630
  450    HZ3  TRP  55           3HZ      TRP  55  10.171  -3.720  -1.200
  451    HH2  TRP  55           HH       TRP  55  10.483  -1.408  -0.479
  452    H    THR  56           H        THR  56   9.913  -5.333   4.275
  453    HA   THR  56           HA       THR  56  10.536  -4.704   6.346
  454    HB   THR  56           HB       THR  56   8.137  -6.228   7.330
  455    HG1  THR  56           1HG      THR  56   7.252  -4.630   6.199
  456   1HG2  THR  56          1HG2      THR  56   9.750  -5.813   9.112
  457   2HG2  THR  56          2HG2      THR  56   8.330  -4.791   9.325
  458   3HG2  THR  56          3HG2      THR  56   9.817  -4.107   8.670
  459    HA   PRO  57           HA       PRO  57  12.636  -8.702   6.972
  460   1HB   PRO  57          2HB       PRO  57  15.106  -7.224   6.871
  461   2HB   PRO  57          1HB       PRO  57  14.496  -8.407   5.714
  462   1HG   PRO  57          2HG       PRO  57  14.780  -5.727   5.179
  463   2HG   PRO  57          1HG       PRO  57  13.648  -6.798   4.334
  464   1HD   PRO  57          2HD       PRO  57  13.133  -4.865   6.559
  465   2HD   PRO  57          1HD       PRO  57  12.142  -5.229   5.129
  466    H    ASN  58           H        ASN  58  13.720  -9.448   8.805
  467    HA   ASN  58           HA       ASN  58  13.611  -7.648  11.100
  468   1HB   ASN  58          2HB       ASN  58  12.532  -9.843  11.331
  469   2HB   ASN  58          1HB       ASN  58  14.056 -10.644  10.957
  470   1HD2  ASN  58          1HD2      ASN  58  14.243 -11.721  12.882
  471   2HD2  ASN  58          2HD2      ASN  58  14.535 -10.925  14.387
  472    H    ASN  59           H        ASN  59  15.400  -6.657  11.801
  473    HA   ASN  59           HA       ASN  59  18.008  -7.386  10.902
  474   1HB   ASN  59          2HB       ASN  59  17.470  -5.067  11.529
  475   2HB   ASN  59          1HB       ASN  59  17.193  -5.571  13.192
  476   1HD2  ASN  59          1HD2      ASN  59  19.592  -5.103  10.700
  477   2HD2  ASN  59          2HD2      ASN  59  20.961  -5.074  11.754
  478    H    LEU  60           H        LEU  60  18.360  -9.482  11.405
  479    HA   LEU  60           HA       LEU  60  17.772 -10.575  13.958
  480   1HB   LEU  60          2HB       LEU  60  19.100 -12.562  13.034
  481   2HB   LEU  60          1HB       LEU  60  17.594 -12.126  12.256
  482    HG   LEU  60           HG       LEU  60  19.005 -10.870  10.541
  483   1HD1  LEU  60          1HD1      LEU  60  21.191 -12.534  11.776
  484   2HD1  LEU  60          2HD1      LEU  60  21.088 -10.774  11.800
  485   3HD1  LEU  60          3HD1      LEU  60  21.308 -11.624  10.270
  486   1HD2  LEU  60          1HD2      LEU  60  17.896 -12.972  10.059
  487   2HD2  LEU  60          2HD2      LEU  60  19.252 -13.863  10.752
  488   3HD2  LEU  60          3HD2      LEU  60  19.479 -12.911   9.284
  489    H    GLU  61           H        GLU  61  19.259 -11.590  15.371
  490    HA   GLU  61           HA       GLU  61  21.369  -9.789  16.073
  491   1HB   GLU  61          2HB       GLU  61  21.678 -11.421  17.995
  492   2HB   GLU  61          1HB       GLU  61  20.109 -10.639  17.885
  493   1HG   GLU  61          2HG       GLU  61  20.450 -13.278  16.577
  494   2HG   GLU  61          1HG       GLU  61  20.353 -13.223  18.336