*HEADER    STRUCTURAL GENOMICS, UNKNOWN FUNCTION   13-APR-09   2KHV              
*TITLE     SOLUTION NMR STRUCTURE OF PROTEIN NMUL_A0922 FROM                     
*TITLE    2 NITROSOSPIRA MULTIFORMIS. NORTHEAST STRUCTURAL GENOMICS              
*TITLE    3 CONSORTIUM TARGET NMR38B.                                            
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PHAGE INTEGRASE;                                           
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 102-199;                                      
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: NITROSOSPIRA MULTIFORMIS ATCC 25196;            
*SOURCE   3 ORGANISM_TAXID: 323848;                                              
*SOURCE   4 STRAIN: NCIMB 11849;                                                 
*SOURCE   5 ATCC: 25196;                                                         
*SOURCE   6 GENE: NMUL_A0922;                                                    
*SOURCE   7 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   8 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   9 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)+MAGIC;                           
*SOURCE  10 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID                               
*KEYWDS    SOLUTION STRUCTURE, GFT, NMR, NESG, STRUCTURAL GENOMICS,              
*KEYWDS   2 UNKNOWN FUNCTION, PSI-2, PROTEIN STRUCTURE INITIATIVE,               
*KEYWDS   3 NORTHEAST STRUCTURAL GENOMICS CONSORTIUM                             
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    Y.WU, J.L.MILLS, D.WANG, C.CICCOSANTI, D.K.SUKUMARAN,                 
*AUTHOR   2 M.JIANG, E.GARCIA, R.NAIR, B.ROST, G.V.T.SWAPNA, T.B.ACTON,          
*AUTHOR   3 R.XIAO, J.EVERETT, G.T.MONTELIONE, T.SZYPERSKI, NORTHEAST            
*AUTHOR   4 STRUCTURAL GENOMICS CONSORTIUM (NESG)                                
*REVDAT   1   21-APR-09 2KHV    0                                                


assign ( resid    1 and name HB2  )   ( resid    2 and name HN   )   3.09  1.29  1.29
assign ( resid    1 and name HB1  )   ( resid    2 and name HN   )   3.09  1.29  1.29
assign ( resid    2 and name HB   )   ( resid    3 and name HN   )   2.51  0.72  0.72
assign ( resid    3 and name HN   )   ( resid    4 and name HN   )   2.76  0.97  0.97
assign ( resid    3 and name HB2  )   ( resid    4 and name HN   )   2.96  1.17  1.17
assign ( resid    3 and name HB1  )   ( resid    4 and name HN   )   2.96  1.17  1.17
assign ( resid    4 and name HN   )   ( resid    5 and name HN   )   2.73  0.93  0.93
assign ( resid    5 and name HB2  )   ( resid    6 and name HN   )   2.67  0.88  0.88
assign ( resid    6 and name HB2  )   ( resid    7 and name HN   )   2.64  0.84  0.84
assign ( resid    9 and name HN   )   ( resid   10 and name HN   )   2.60  0.81  0.81
assign ( resid    9 and name HB2  )   ( resid   10 and name HN   )   2.71  0.91  0.91
assign ( resid    9 and name HB1  )   ( resid   10 and name HN   )   2.80  1.00  1.00
assign ( resid   10 and name HB2  )   ( resid   11 and name HN   )   2.76  0.97  0.97
assign ( resid   10 and name HB1  )   ( resid   11 and name HN   )   2.76  0.97  0.97
assign ( resid   11 and name HN   )   ( resid   12 and name HN   )   2.66  0.86  0.86
assign ( resid   12 and name HB*  )   ( resid   13 and name HN   )   3.13  1.34  1.34
assign ( resid   13 and name HN   )   ( resid   14 and name HN   )   2.58  0.79  0.79
assign ( resid   16 and name HB2  )   ( resid   17 and name HN   )   2.89  1.09  1.09
assign ( resid   16 and name HB1  )   ( resid   17 and name HN   )   2.89  1.09  1.09
assign ( resid   19 and name HN   )   ( resid   20 and name HN   )   2.98  1.18  1.18
assign ( resid   20 and name HA   )   ( resid   21 and name HN   )   2.51  0.72  0.72
assign ( resid   21 and name HA   )   ( resid   22 and name HN   )   2.66  0.86  0.86
assign ( resid   21 and name HB   )   ( resid   22 and name HN   )   2.49  0.70  0.70
assign ( resid   22 and name HN   )   ( resid   23 and name HN   )   2.60  0.81  0.81
assign ( resid   22 and name HA   )   ( resid   23 and name HN   )   2.66  0.86  0.86
assign ( resid   22 and name HB2  )   ( resid   23 and name HN   )   3.00  1.20  1.20
assign ( resid   22 and name HB1  )   ( resid   23 and name HN   )   3.00  1.20  1.20
assign ( resid   23 and name HB2  )   ( resid   24 and name HN   )   3.39  1.60  1.60
assign ( resid   23 and name HB1  )   ( resid   24 and name HN   )   3.39  1.60  1.60
assign ( resid   24 and name HN   )   ( resid   25 and name HN   )   2.60  0.81  0.81
assign ( resid   25 and name HN   )   ( resid   26 and name HN   )   2.51  0.72  0.72
assign ( resid   25 and name HB2  )   ( resid   26 and name HN   )   2.76  0.97  0.97
assign ( resid   25 and name HB1  )   ( resid   26 and name HN   )   2.76  0.97  0.97
assign ( resid   26 and name HB2  )   ( resid   27 and name HN   )   2.93  1.13  1.13
assign ( resid   27 and name HN   )   ( resid   28 and name HN   )   2.67  0.88  0.88
assign ( resid   27 and name HB1  )   ( resid   28 and name HN   )   2.85  1.06  1.06
assign ( resid   27 and name HB2  )   ( resid   28 and name HN   )   2.75  0.95  0.95
assign ( resid   28 and name HB   )   ( resid   29 and name HN   )   2.48  0.68  0.68
assign ( resid   29 and name HN   )   ( resid   30 and name HN   )   2.60  0.81  0.81
assign ( resid   29 and name HB2  )   ( resid   30 and name HN   )   2.78  0.99  0.99
assign ( resid   29 and name HB1  )   ( resid   30 and name HN   )   2.78  0.99  0.99
assign ( resid   31 and name HB   )   ( resid   32 and name HN   )   2.57  0.77  0.77
assign ( resid   32 and name HN   )   ( resid   33 and name HN   )   2.62  0.82  0.82
assign ( resid   32 and name HB2  )   ( resid   33 and name HN   )   2.82  1.02  1.02
assign ( resid   32 and name HB1  )   ( resid   33 and name HN   )   2.82  1.02  1.02
assign ( resid   33 and name HN   )   ( resid   34 and name HN   )   2.49  0.70  0.70
assign ( resid   34 and name HN   )   ( resid   35 and name HN   )   2.48  0.68  0.68
assign ( resid   34 and name HB1  )   ( resid   35 and name HN   )   3.00  1.20  1.20
assign ( resid   34 and name HB2  )   ( resid   35 and name HN   )   2.82  1.02  1.02
assign ( resid   35 and name HN   )   ( resid   36 and name HN   )   2.73  0.93  0.93
assign ( resid   35 and name HB1  )   ( resid   36 and name HN   )   3.11  1.31  1.31
assign ( resid   39 and name HN   )   ( resid   40 and name HN   )   2.58  0.79  0.79
assign ( resid   39 and name HB   )   ( resid   40 and name HN   )   3.23  1.44  1.44
assign ( resid   42 and name HB2  )   ( resid   43 and name HN   )   2.91  1.11  1.11
assign ( resid   42 and name HB1  )   ( resid   43 and name HN   )   2.64  0.84  0.84
assign ( resid   43 and name HB1  )   ( resid   44 and name HN   )   3.03  1.24  1.24
assign ( resid   44 and name HN   )   ( resid   45 and name HN   )   2.76  0.97  0.97
assign ( resid   44 and name HB   )   ( resid   45 and name HN   )   3.12  1.33  1.33
assign ( resid   45 and name HN   )   ( resid   46 and name HN   )   2.58  0.79  0.79
assign ( resid   45 and name HB2  )   ( resid   46 and name HN   )   3.07  1.27  1.27
assign ( resid   45 and name HB1  )   ( resid   46 and name HN   )   3.07  1.27  1.27
assign ( resid   46 and name HN   )   ( resid   47 and name HN   )   2.44  0.64  0.64
assign ( resid   46 and name HB2  )   ( resid   47 and name HN   )   3.36  1.56  1.56
assign ( resid   46 and name HB1  )   ( resid   47 and name HN   )   3.36  1.56  1.56
assign ( resid   47 and name HN   )   ( resid   48 and name HN   )   3.47  1.67  1.67
assign ( resid   47 and name HB   )   ( resid   48 and name HN   )   3.27  1.47  1.47
assign ( resid   48 and name HA   )   ( resid   49 and name HN   )   2.58  0.79  0.79
assign ( resid   48 and name HB2  )   ( resid   49 and name HN   )   2.66  0.86  0.86
assign ( resid   49 and name HN   )   ( resid   50 and name HN   )   2.71  0.91  0.91
assign ( resid   50 and name HB1  )   ( resid   51 and name HN   )   2.73  0.93  0.93
assign ( resid   51 and name HN   )   ( resid   52 and name HN   )   2.57  0.77  0.77
assign ( resid   51 and name HB2  )   ( resid   52 and name HN   )   2.66  0.86  0.86
assign ( resid   51 and name HB1  )   ( resid   52 and name HN   )   3.02  1.22  1.22
assign ( resid   52 and name HB   )   ( resid   53 and name HN   )   2.53  0.73  0.73
assign ( resid   56 and name HB2  )   ( resid   57 and name HN   )   2.85  1.06  1.06
assign ( resid   56 and name HB1  )   ( resid   57 and name HN   )   3.39  1.60  1.60
assign ( resid   59 and name HN   )   ( resid   60 and name HN   )   2.46  0.66  0.66
assign ( resid   62 and name HN   )   ( resid   63 and name HN   )   2.37  0.57  0.57
assign ( resid   62 and name HB1  )   ( resid   63 and name HN   )   2.84  1.04  1.04
assign ( resid   64 and name HB2  )   ( resid   65 and name HN   )   2.64  0.84  0.84
assign ( resid   65 and name HN   )   ( resid   66 and name HN   )   2.46  0.66  0.66
assign ( resid   65 and name HB2  )   ( resid   66 and name HN   )   2.84  1.04  1.04
assign ( resid   65 and name HB1  )   ( resid   66 and name HN   )   2.84  1.04  1.04
assign ( resid   66 and name HA   )   ( resid   67 and name HN   )   2.64  0.84  0.84
assign ( resid   69 and name HN   )   ( resid   70 and name HN   )   2.58  0.79  0.79
assign ( resid   69 and name HB1  )   ( resid   70 and name HN   )   2.84  1.04  1.04
assign ( resid   70 and name HB2  )   ( resid   71 and name HN   )   2.98  1.18  1.18
assign ( resid   70 and name HB1  )   ( resid   71 and name HN   )   2.67  0.88  0.88
assign ( resid   71 and name HN   )   ( resid   72 and name HN   )   2.71  0.91  0.91
assign ( resid   71 and name HB2  )   ( resid   72 and name HN   )   2.84  1.04  1.04
assign ( resid   71 and name HB1  )   ( resid   72 and name HN   )   2.84  1.04  1.04
assign ( resid   73 and name HB2  )   ( resid   74 and name HN   )   3.05  1.26  1.26
assign ( resid   73 and name HB1  )   ( resid   74 and name HN   )   3.05  1.26  1.26
assign ( resid   74 and name HB   )   ( resid   75 and name HN   )   2.58  0.79  0.79
assign ( resid   75 and name HN   )   ( resid   76 and name HN   )   2.71  0.91  0.91
assign ( resid   75 and name HB2  )   ( resid   76 and name HN   )   2.75  0.95  0.95
assign ( resid   75 and name HB1  )   ( resid   76 and name HN   )   2.75  0.95  0.95
assign ( resid   76 and name HB2  )   ( resid   77 and name HN   )   3.02  1.22  1.22
assign ( resid   76 and name HB1  )   ( resid   77 and name HN   )   3.02  1.22  1.22
assign ( resid   78 and name HN   )   ( resid   79 and name HN   )   2.71  0.91  0.91
assign ( resid   78 and name HB2  )   ( resid   79 and name HN   )   2.75  0.95  0.95
assign ( resid   78 and name HB1  )   ( resid   79 and name HN   )   3.12  1.33  1.33
assign ( resid   80 and name HB1  )   ( resid   81 and name HN   )   2.73  0.93  0.93
assign ( resid   80 and name HB2  )   ( resid   81 and name HN   )   3.00  1.20  1.20
assign ( resid   81 and name HN   )   ( resid   82 and name HN   )   2.73  0.93  0.93
assign ( resid   82 and name HB   )   ( resid   83 and name HN   )   2.55  0.75  0.75
assign ( resid   83 and name HN   )   ( resid   84 and name HN   )   2.57  0.77  0.77
assign ( resid   84 and name HN   )   ( resid   85 and name HN   )   2.60  0.81  0.81
assign ( resid   84 and name HB2  )   ( resid   85 and name HN   )   3.20  1.40  1.40
assign ( resid   84 and name HB1  )   ( resid   85 and name HN   )   3.16  1.36  1.36
assign ( resid   86 and name HB2  )   ( resid   87 and name HN   )   2.98  1.18  1.18
assign ( resid   86 and name HB1  )   ( resid   87 and name HN   )   3.21  1.42  1.42
assign ( resid   87 and name HB2  )   ( resid   88 and name HN   )   2.91  1.11  1.11
assign ( resid   87 and name HB1  )   ( resid   88 and name HN   )   2.91  1.11  1.11
assign ( resid   88 and name HN   )   ( resid   89 and name HN   )   3.23  1.44  1.44
assign ( resid   88 and name HA   )   ( resid   89 and name HN   )   2.31  0.52  0.52
assign ( resid   88 and name HB1  )   ( resid   89 and name HN   )   2.75  0.95  0.95
assign ( resid   89 and name HA2  )   ( resid   90 and name HN   )   2.53  0.73  0.73
assign ( resid   90 and name HB2  )   ( resid   91 and name HN   )   2.93  1.13  1.13
assign ( resid   93 and name HN   )   ( resid   94 and name HN   )   2.49  0.70  0.70
assign ( resid   95 and name HN   )   ( resid   96 and name HN   )   3.30  1.51  1.51
assign ( resid   97 and name HN   )   ( resid   98 and name HN   )   2.67  0.88  0.88
assign ( resid   98 and name HB2  )   ( resid   99 and name HN   )   3.00  1.20  1.20
assign ( resid   98 and name HB1  )   ( resid   99 and name HN   )   3.00  1.20  1.20
assign ( resid   99 and name HN   )   ( resid  100 and name HN   )   2.58  0.79  0.79
assign ( resid    3 and name HN   )   ( resid    3 and name HB2  )   2.60  0.81  0.81
assign ( resid    3 and name HN   )   ( resid    3 and name HB1  )   2.60  0.81  0.81
assign ( resid    5 and name HN   )   ( resid    5 and name HB2  )   2.49  0.70  0.70
assign ( resid    9 and name HN   )   ( resid    9 and name HB2  )   2.48  0.68  0.68
assign ( resid   10 and name HN   )   ( resid   10 and name HB2  )   2.66  0.86  0.86
assign ( resid   10 and name HN   )   ( resid   10 and name HB1  )   2.66  0.86  0.86
assign ( resid   11 and name HN   )   ( resid   11 and name HB   )   2.42  0.63  0.63
assign ( resid   14 and name HN   )   ( resid   14 and name HB2  )   2.94  1.15  1.15
assign ( resid   14 and name HN   )   ( resid   14 and name HB1  )   2.94  1.15  1.15
assign ( resid   15 and name HN   )   ( resid   15 and name HB1  )   2.69  0.90  0.90
assign ( resid   17 and name HN   )   ( resid   17 and name HB2  )   2.64  0.84  0.84
assign ( resid   22 and name HN   )   ( resid   22 and name HB1  )   2.71  0.91  0.91
assign ( resid   23 and name HN   )   ( resid   23 and name HB2  )   2.71  0.91  0.91
assign ( resid   23 and name HN   )   ( resid   23 and name HB1  )   2.71  0.91  0.91
assign ( resid   26 and name HN   )   ( resid   26 and name HB2  )   2.48  0.68  0.68
assign ( resid   26 and name HN   )   ( resid   26 and name HB1  )   2.62  0.82  0.82
assign ( resid   27 and name HN   )   ( resid   27 and name HB2  )   2.67  0.88  0.88
assign ( resid   30 and name HN   )   ( resid   30 and name HB   )   2.69  0.90  0.90
assign ( resid   31 and name HN   )   ( resid   31 and name HB   )   2.42  0.63  0.63
assign ( resid   32 and name HN   )   ( resid   32 and name HB2  )   2.49  0.70  0.70
assign ( resid   32 and name HN   )   ( resid   32 and name HB1  )   2.49  0.70  0.70
assign ( resid   33 and name HN   )   ( resid   33 and name HB   )   2.49  0.70  0.70
assign ( resid   34 and name HN   )   ( resid   34 and name HB1  )   2.71  0.91  0.91
assign ( resid   34 and name HN   )   ( resid   34 and name HB2  )   2.57  0.77  0.77
assign ( resid   35 and name HN   )   ( resid   35 and name HB1  )   2.87  1.08  1.08
assign ( resid   35 and name HN   )   ( resid   35 and name HB2  )   2.64  0.84  0.84
assign ( resid   38 and name HN   )   ( resid   38 and name HB   )   2.55  0.75  0.75
assign ( resid   42 and name HN   )   ( resid   42 and name HB2  )   2.46  0.66  0.66
assign ( resid   45 and name HN   )   ( resid   45 and name HB2  )   2.58  0.79  0.79
assign ( resid   45 and name HN   )   ( resid   45 and name HB1  )   2.58  0.79  0.79
assign ( resid   46 and name HN   )   ( resid   46 and name HB2  )   2.66  0.86  0.86
assign ( resid   46 and name HN   )   ( resid   46 and name HB1  )   2.66  0.86  0.86
assign ( resid   47 and name HN   )   ( resid   47 and name HB   )   2.40  0.61  0.61
assign ( resid   50 and name HN   )   ( resid   50 and name HB1  )   2.49  0.70  0.70
assign ( resid   51 and name HN   )   ( resid   51 and name HB1  )   2.64  0.84  0.84
assign ( resid   52 and name HN   )   ( resid   52 and name HB   )   2.44  0.64  0.64
assign ( resid   55 and name HN   )   ( resid   55 and name HB   )   2.40  0.61  0.61
assign ( resid   56 and name HN   )   ( resid   56 and name HB2  )   2.49  0.70  0.70
assign ( resid   56 and name HN   )   ( resid   56 and name HB1  )   2.89  1.09  1.09
assign ( resid   57 and name HN   )   ( resid   57 and name HB2  )   2.66  0.86  0.86
assign ( resid   63 and name HN   )   ( resid   63 and name HB1  )   2.84  1.04  1.04
assign ( resid   63 and name HN   )   ( resid   63 and name HB2  )   2.64  0.84  0.84
assign ( resid   69 and name HN   )   ( resid   69 and name HB1  )   2.60  0.81  0.81
assign ( resid   70 and name HN   )   ( resid   70 and name HB2  )   2.55  0.75  0.75
assign ( resid   70 and name HN   )   ( resid   70 and name HB1  )   2.53  0.73  0.73
assign ( resid   71 and name HN   )   ( resid   71 and name HB2  )   2.64  0.84  0.84
assign ( resid   71 and name HN   )   ( resid   71 and name HB1  )   2.64  0.84  0.84
assign ( resid   73 and name HN   )   ( resid   73 and name HB2  )   2.82  1.02  1.02
assign ( resid   73 and name HN   )   ( resid   73 and name HB1  )   2.82  1.02  1.02
assign ( resid   74 and name HN   )   ( resid   74 and name HB   )   2.51  0.72  0.72
assign ( resid   75 and name HN   )   ( resid   75 and name HB2  )   2.71  0.91  0.91
assign ( resid   75 and name HN   )   ( resid   75 and name HB1  )   2.71  0.91  0.91
assign ( resid   76 and name HN   )   ( resid   76 and name HB2  )   2.76  0.97  0.97
assign ( resid   76 and name HN   )   ( resid   76 and name HB1  )   2.76  0.97  0.97
assign ( resid   77 and name HN   )   ( resid   77 and name HB   )   2.46  0.66  0.66
assign ( resid   78 and name HN   )   ( resid   78 and name HB2  )   2.51  0.72  0.72
assign ( resid   78 and name HN   )   ( resid   78 and name HB1  )   2.78  0.99  0.99
assign ( resid   80 and name HN   )   ( resid   80 and name HB1  )   2.49  0.70  0.70
assign ( resid   80 and name HN   )   ( resid   80 and name HB2  )   2.49  0.70  0.70
assign ( resid   83 and name HN   )   ( resid   83 and name HB   )   2.46  0.66  0.66
assign ( resid   84 and name HN   )   ( resid   84 and name HB2  )   2.53  0.73  0.73
assign ( resid   84 and name HN   )   ( resid   84 and name HB1  )   2.73  0.93  0.93
assign ( resid   86 and name HN   )   ( resid   86 and name HB2  )   2.58  0.79  0.79
assign ( resid   86 and name HN   )   ( resid   86 and name HB1  )   2.76  0.97  0.97
assign ( resid   88 and name HN   )   ( resid   88 and name HB2  )   2.94  1.15  1.15
assign ( resid   88 and name HN   )   ( resid   88 and name HB1  )   2.94  1.15  1.15
assign ( resid   90 and name HN   )   ( resid   90 and name HB1  )   2.66  0.86  0.86
assign ( resid   91 and name HN   )   ( resid   91 and name HB2  )   2.57  0.77  0.77
assign ( resid   91 and name HN   )   ( resid   91 and name HB1  )   2.57  0.77  0.77
assign ( resid   96 and name HN   )   ( resid   96 and name HB2  )   2.66  0.86  0.86
assign ( resid   98 and name HN   )   ( resid   98 and name HB2  )   2.67  0.88  0.88
assign ( resid   98 and name HN   )   ( resid   98 and name HB1  )   2.67  0.88  0.88
assign ( resid   99 and name HN   )   ( resid   99 and name HB1  )   2.69  0.90  0.90
assign ( resid    5 and name HN   )   ( resid    6 and name HN   )   2.57  0.77  0.77
assign ( resid    6 and name HN   )   ( resid    7 and name HN   )   2.55  0.75  0.75
assign ( resid    7 and name HN   )   ( resid    8 and name HN   )   2.60  0.81  0.81
assign ( resid    8 and name HN   )   ( resid    9 and name HN   )   2.57  0.77  0.77
assign ( resid   10 and name HN   )   ( resid   11 and name HN   )   2.78  0.99  0.99
assign ( resid   12 and name HN   )   ( resid   13 and name HN   )   2.55  0.75  0.75
assign ( resid   14 and name HN   )   ( resid   15 and name HN   )   2.42  0.63  0.63
assign ( resid   15 and name HN   )   ( resid   16 and name HN   )   2.73  0.93  0.93
assign ( resid   16 and name HN   )   ( resid   17 and name HN   )   2.55  0.75  0.75
assign ( resid   18 and name HN   )   ( resid   19 and name HN   )   2.51  0.72  0.72
assign ( resid   20 and name HN   )   ( resid   21 and name HN   )   2.76  0.97  0.97
assign ( resid   23 and name HN   )   ( resid   24 and name HN   )   2.71  0.91  0.91
assign ( resid   26 and name HN   )   ( resid   27 and name HN   )   2.57  0.77  0.77
assign ( resid   28 and name HN   )   ( resid   29 and name HN   )   2.71  0.91  0.91
assign ( resid   30 and name HN   )   ( resid   31 and name HN   )   2.57  0.77  0.77
assign ( resid   31 and name HN   )   ( resid   32 and name HN   )   2.60  0.81  0.81
assign ( resid   38 and name HN   )   ( resid   39 and name HN   )   2.46  0.66  0.66
assign ( resid   42 and name HN   )   ( resid   43 and name HN   )   3.29  1.49  1.49
assign ( resid   48 and name HN   )   ( resid   49 and name HN   )   3.72  1.92  1.92
assign ( resid   50 and name HN   )   ( resid   51 and name HN   )   2.58  0.79  0.79
assign ( resid   52 and name HN   )   ( resid   53 and name HN   )   2.60  0.81  0.81
assign ( resid   53 and name HN   )   ( resid   54 and name HN   )   2.64  0.84  0.84
assign ( resid   55 and name HN   )   ( resid   56 and name HN   )   2.51  0.72  0.72
assign ( resid   56 and name HN   )   ( resid   57 and name HN   )   2.67  0.88  0.88
assign ( resid   60 and name HN   )   ( resid   61 and name HN   )   2.78  0.99  0.99
assign ( resid   61 and name HN   )   ( resid   62 and name HN   )   2.48  0.68  0.68
assign ( resid   66 and name HN   )   ( resid   67 and name HN   )   2.44  0.64  0.64
assign ( resid   72 and name HN   )   ( resid   73 and name HN   )   2.64  0.84  0.84
assign ( resid   73 and name HN   )   ( resid   74 and name HN   )   2.73  0.93  0.93
assign ( resid   74 and name HN   )   ( resid   75 and name HN   )   2.67  0.88  0.88
assign ( resid   76 and name HN   )   ( resid   77 and name HN   )   2.67  0.88  0.88
assign ( resid   77 and name HN   )   ( resid   78 and name HN   )   2.66  0.86  0.86
assign ( resid   79 and name HN   )   ( resid   80 and name HN   )   2.64  0.84  0.84
assign ( resid   80 and name HN   )   ( resid   81 and name HN   )   2.66  0.86  0.86
assign ( resid   85 and name HN   )   ( resid   86 and name HN   )   2.58  0.79  0.79
assign ( resid   86 and name HN   )   ( resid   87 and name HN   )   2.40  0.61  0.61
assign ( resid   87 and name HN   )   ( resid   88 and name HN   )   3.52  1.72  1.72
assign ( resid   90 and name HN   )   ( resid   91 and name HN   )   3.27  1.47  1.47
assign ( resid   96 and name HN   )   ( resid   97 and name HN   )   3.11  1.31  1.31
assign ( resid    2 and name HA   )   ( resid    4 and name HN   )   3.12  1.33  1.33
assign ( resid    4 and name HN   )   ( resid    6 and name HN   )   3.88  2.08  2.08
assign ( resid    4 and name HA   )   ( resid    6 and name HN   )   3.21  1.42  1.42
assign ( resid    3 and name HA   )   ( resid    6 and name HN   )   2.84  1.04  1.04
assign ( resid    4 and name HA   )   ( resid    7 and name HN   )   3.02  1.22  1.22
assign ( resid    3 and name HA   )   ( resid    7 and name HN   )   3.12  1.33  1.33
assign ( resid    6 and name HN   )   ( resid    8 and name HN   )   3.09  1.29  1.29
assign ( resid    5 and name HA   )   ( resid    8 and name HN   )   2.80  1.00  1.00
assign ( resid    8 and name HN   )   ( resid   10 and name HN   )   3.32  1.53  1.53
assign ( resid    7 and name HN   )   ( resid    9 and name HN   )   3.11  1.31  1.31
assign ( resid    6 and name HA   )   ( resid    9 and name HN   )   2.87  1.08  1.08
assign ( resid    9 and name HN   )   ( resid   11 and name HN   )   3.34  1.54  1.54
assign ( resid    7 and name HA   )   ( resid   10 and name HN   )   2.84  1.04  1.04
assign ( resid   10 and name HN   )   ( resid   12 and name HN   )   3.57  1.78  1.78
assign ( resid    8 and name HA   )   ( resid   11 and name HN   )   2.93  1.13  1.13
assign ( resid    7 and name HA   )   ( resid   11 and name HN   )   3.21  1.42  1.42
assign ( resid   11 and name HN   )   ( resid   13 and name HN   )   3.32  1.53  1.53
assign ( resid    9 and name HA   )   ( resid   12 and name HN   )   2.78  0.99  0.99
assign ( resid   10 and name HA   )   ( resid   13 and name HN   )   3.18  1.38  1.38
assign ( resid   13 and name HN   )   ( resid   15 and name HN   )   3.29  1.49  1.49
assign ( resid   12 and name HA   )   ( resid   14 and name HN   )   3.16  1.36  1.36
assign ( resid   12 and name HA   )   ( resid   15 and name HN   )   2.93  1.13  1.13
assign ( resid   14 and name HA   )   ( resid   16 and name HN   )   3.41  1.62  1.62
assign ( resid   25 and name HN   )   ( resid   27 and name HN   )   2.96  1.17  1.17
assign ( resid   26 and name HN   )   ( resid   28 and name HN   )   3.20  1.40  1.40
assign ( resid   25 and name HA   )   ( resid   29 and name HN   )   3.18  1.38  1.38
assign ( resid   29 and name HN   )   ( resid   31 and name HN   )   3.18  1.38  1.38
assign ( resid   28 and name HN   )   ( resid   30 and name HN   )   3.38  1.58  1.58
assign ( resid   31 and name HN   )   ( resid   33 and name HN   )   2.98  1.18  1.18
assign ( resid   30 and name HN   )   ( resid   32 and name HN   )   3.00  1.20  1.20
assign ( resid   31 and name HA   )   ( resid   33 and name HN   )   2.93  1.13  1.13
assign ( resid   30 and name HA   )   ( resid   33 and name HN   )   2.94  1.15  1.15
assign ( resid   30 and name HA   )   ( resid   34 and name HN   )   3.07  1.27  1.27
assign ( resid   49 and name HA   )   ( resid   52 and name HN   )   2.98  1.18  1.18
assign ( resid   50 and name HA   )   ( resid   53 and name HN   )   2.93  1.13  1.13
assign ( resid   52 and name HN   )   ( resid   54 and name HN   )   3.11  1.31  1.31
assign ( resid   53 and name HN   )   ( resid   55 and name HN   )   3.56  1.76  1.76
assign ( resid   52 and name HA   )   ( resid   55 and name HN   )   2.94  1.15  1.15
assign ( resid   65 and name HN   )   ( resid   67 and name HN   )   3.09  1.29  1.29
assign ( resid   65 and name HA   )   ( resid   67 and name HN   )   3.18  1.38  1.38
assign ( resid   66 and name HN   )   ( resid   68 and name HN   )   3.18  1.38  1.38
assign ( resid   65 and name HA   )   ( resid   68 and name HN   )   2.87  1.08  1.08
assign ( resid   69 and name HN   )   ( resid   71 and name HN   )   3.23  1.44  1.44
assign ( resid   67 and name HA   )   ( resid   70 and name HN   )   3.03  1.24  1.24
assign ( resid   69 and name HA   )   ( resid   71 and name HN   )   3.09  1.29  1.29
assign ( resid   70 and name HN   )   ( resid   72 and name HN   )   3.68  1.89  1.89
assign ( resid   71 and name HN   )   ( resid   73 and name HN   )   3.12  1.33  1.33
assign ( resid   70 and name HA   )   ( resid   73 and name HN   )   2.87  1.08  1.08
assign ( resid   80 and name HN   )   ( resid   82 and name HN   )   3.38  1.58  1.58
assign ( resid    3 and name HN   )   ( resid   40 and name HA2  )   3.29  1.49  1.49
assign ( resid    3 and name HN   )   ( resid   43 and name HA   )   3.05  1.26  1.26
assign ( resid    3 and name HN   )   ( resid   41 and name HA   )   3.11  1.31  1.31
assign ( resid    3 and name HN   )   ( resid   44 and name HN   )   3.20  1.40  1.40
assign ( resid    4 and name HN   )   ( resid   40 and name HA1  )   3.05  1.26  1.26
assign ( resid    2 and name HB   )   ( resid    5 and name HN   )   3.02  1.22  1.22
assign ( resid    2 and name HN   )   ( resid    5 and name HN   )   3.03  1.24  1.24
assign ( resid   12 and name HB*  )   ( resid   14 and name HN   )   3.78  1.98  1.98
assign ( resid   16 and name HA   )   ( resid   18 and name HN   )   3.09  1.29  1.29
assign ( resid   16 and name HN   )   ( resid   18 and name HN   )   3.20  1.40  1.40
assign ( resid   23 and name HN   )   ( resid   25 and name HN   )   3.18  1.38  1.38
assign ( resid   31 and name HA   )   ( resid   35 and name HN   )   2.66  0.86  0.86
assign ( resid   34 and name HN   )   ( resid   36 and name HN   )   3.18  1.38  1.38
assign ( resid   38 and name HN   )   ( resid   40 and name HN   )   2.60  0.81  0.81
assign ( resid   35 and name HA   )   ( resid   39 and name HN   )   2.96  1.17  1.17
assign ( resid   38 and name HB   )   ( resid   40 and name HN   )   3.09  1.29  1.29
assign ( resid   40 and name HA2  )   ( resid   42 and name HN   )   3.36  1.56  1.56
assign ( resid   39 and name HA   )   ( resid   42 and name HN   )   3.09  1.29  1.29
assign ( resid    3 and name HN   )   ( resid   42 and name HN   )   3.16  1.36  1.36
assign ( resid   43 and name HN   )   ( resid   46 and name HB1  )   3.38  1.58  1.58
assign ( resid   43 and name HN   )   ( resid   46 and name HB2  )   3.38  1.58  1.58
assign ( resid    2 and name HA   )   ( resid   44 and name HN   )   2.69  0.90  0.90
assign ( resid   44 and name HN   )   ( resid   46 and name HN   )   3.50  1.71  1.71
assign ( resid   43 and name HB2  )   ( resid   45 and name HN   )   3.23  1.44  1.44
assign ( resid   43 and name HA   )   ( resid   45 and name HN   )   3.39  1.60  1.60
assign ( resid   45 and name HN   )   ( resid   47 and name HN   )   3.39  1.60  1.60
assign ( resid   44 and name HA   )   ( resid   47 and name HN   )   2.91  1.11  1.11
assign ( resid   45 and name HA   )   ( resid   47 and name HN   )   3.41  1.62  1.62
assign ( resid   48 and name HN   )   ( resid   51 and name HB2  )   2.58  0.79  0.79
assign ( resid   48 and name HN   )   ( resid   52 and name HN   )   3.14  1.35  1.35
assign ( resid   48 and name HB2  )   ( resid   50 and name HN   )   3.34  1.54  1.54
assign ( resid   48 and name HN   )   ( resid   51 and name HN   )   2.87  1.08  1.08
assign ( resid   55 and name HN   )   ( resid   57 and name HN   )   3.36  1.56  1.56
assign ( resid   56 and name HA   )   ( resid   59 and name HN   )   3.32  1.53  1.53
assign ( resid   58 and name HA   )   ( resid   61 and name HN   )   3.21  1.42  1.42
assign ( resid   59 and name HN   )   ( resid   61 and name HN   )   3.02  1.22  1.22
assign ( resid   59 and name HA   )   ( resid   63 and name HN   )   2.75  0.95  0.95
assign ( resid   61 and name HN   )   ( resid   63 and name HN   )   3.05  1.26  1.26
assign ( resid   63 and name HA   )   ( resid   65 and name HN   )   3.11  1.31  1.31
assign ( resid   63 and name HB2  )   ( resid   66 and name HN   )   2.93  1.13  1.13
assign ( resid   63 and name HB1  )   ( resid   66 and name HN   )   2.80  1.00  1.00
assign ( resid   63 and name HB2  )   ( resid   67 and name HN   )   3.05  1.26  1.26
assign ( resid   63 and name HB1  )   ( resid   67 and name HN   )   3.03  1.24  1.24
assign ( resid   71 and name HA   )   ( resid   74 and name HN   )   3.18  1.38  1.38
assign ( resid   71 and name HA   )   ( resid   75 and name HN   )   3.50  1.71  1.71
assign ( resid   73 and name HA   )   ( resid   76 and name HN   )   2.93  1.13  1.13
assign ( resid   74 and name HA   )   ( resid   77 and name HN   )   3.11  1.31  1.31
assign ( resid   74 and name HA   )   ( resid   78 and name HN   )   3.38  1.58  1.58
assign ( resid   75 and name HA   )   ( resid   78 and name HN   )   3.16  1.36  1.36
assign ( resid   76 and name HA   )   ( resid   79 and name HN   )   3.02  1.22  1.22
assign ( resid   75 and name HA   )   ( resid   79 and name HN   )   3.23  1.44  1.44
assign ( resid   77 and name HA   )   ( resid   80 and name HN   )   3.00  1.20  1.20
assign ( resid   77 and name HA   )   ( resid   81 and name HN   )   3.47  1.67  1.67
assign ( resid   78 and name HA   )   ( resid   81 and name HN   )   2.89  1.09  1.09
assign ( resid   81 and name HA   )   ( resid   84 and name HN   )   2.93  1.13  1.13
assign ( resid   84 and name HB1  )   ( resid   86 and name HN   )   3.29  1.49  1.49
assign ( resid   84 and name HB2  )   ( resid   86 and name HN   )   3.11  1.31  1.31
assign ( resid   82 and name HA   )   ( resid   86 and name HN   )   3.14  1.35  1.35
assign ( resid   84 and name HN   )   ( resid   86 and name HN   )   3.14  1.35  1.35
assign ( resid   94 and name HB1  )   ( resid   95 and name HN   )   2.93  1.13  1.13
assign ( resid   94 and name HB2  )   ( resid   95 and name HN   )   2.93  1.13  1.13
assign ( resid   21 and name HN   )   ( resid   22 and name HN   )   3.20  1.40  1.40
assign ( resid   44 and name HA   )   ( resid   46 and name HN   )   3.12  1.33  1.33
assign ( resid   35 and name HA   )   ( resid   38 and name HN   )   3.29  1.49  1.49
assign ( resid   43 and name HB1  )   ( resid   45 and name HN   )   3.23  1.44  1.44
assign ( resid   81 and name HA   )   ( resid   86 and name HN   )   3.11  1.31  1.31
assign ( resid   83 and name HN   )   ( resid   85 and name HN   )   3.21  1.42  1.42
assign ( resid   24 and name HN   )   ( resid   26 and name HN   )   3.18  1.38  1.38
assign ( resid    5 and name HG2  )   ( resid    6 and name HN   )   3.36  1.56  1.56
assign ( resid    5 and name HG1  )   ( resid    6 and name HN   )   3.36  1.56  1.56
assign ( resid    9 and name HG   )   ( resid   10 and name HN   )   3.41  1.62  1.62
assign ( resid   12 and name HG2  )   ( resid   13 and name HN   )   3.90  2.10  2.10
assign ( resid   12 and name HG1  )   ( resid   13 and name HN   )   3.90  2.10  2.10
assign ( resid   12 and name HD*  )   ( resid   13 and name HN   )   4.34  2.54  2.54
assign ( resid   15 and name HG2  )   ( resid   16 and name HN   )   3.39  1.60  1.60
assign ( resid   15 and name HG1  )   ( resid   16 and name HN   )   3.39  1.60  1.60
assign ( resid   22 and name HE*  )   ( resid   23 and name HN   )   4.34  2.54  2.54
assign ( resid   39 and name HG12 )   ( resid   40 and name HN   )   3.61  1.81  1.81
assign ( resid   39 and name HG11 )   ( resid   40 and name HN   )   3.61  1.81  1.81
assign ( resid   41 and name HG2  )   ( resid   42 and name HN   )   3.74  1.94  1.94
assign ( resid   41 and name HG1  )   ( resid   42 and name HN   )   3.74  1.94  1.94
assign ( resid   42 and name HG   )   ( resid   43 and name HN   )   3.48  1.69  1.69
assign ( resid   50 and name HG2  )   ( resid   51 and name HN   )   3.90  2.10  2.10
assign ( resid   50 and name HG1  )   ( resid   51 and name HN   )   3.90  2.10  2.10
assign ( resid   59 and name HG12 )   ( resid   60 and name HN   )   3.84  2.05  2.05
assign ( resid   59 and name HG11 )   ( resid   60 and name HN   )   3.84  2.05  2.05
assign ( resid   64 and name HD2  )   ( resid   65 and name HN   )   2.96  1.17  1.17
assign ( resid   88 and name HG*  )   ( resid   89 and name HN   )   4.30  2.51  2.51
assign ( resid   92 and name HG2  )   ( resid   93 and name HN   )   3.38  1.58  1.58
assign ( resid   92 and name HG1  )   ( resid   93 and name HN   )   3.38  1.58  1.58
assign ( resid    5 and name HN   )   ( resid    5 and name HG2  )   2.84  1.04  1.04
assign ( resid    5 and name HN   )   ( resid    5 and name HG1  )   2.84  1.04  1.04
assign ( resid   11 and name HN   )   ( resid   11 and name HG12 )   2.87  1.08  1.08
assign ( resid   11 and name HN   )   ( resid   11 and name HG11 )   2.87  1.08  1.08
assign ( resid   12 and name HN   )   ( resid   12 and name HG2  )   3.45  1.65  1.65
assign ( resid   12 and name HN   )   ( resid   12 and name HD*  )   4.07  2.27  2.27
assign ( resid   15 and name HN   )   ( resid   15 and name HG2  )   2.67  0.88  0.88
assign ( resid   15 and name HN   )   ( resid   15 and name HG1  )   2.67  0.88  0.88
assign ( resid   22 and name HN   )   ( resid   22 and name HG2  )   2.85  1.06  1.06
assign ( resid   26 and name HN   )   ( resid   26 and name HG2  )   2.71  0.91  0.91
assign ( resid   26 and name HN   )   ( resid   26 and name HG1  )   2.71  0.91  0.91
assign ( resid   31 and name HN   )   ( resid   31 and name HG12 )   2.66  0.86  0.86
assign ( resid   32 and name HN   )   ( resid   32 and name HG2  )   3.25  1.45  1.45
assign ( resid   32 and name HN   )   ( resid   32 and name HG1  )   3.25  1.45  1.45
assign ( resid   39 and name HN   )   ( resid   39 and name HG11 )   2.80  1.00  1.00
assign ( resid   42 and name HN   )   ( resid   42 and name HG   )   2.37  0.57  0.57
assign ( resid   45 and name HN   )   ( resid   45 and name HG2  )   3.43  1.63  1.63
assign ( resid   45 and name HN   )   ( resid   45 and name HG1  )   3.43  1.63  1.63
assign ( resid   50 and name HN   )   ( resid   50 and name HD*  )   4.28  2.49  2.49
assign ( resid   52 and name HN   )   ( resid   52 and name HG11 )   3.02  1.22  1.22
assign ( resid   53 and name HN   )   ( resid   53 and name HG1  )   2.85  1.06  1.06
assign ( resid   54 and name HN   )   ( resid   54 and name HG2  )   3.29  1.49  1.49
assign ( resid   54 and name HN   )   ( resid   54 and name HG1  )   3.29  1.49  1.49
assign ( resid   62 and name HN   )   ( resid   62 and name HG1  )   3.02  1.22  1.22
assign ( resid   63 and name HN   )   ( resid   63 and name HG1  )   3.25  1.45  1.45
assign ( resid   65 and name HN   )   ( resid   65 and name HG*  )   3.47  1.68  1.68
assign ( resid   69 and name HN   )   ( resid   69 and name HG2  )   2.94  1.15  1.15
assign ( resid   69 and name HN   )   ( resid   69 and name HG1  )   2.66  0.86  0.86
assign ( resid   70 and name HN   )   ( resid   70 and name HG   )   3.30  1.51  1.51
assign ( resid   71 and name HN   )   ( resid   71 and name HG2  )   3.54  1.74  1.74
assign ( resid   71 and name HN   )   ( resid   71 and name HG1  )   3.54  1.74  1.74
assign ( resid   73 and name HN   )   ( resid   73 and name HG1  )   2.96  1.17  1.17
assign ( resid   74 and name HN   )   ( resid   74 and name HG12 )   2.87  1.08  1.08
assign ( resid   74 and name HN   )   ( resid   74 and name HG11 )   2.87  1.08  1.08
assign ( resid   75 and name HN   )   ( resid   75 and name HG2  )   3.54  1.74  1.74
assign ( resid   75 and name HN   )   ( resid   75 and name HG1  )   3.54  1.74  1.74
assign ( resid   78 and name HN   )   ( resid   78 and name HG   )   2.40  0.61  0.61
assign ( resid   84 and name HN   )   ( resid   84 and name HG2  )   2.91  1.11  1.11
assign ( resid   84 and name HN   )   ( resid   84 and name HG1  )   2.91  1.11  1.11
assign ( resid   87 and name HN   )   ( resid   87 and name HG2  )   3.16  1.36  1.36
assign ( resid   87 and name HN   )   ( resid   87 and name HG1  )   3.16  1.36  1.36
assign ( resid   88 and name HN   )   ( resid   88 and name HG*  )   3.60  1.81  1.81
assign ( resid   96 and name HN   )   ( resid   96 and name HG2  )   3.12  1.33  1.33
assign ( resid   98 and name HN   )   ( resid   98 and name HE*  )   4.96  3.17  3.17
assign ( resid   99 and name HN   )   ( resid   99 and name HG   )   2.66  0.86  0.86
assign ( resid   45 and name HA   )   ( resid   45 and name HE21 )   3.77  1.98  1.98
assign ( resid   45 and name HB1  )   ( resid   45 and name HE21 )   4.78  2.98  2.98
assign ( resid   45 and name HA   )   ( resid   45 and name HE22 )   3.77  1.98  1.98
assign ( resid   45 and name HB1  )   ( resid   45 and name HE22 )   4.78  2.98  2.98
assign ( resid    3 and name HN   )   ( resid   42 and name HB2  )   3.90  2.10  2.10
assign ( resid    3 and name HN   )   ( resid   44 and name HB   )   3.83  2.03  2.03
assign ( resid    3 and name HD*  )   ( resid    4 and name HN   )   4.62  2.82  2.82
assign ( resid    7 and name HN   )   ( resid   44 and name HB   )   3.75  1.96  1.96
assign ( resid   10 and name HN   )   ( resid   80 and name HZ3  )   3.52  1.72  1.72
assign ( resid   10 and name HN   )   ( resid   80 and name HH2  )   3.84  2.05  2.05
assign ( resid   18 and name HN   )   ( resid   19 and name HD*  )   4.34  2.54  2.54
assign ( resid   18 and name HN   )   ( resid   19 and name HG*  )   4.34  2.54  2.54
assign ( resid   23 and name HN   )   ( resid   23 and name HD2  )   3.88  2.08  2.08
assign ( resid   27 and name HD1  )   ( resid   28 and name HN   )   3.79  1.99  1.99
assign ( resid   25 and name HB1  )   ( resid   29 and name HD21 )   4.63  2.84  2.84
assign ( resid   25 and name HB1  )   ( resid   29 and name HD22 )   4.63  2.84  2.84
assign ( resid   40 and name HN   )   ( resid   41 and name HD1  )   2.78  0.99  0.99
assign ( resid    3 and name HB1  )   ( resid   42 and name HN   )   3.90  2.10  2.10
assign ( resid    3 and name HB2  )   ( resid   42 and name HN   )   3.90  2.10  2.10
assign ( resid    2 and name HB   )   ( resid   42 and name HN   )   3.47  1.67  1.67
assign ( resid   45 and name HE22 )   ( resid   88 and name HN   )   3.45  1.65  1.65
assign ( resid   49 and name HN   )   ( resid   92 and name HB1  )   3.20  1.40  1.40
assign ( resid   49 and name HN   )   ( resid   92 and name HB2  )   3.12  1.33  1.33
assign ( resid   54 and name HN   )   ( resid   54 and name HD*  )   4.34  2.54  2.54
assign ( resid   56 and name HN   )   ( resid   56 and name HG   )   2.71  0.91  0.91
assign ( resid   57 and name HN   )   ( resid   58 and name HD1  )   2.80  1.00  1.00
assign ( resid   63 and name HN   )   ( resid   64 and name HD1  )   2.87  1.08  1.08
assign ( resid   27 and name HH2  )   ( resid   76 and name HN   )   3.90  2.10  2.10
assign ( resid   27 and name HZ3  )   ( resid   77 and name HN   )   3.90  2.10  2.10
assign ( resid   78 and name HN   )   ( resid   91 and name HD21 )   3.65  1.85  1.85
assign ( resid   79 and name HN   )   ( resid   91 and name HD22 )   3.21  1.42  1.42
assign ( resid   79 and name HN   )   ( resid   91 and name HD21 )   2.94  1.15  1.15
assign ( resid   10 and name HE*  )   ( resid   80 and name HN   )   4.96  3.17  3.17
assign ( resid   80 and name HE1  )   ( resid   84 and name HD1  )   3.90  2.10  2.10
assign ( resid   45 and name HE21 )   ( resid   88 and name HN   )   3.45  1.65  1.65
assign ( resid   78 and name HB2  )   ( resid   91 and name HD22 )   3.09  1.29  1.29
assign ( resid   78 and name HB1  )   ( resid   91 and name HD22 )   3.90  2.10  2.10
assign ( resid   78 and name HB2  )   ( resid   91 and name HD21 )   2.94  1.15  1.15
assign ( resid   75 and name HG1  )   ( resid   91 and name HD21 )   3.30  1.51  1.51
assign ( resid   75 and name HA   )   ( resid   91 and name HD22 )   3.02  1.22  1.22
assign ( resid   95 and name HE1  )   ( resid   98 and name HA   )   3.16  1.36  1.36
assign ( resid   14 and name HB2  )   ( resid   18 and name HE1  )   3.90  2.10  2.10
assign ( resid   14 and name HB1  )   ( resid   18 and name HE1  )   3.90  2.10  2.10
assign ( resid   18 and name HA   )   ( resid   18 and name HE1  )   3.79  1.99  1.99
assign ( resid   56 and name HB1  )   ( resid   60 and name HE1  )   3.48  1.69  1.69
assign ( resid   56 and name HB2  )   ( resid   60 and name HE1  )   3.63  1.83  1.83
assign ( resid    2 and name HG2* )   ( resid    3 and name HN   )   3.24  1.44  1.44
assign ( resid    7 and name HB*  )   ( resid    8 and name HN   )   2.82  1.03  1.03
assign ( resid    8 and name HB*  )   ( resid    9 and name HN   )   2.84  1.05  1.05
assign ( resid    9 and name HD1* )   ( resid   10 and name HN   )   3.94  2.14  2.14
assign ( resid    9 and name HD2* )   ( resid   10 and name HN   )   3.99  2.20  2.20
assign ( resid   11 and name HG2* )   ( resid   12 and name HN   )   3.00  1.21  1.21
assign ( resid   13 and name HB*  )   ( resid   14 and name HN   )   3.06  1.26  1.26
assign ( resid   24 and name HB*  )   ( resid   25 and name HN   )   2.79  0.99  0.99
assign ( resid   30 and name HG2* )   ( resid   31 and name HN   )   3.67  1.87  1.87
assign ( resid   31 and name HG2* )   ( resid   32 and name HN   )   3.16  1.37  1.37
assign ( resid   28 and name HG2* )   ( resid   32 and name HN   )   3.52  1.73  1.73
assign ( resid   31 and name HD1* )   ( resid   32 and name HN   )   4.08  2.29  2.29
assign ( resid   33 and name HG2* )   ( resid   34 and name HN   )   3.36  1.57  1.57
assign ( resid   39 and name HG2* )   ( resid   40 and name HN   )   3.74  1.95  1.95
assign ( resid   42 and name HD2* )   ( resid   43 and name HN   )   3.29  1.50  1.50
assign ( resid   42 and name HD1* )   ( resid   43 and name HN   )   3.87  2.07  2.07
assign ( resid   44 and name HG1* )   ( resid   45 and name HN   )   3.02  1.23  1.23
assign ( resid   44 and name HG2* )   ( resid   45 and name HN   )   3.54  1.75  1.75
assign ( resid   47 and name HG1* )   ( resid   48 and name HN   )   2.99  1.19  1.19
assign ( resid   49 and name HG2* )   ( resid   50 and name HN   )   3.38  1.59  1.59
assign ( resid   51 and name HD1* )   ( resid   52 and name HN   )   4.01  2.22  2.22
assign ( resid   51 and name HD2* )   ( resid   52 and name HN   )   4.06  2.27  2.27
assign ( resid   52 and name HG2* )   ( resid   53 and name HN   )   3.27  1.48  1.48
assign ( resid   55 and name HG1* )   ( resid   56 and name HN   )   3.38  1.59  1.59
assign ( resid   55 and name HG2* )   ( resid   56 and name HN   )   3.40  1.60  1.60
assign ( resid   59 and name HG2* )   ( resid   60 and name HN   )   3.58  1.78  1.78
assign ( resid   59 and name HD1* )   ( resid   60 and name HN   )   4.41  2.61  2.61
assign ( resid   66 and name HG2* )   ( resid   67 and name HN   )   3.31  1.51  1.51
assign ( resid   67 and name HB*  )   ( resid   68 and name HN   )   2.89  1.10  1.10
assign ( resid   70 and name HD2* )   ( resid   71 and name HN   )   3.72  1.93  1.93
assign ( resid   74 and name HN   )   ( resid   93 and name HB*  )   3.52  1.73  1.73
assign ( resid   74 and name HG2* )   ( resid   75 and name HN   )   3.34  1.55  1.55
assign ( resid   74 and name HD1* )   ( resid   75 and name HN   )   3.90  2.11  2.11
assign ( resid   77 and name HG2* )   ( resid   78 and name HN   )   3.43  1.64  1.64
assign ( resid   77 and name HG1* )   ( resid   78 and name HN   )   3.49  1.69  1.69
assign ( resid   78 and name HD2* )   ( resid   79 and name HN   )   4.41  2.61  2.61
assign ( resid   78 and name HD1* )   ( resid   79 and name HN   )   4.19  2.40  2.40
assign ( resid   81 and name HB*  )   ( resid   82 and name HN   )   2.98  1.19  1.19
assign ( resid   82 and name HG2* )   ( resid   83 and name HN   )   3.38  1.59  1.59
assign ( resid   83 and name HG1* )   ( resid   84 and name HN   )   3.40  1.60  1.60
assign ( resid    2 and name HN   )   ( resid    2 and name HG2* )   2.71  0.92  0.92
assign ( resid    7 and name HN   )   ( resid    7 and name HB*  )   2.61  0.81  0.81
assign ( resid    9 and name HN   )   ( resid    9 and name HD1* )   3.45  1.66  1.66
assign ( resid    9 and name HN   )   ( resid    9 and name HD2* )   3.13  1.33  1.33
assign ( resid   11 and name HN   )   ( resid   11 and name HD1* )   3.18  1.39  1.39
assign ( resid   13 and name HN   )   ( resid   13 and name HB*  )   2.62  0.83  0.83
assign ( resid   31 and name HN   )   ( resid   31 and name HG2* )   3.24  1.44  1.44
assign ( resid   33 and name HN   )   ( resid   33 and name HG2* )   3.22  1.42  1.42
assign ( resid   38 and name HN   )   ( resid   38 and name HG2* )   2.80  1.01  1.01
assign ( resid   39 and name HN   )   ( resid   39 and name HG2* )   3.09  1.30  1.30
assign ( resid   42 and name HN   )   ( resid   42 and name HD2* )   3.18  1.39  1.39
assign ( resid   42 and name HN   )   ( resid   42 and name HD1* )   3.26  1.46  1.46
assign ( resid   47 and name HN   )   ( resid   47 and name HG2* )   2.68  0.88  0.88
assign ( resid   51 and name HN   )   ( resid   51 and name HD1* )   3.54  1.75  1.75
assign ( resid   51 and name HN   )   ( resid   51 and name HD2* )   3.25  1.46  1.46
assign ( resid   52 and name HN   )   ( resid   52 and name HG2* )   3.20  1.41  1.41
assign ( resid   52 and name HN   )   ( resid   52 and name HD1* )   3.33  1.53  1.53
assign ( resid   53 and name HN   )   ( resid   53 and name HE*  )   4.15  2.36  2.36
assign ( resid   55 and name HN   )   ( resid   55 and name HG1* )   3.08  1.28  1.28
assign ( resid   55 and name HN   )   ( resid   55 and name HG2* )   2.70  0.90  0.90
assign ( resid   56 and name HN   )   ( resid   56 and name HD2* )   3.29  1.50  1.50
assign ( resid   59 and name HN   )   ( resid   59 and name HG2* )   3.25  1.46  1.46
assign ( resid   59 and name HN   )   ( resid   59 and name HD1* )   3.56  1.77  1.77
assign ( resid   66 and name HN   )   ( resid   66 and name HG2* )   3.31  1.51  1.51
assign ( resid   67 and name HN   )   ( resid   67 and name HB*  )   2.68  0.88  0.88
assign ( resid   70 and name HN   )   ( resid   70 and name HD1* )   3.51  1.71  1.71
assign ( resid   70 and name HN   )   ( resid   70 and name HD2* )   3.63  1.84  1.84
assign ( resid   74 and name HN   )   ( resid   74 and name HG2* )   3.13  1.33  1.33
assign ( resid   74 and name HN   )   ( resid   74 and name HD1* )   3.08  1.28  1.28
assign ( resid   77 and name HN   )   ( resid   77 and name HG1* )   3.24  1.44  1.44
assign ( resid   78 and name HN   )   ( resid   78 and name HD2* )   3.34  1.55  1.55
assign ( resid   78 and name HN   )   ( resid   78 and name HD1* )   3.63  1.84  1.84
assign ( resid   81 and name HN   )   ( resid   81 and name HB*  )   2.70  0.90  0.90
assign ( resid   83 and name HN   )   ( resid   83 and name HG1* )   3.18  1.39  1.39
assign ( resid   99 and name HN   )   ( resid   99 and name HD1* )   3.65  1.86  1.86
assign ( resid    3 and name HN   )   ( resid   47 and name HG2* )   3.47  1.68  1.68
assign ( resid    2 and name HG2* )   ( resid    4 and name HN   )   3.74  1.95  1.95
assign ( resid    4 and name HN   )   ( resid   31 and name HG2* )   4.41  2.61  2.61
assign ( resid    2 and name HG2* )   ( resid    5 and name HN   )   3.67  1.87  1.87
assign ( resid    6 and name HN   )   ( resid   44 and name HG2* )   3.81  2.02  2.02
assign ( resid    7 and name HN   )   ( resid   77 and name HG1* )   3.33  1.53  1.53
assign ( resid    8 and name HN   )   ( resid   11 and name HD1* )   3.51  1.71  1.71
assign ( resid    8 and name HB*  )   ( resid   10 and name HN   )   4.03  2.23  2.23
assign ( resid    7 and name HB*  )   ( resid   10 and name HN   )   3.99  2.20  2.20
assign ( resid   10 and name HN   )   ( resid   77 and name HG1* )   3.80  2.00  2.00
assign ( resid    8 and name HB*  )   ( resid   11 and name HN   )   4.26  2.47  2.47
assign ( resid   11 and name HG2* )   ( resid   13 and name HN   )   3.96  2.16  2.16
assign ( resid   11 and name HG2* )   ( resid   15 and name HN   )   4.12  2.32  2.32
assign ( resid   23 and name HN   )   ( resid   24 and name HB*  )   3.81  2.02  2.02
assign ( resid   21 and name HG2* )   ( resid   23 and name HN   )   3.90  2.11  2.11
assign ( resid   24 and name HB*  )   ( resid   26 and name HN   )   4.10  2.31  2.31
assign ( resid   11 and name HD1* )   ( resid   28 and name HN   )   3.51  1.71  1.71
assign ( resid   24 and name HB*  )   ( resid   28 and name HN   )   4.41  2.61  2.61
assign ( resid   28 and name HG2* )   ( resid   30 and name HN   )   3.83  2.04  2.04
assign ( resid   31 and name HG2* )   ( resid   35 and name HN   )   3.42  1.62  1.62
assign ( resid   35 and name HN   )   ( resid   55 and name HG1* )   3.53  1.73  1.73
assign ( resid   35 and name HN   )   ( resid   70 and name HD1* )   3.71  1.91  1.91
assign ( resid   35 and name HN   )   ( resid   70 and name HD2* )   3.67  1.87  1.87
assign ( resid   30 and name HG2* )   ( resid   34 and name HN   )   3.96  2.16  2.16
assign ( resid   34 and name HN   )   ( resid   70 and name HD2* )   3.88  2.09  2.09
assign ( resid   31 and name HG2* )   ( resid   36 and name HN   )   4.06  2.27  2.27
assign ( resid   38 and name HN   )   ( resid   55 and name HG2* )   3.70  1.91  1.91
assign ( resid   39 and name HN   )   ( resid   55 and name HG2* )   3.56  1.77  1.77
assign ( resid   40 and name HN   )   ( resid   42 and name HD1* )   3.76  1.96  1.96
assign ( resid   39 and name HG2* )   ( resid   42 and name HN   )   4.24  2.45  2.45
assign ( resid   42 and name HN   )   ( resid   47 and name HG2* )   4.06  2.27  2.27
assign ( resid    2 and name HG2* )   ( resid   42 and name HN   )   3.92  2.13  2.13
assign ( resid   46 and name HN   )   ( resid   47 and name HG2* )   3.34  1.55  1.55
assign ( resid   46 and name HN   )   ( resid   51 and name HD1* )   4.35  2.56  2.56
assign ( resid   47 and name HN   )   ( resid   51 and name HD1* )   3.45  1.66  1.66
assign ( resid   44 and name HG2* )   ( resid   47 and name HN   )   3.76  1.96  1.96
assign ( resid   48 and name HN   )   ( resid   51 and name HD1* )   2.88  1.08  1.08
assign ( resid   48 and name HN   )   ( resid   51 and name HD2* )   3.63  1.84  1.84
assign ( resid   39 and name HG2* )   ( resid   51 and name HN   )   3.85  2.05  2.05
assign ( resid   47 and name HG1* )   ( resid   52 and name HN   )   3.33  1.53  1.53
assign ( resid   49 and name HG2* )   ( resid   53 and name HN   )   3.88  2.09  2.09
assign ( resid   38 and name HG1* )   ( resid   54 and name HN   )   3.80  2.00  2.00
assign ( resid   51 and name HD2* )   ( resid   54 and name HN   )   3.67  1.87  1.87
assign ( resid   38 and name HG1* )   ( resid   55 and name HN   )   3.33  1.53  1.53
assign ( resid   59 and name HG2* )   ( resid   61 and name HN   )   3.94  2.14  2.14
assign ( resid   59 and name HG2* )   ( resid   62 and name HN   )   4.41  2.61  2.61
assign ( resid   59 and name HG2* )   ( resid   63 and name HN   )   3.29  1.50  1.50
assign ( resid   66 and name HN   )   ( resid   67 and name HB*  )   3.72  1.93  1.93
assign ( resid   59 and name HD1* )   ( resid   67 and name HN   )   4.03  2.23  2.23
assign ( resid   56 and name HD1* )   ( resid   71 and name HN   )   3.36  1.57  1.57
assign ( resid   56 and name HD2* )   ( resid   71 and name HN   )   3.31  1.51  1.51
assign ( resid   70 and name HD1* )   ( resid   73 and name HN   )   4.17  2.38  2.38
assign ( resid   75 and name HN   )   ( resid   93 and name HB*  )   3.27  1.48  1.48
assign ( resid   76 and name HN   )   ( resid   93 and name HB*  )   4.03  2.23  2.23
assign ( resid   74 and name HG2* )   ( resid   76 and name HN   )   4.41  2.61  2.61
assign ( resid   76 and name HN   )   ( resid   77 and name HG2* )   3.96  2.16  2.16
assign ( resid   80 and name HN   )   ( resid   81 and name HB*  )   4.14  2.34  2.34
assign ( resid   77 and name HG1* )   ( resid   81 and name HN   )   4.21  2.41  2.41
assign ( resid   82 and name HN   )   ( resid   83 and name HG2* )   3.76  1.96  1.96
assign ( resid   81 and name HB*  )   ( resid   86 and name HN   )   3.52  1.73  1.73
assign ( resid   82 and name HG2* )   ( resid   87 and name HN   )   4.14  2.34  2.34
assign ( resid   82 and name HG2* )   ( resid   89 and name HN   )   3.25  1.46  1.46
assign ( resid   91 and name HD22 )   ( resid   93 and name HB*  )   4.08  2.29  2.29
assign ( resid   78 and name HD1* )   ( resid   93 and name HN   )   3.18  1.39  1.39
assign ( resid   78 and name HD1* )   ( resid   94 and name HN   )   3.92  2.13  2.13
assign ( resid   11 and name HG2* )   ( resid   28 and name HN   )   4.19  2.40  2.40
assign ( resid   59 and name HG2* )   ( resid   66 and name HN   )   3.69  1.89  1.89
assign ( resid   60 and name HN   )   ( resid   67 and name HB*  )   3.58  1.78  1.78
assign ( resid   44 and name HG1* )   ( resid   87 and name HN   )   4.41  2.61  2.61
assign ( resid   56 and name HN   )   ( resid   56 and name HD1* )   3.58  1.78  1.78
assign ( resid   74 and name HG2* )   ( resid   78 and name HN   )   3.54  1.75  1.75
assign ( resid   56 and name HD2* )   ( resid   70 and name HN   )   3.76  1.96  1.96
assign ( resid   60 and name HE1  )   ( resid   99 and name HD2* )   3.63  1.84  1.84
assign ( resid   56 and name HD1* )   ( resid   60 and name HE1  )   4.10  2.31  2.31
assign ( resid    6 and name HN   )   ( resid    7 and name HB*  )   3.90  2.11  2.11
assign ( resid    2 and name HN   )   ( resid    2 and name HB   )   2.93  1.13  1.13
assign ( resid    5 and name HN   )   ( resid    5 and name HB1  )   2.64  0.84  0.84
assign ( resid    6 and name HN   )   ( resid    6 and name HB2  )   2.49  0.70  0.70
assign ( resid    6 and name HN   )   ( resid    6 and name HB1  )   2.49  0.70  0.70
assign ( resid    9 and name HN   )   ( resid    9 and name HB1  )   2.71  0.91  0.91
assign ( resid   15 and name HN   )   ( resid   15 and name HB2  )   2.69  0.90  0.90
assign ( resid   16 and name HN   )   ( resid   16 and name HB2  )   2.58  0.79  0.79
assign ( resid   16 and name HN   )   ( resid   16 and name HB1  )   2.58  0.79  0.79
assign ( resid   17 and name HN   )   ( resid   17 and name HB1  )   2.64  0.84  0.84
assign ( resid   22 and name HN   )   ( resid   22 and name HB2  )   2.71  0.91  0.91
assign ( resid   25 and name HN   )   ( resid   25 and name HB2  )   2.55  0.75  0.75
assign ( resid   25 and name HN   )   ( resid   25 and name HB1  )   2.55  0.75  0.75
assign ( resid   27 and name HN   )   ( resid   27 and name HB1  )   2.82  1.02  1.02
assign ( resid   28 and name HN   )   ( resid   28 and name HB   )   2.73  0.93  0.93
assign ( resid   29 and name HN   )   ( resid   29 and name HB2  )   2.57  0.77  0.77
assign ( resid   29 and name HN   )   ( resid   29 and name HB1  )   2.57  0.77  0.77
assign ( resid   42 and name HN   )   ( resid   42 and name HB1  )   2.71  0.91  0.91
assign ( resid   43 and name HN   )   ( resid   43 and name HB2  )   2.46  0.66  0.66
assign ( resid   43 and name HN   )   ( resid   43 and name HB1  )   2.46  0.66  0.66
assign ( resid   44 and name HN   )   ( resid   44 and name HB   )   2.53  0.73  0.73
assign ( resid   49 and name HN   )   ( resid   49 and name HB   )   2.55  0.75  0.75
assign ( resid   50 and name HN   )   ( resid   50 and name HB2  )   2.49  0.70  0.70
assign ( resid   51 and name HN   )   ( resid   51 and name HB2  )   2.53  0.73  0.73
assign ( resid   57 and name HN   )   ( resid   57 and name HB1  )   2.66  0.86  0.86
assign ( resid   59 and name HN   )   ( resid   59 and name HB   )   2.62  0.82  0.82
assign ( resid   61 and name HN   )   ( resid   61 and name HB2  )   2.53  0.73  0.73
assign ( resid   61 and name HN   )   ( resid   61 and name HB1  )   2.53  0.73  0.73
assign ( resid   62 and name HN   )   ( resid   62 and name HB2  )   2.67  0.88  0.88
assign ( resid   62 and name HN   )   ( resid   62 and name HB1  )   2.67  0.88  0.88
assign ( resid   65 and name HA   )   ( resid   65 and name HB2  )   2.37  0.57  0.57
assign ( resid   65 and name HA   )   ( resid   65 and name HB1  )   2.37  0.57  0.57
assign ( resid   65 and name HN   )   ( resid   65 and name HB2  )   2.53  0.73  0.73
assign ( resid   65 and name HN   )   ( resid   65 and name HB1  )   2.53  0.73  0.73
assign ( resid   66 and name HN   )   ( resid   66 and name HB   )   2.46  0.66  0.66
assign ( resid   69 and name HN   )   ( resid   69 and name HB2  )   2.49  0.70  0.70
assign ( resid   76 and name HA   )   ( resid   76 and name HB2  )   2.35  0.55  0.55
assign ( resid   76 and name HA   )   ( resid   76 and name HB1  )   2.35  0.55  0.55
assign ( resid   82 and name HN   )   ( resid   82 and name HB   )   2.55  0.75  0.75
assign ( resid   90 and name HN   )   ( resid   90 and name HB2  )   2.66  0.86  0.86
assign ( resid   94 and name HN   )   ( resid   94 and name HB2  )   2.67  0.88  0.88
assign ( resid   94 and name HN   )   ( resid   94 and name HB1  )   2.67  0.88  0.88
assign ( resid   99 and name HN   )   ( resid   99 and name HB2  )   2.69  0.90  0.90
assign ( resid    1 and name HA   )   ( resid    2 and name HN   )   2.33  0.54  0.54
assign ( resid    2 and name HA   )   ( resid    3 and name HN   )   2.46  0.66  0.66
assign ( resid    5 and name HB1  )   ( resid    6 and name HN   )   2.75  0.95  0.95
assign ( resid    6 and name HB1  )   ( resid    7 and name HN   )   2.64  0.84  0.84
assign ( resid   11 and name HB   )   ( resid   12 and name HN   )   2.62  0.82  0.82
assign ( resid   15 and name HB2  )   ( resid   16 and name HN   )   2.94  1.15  1.15
assign ( resid   15 and name HB1  )   ( resid   16 and name HN   )   2.94  1.15  1.15
assign ( resid   17 and name HB2  )   ( resid   18 and name HN   )   2.98  1.18  1.18
assign ( resid   17 and name HB1  )   ( resid   18 and name HN   )   2.98  1.18  1.18
assign ( resid   19 and name HA   )   ( resid   20 and name HN   )   2.39  0.59  0.59
assign ( resid   26 and name HB1  )   ( resid   27 and name HN   )   2.94  1.15  1.15
assign ( resid   30 and name HB   )   ( resid   31 and name HN   )   2.93  1.13  1.13
assign ( resid   33 and name HB   )   ( resid   34 and name HN   )   2.58  0.79  0.79
assign ( resid   35 and name HB2  )   ( resid   36 and name HN   )   3.20  1.40  1.40
assign ( resid   38 and name HB   )   ( resid   39 and name HN   )   2.55  0.75  0.75
assign ( resid   42 and name HA   )   ( resid   43 and name HN   )   2.31  0.52  0.52
assign ( resid   43 and name HA   )   ( resid   44 and name HN   )   2.33  0.54  0.54
assign ( resid   43 and name HB2  )   ( resid   44 and name HN   )   3.03  1.24  1.24
assign ( resid   47 and name HA   )   ( resid   48 and name HN   )   2.31  0.52  0.52
assign ( resid   48 and name HB1  )   ( resid   49 and name HN   )   2.66  0.86  0.86
assign ( resid   49 and name HB   )   ( resid   50 and name HN   )   2.62  0.82  0.82
assign ( resid   50 and name HB2  )   ( resid   51 and name HN   )   2.73  0.93  0.93
assign ( resid   55 and name HB   )   ( resid   56 and name HN   )   2.57  0.77  0.77
assign ( resid   59 and name HB   )   ( resid   60 and name HN   )   2.75  0.95  0.95
assign ( resid   61 and name HB2  )   ( resid   62 and name HN   )   2.78  0.99  0.99
assign ( resid   61 and name HB1  )   ( resid   62 and name HN   )   2.78  0.99  0.99
assign ( resid   62 and name HB2  )   ( resid   63 and name HN   )   2.84  1.04  1.04
assign ( resid   66 and name HB   )   ( resid   67 and name HN   )   2.57  0.77  0.77
assign ( resid   69 and name HB2  )   ( resid   70 and name HN   )   2.73  0.93  0.93
assign ( resid   77 and name HB   )   ( resid   78 and name HN   )   2.67  0.88  0.88
assign ( resid   83 and name HB   )   ( resid   84 and name HN   )   2.66  0.86  0.86
assign ( resid   88 and name HB2  )   ( resid   89 and name HN   )   2.75  0.95  0.95
assign ( resid   89 and name HA1  )   ( resid   90 and name HN   )   2.53  0.73  0.73
assign ( resid   90 and name HA   )   ( resid   91 and name HN   )   2.31  0.52  0.52
assign ( resid   90 and name HB1  )   ( resid   91 and name HN   )   2.93  1.13  1.13
assign ( resid   96 and name HA   )   ( resid   97 and name HN   )   2.60  0.81  0.81
assign ( resid   99 and name HB2  )   ( resid  100 and name HN   )   3.00  1.20  1.20
assign ( resid   99 and name HB1  )   ( resid  100 and name HN   )   3.00  1.20  1.20
assign ( resid    3 and name HA   )   ( resid    6 and name HB2  )   2.69  0.90  0.90
assign ( resid    3 and name HA   )   ( resid    6 and name HB1  )   2.69  0.90  0.90
assign ( resid    6 and name HA   )   ( resid    9 and name HB2  )   2.62  0.82  0.82
assign ( resid    6 and name HA   )   ( resid    9 and name HB1  )   3.02  1.22  1.22
assign ( resid    7 and name HA   )   ( resid   10 and name HB2  )   2.71  0.91  0.91
assign ( resid    7 and name HA   )   ( resid   10 and name HB1  )   2.71  0.91  0.91
assign ( resid    8 and name HA   )   ( resid   11 and name HB   )   2.55  0.75  0.75
assign ( resid    8 and name HA   )   ( resid   12 and name HN   )   3.14  1.35  1.35
assign ( resid    9 and name HA   )   ( resid   12 and name HB*  )   3.11  1.32  1.32
assign ( resid   11 and name HA   )   ( resid   14 and name HN   )   3.02  1.22  1.22
assign ( resid   12 and name HA   )   ( resid   15 and name HB2  )   2.94  1.15  1.15
assign ( resid   12 and name HA   )   ( resid   15 and name HB1  )   2.94  1.15  1.15
assign ( resid   13 and name HA   )   ( resid   15 and name HN   )   3.09  1.29  1.29
assign ( resid   14 and name HA   )   ( resid   17 and name HN   )   3.07  1.27  1.27
assign ( resid   23 and name HA   )   ( resid   26 and name HN   )   2.98  1.18  1.18
assign ( resid   23 and name HA   )   ( resid   26 and name HB2  )   2.69  0.90  0.90
assign ( resid   23 and name HA   )   ( resid   26 and name HB1  )   2.94  1.15  1.15
assign ( resid   24 and name HA   )   ( resid   27 and name HN   )   3.29  1.49  1.49
assign ( resid   24 and name HA   )   ( resid   27 and name HB1  )   3.16  1.36  1.36
assign ( resid   24 and name HA   )   ( resid   27 and name HB2  )   2.85  1.06  1.06
assign ( resid   24 and name HA   )   ( resid   28 and name HN   )   3.27  1.47  1.47
assign ( resid   25 and name HA   )   ( resid   28 and name HN   )   2.98  1.18  1.18
assign ( resid   26 and name HA   )   ( resid   29 and name HN   )   2.98  1.18  1.18
assign ( resid   26 and name HA   )   ( resid   29 and name HB2  )   2.91  1.11  1.11
assign ( resid   26 and name HA   )   ( resid   29 and name HB1  )   2.91  1.11  1.11
assign ( resid   29 and name HA   )   ( resid   32 and name HN   )   2.87  1.08  1.08
assign ( resid   29 and name HA   )   ( resid   32 and name HB2  )   2.76  0.97  0.97
assign ( resid   29 and name HA   )   ( resid   32 and name HB1  )   2.76  0.97  0.97
assign ( resid   29 and name HA   )   ( resid   33 and name HN   )   3.18  1.38  1.38
assign ( resid   30 and name HA   )   ( resid   33 and name HB   )   2.62  0.82  0.82
assign ( resid   49 and name HA   )   ( resid   52 and name HB   )   2.62  0.82  0.82
assign ( resid   50 and name HA   )   ( resid   53 and name HB*  )   3.65  1.86  1.86
assign ( resid   51 and name HA   )   ( resid   54 and name HN   )   2.76  0.97  0.97
assign ( resid   51 and name HA   )   ( resid   54 and name HB*  )   3.04  1.25  1.25
assign ( resid   52 and name HA   )   ( resid   55 and name HB   )   2.75  0.95  0.95
assign ( resid   53 and name HA   )   ( resid   56 and name HN   )   2.80  1.00  1.00
assign ( resid   53 and name HA   )   ( resid   56 and name HB2  )   2.60  0.81  0.81
assign ( resid   53 and name HA   )   ( resid   56 and name HB1  )   3.16  1.36  1.36
assign ( resid   65 and name HA   )   ( resid   68 and name HB*  )   3.31  1.52  1.52
assign ( resid   67 and name HA   )   ( resid   70 and name HB2  )   2.89  1.09  1.09
assign ( resid   67 and name HA   )   ( resid   70 and name HB1  )   2.80  1.00  1.00
assign ( resid   67 and name HA   )   ( resid   71 and name HN   )   3.43  1.63  1.63
assign ( resid   68 and name HA   )   ( resid   71 and name HN   )   3.18  1.38  1.38
assign ( resid   68 and name HA   )   ( resid   71 and name HB2  )   3.05  1.26  1.26
assign ( resid   68 and name HA   )   ( resid   71 and name HB1  )   3.05  1.26  1.26
assign ( resid   69 and name HA   )   ( resid   72 and name HN   )   3.16  1.36  1.36
assign ( resid   80 and name HA   )   ( resid   83 and name HN   )   2.96  1.17  1.17
assign ( resid   80 and name HA   )   ( resid   83 and name HB   )   2.67  0.88  0.88
assign ( resid    2 and name HA   )   ( resid   43 and name HA   )   2.40  0.61  0.61
assign ( resid    2 and name HB   )   ( resid    4 and name HN   )   2.80  1.00  1.00
assign ( resid    2 and name HN   )   ( resid    5 and name HB2  )   2.67  0.88  0.88
assign ( resid    2 and name HN   )   ( resid    5 and name HB1  )   2.75  0.95  0.95
assign ( resid   16 and name HA   )   ( resid   19 and name HN   )   3.27  1.47  1.47
assign ( resid   15 and name HA   )   ( resid   18 and name HB*  )   3.37  1.57  1.57
assign ( resid   21 and name HB   )   ( resid   23 and name HN   )   2.94  1.15  1.15
assign ( resid   28 and name HA   )   ( resid   31 and name HB   )   2.84  1.04  1.04
assign ( resid   32 and name HA   )   ( resid   36 and name HN   )   3.16  1.36  1.36
assign ( resid   36 and name HA2  )   ( resid   40 and name HN   )   3.27  1.47  1.47
assign ( resid   36 and name HA1  )   ( resid   40 and name HN   )   3.27  1.47  1.47
assign ( resid   35 and name HA   )   ( resid   38 and name HB   )   3.23  1.44  1.44
assign ( resid    4 and name HN   )   ( resid   40 and name HA2  )   2.87  1.08  1.08
assign ( resid   39 and name HA   )   ( resid   42 and name HB2  )   3.09  1.29  1.29
assign ( resid   43 and name HB1  )   ( resid   46 and name HN   )   2.80  1.00  1.00
assign ( resid   43 and name HB2  )   ( resid   46 and name HN   )   2.80  1.00  1.00
assign ( resid   44 and name HA   )   ( resid   47 and name HB   )   3.02  1.22  1.22
assign ( resid    3 and name HN   )   ( resid   44 and name HA   )   3.29  1.49  1.49
assign ( resid   47 and name HA   )   ( resid   51 and name HB2  )   2.85  1.06  1.06
assign ( resid   48 and name HB1  )   ( resid   50 and name HN   )   3.34  1.54  1.54
assign ( resid   48 and name HN   )   ( resid   51 and name HB1  )   2.85  1.06  1.06
assign ( resid   53 and name HA   )   ( resid   57 and name HN   )   3.27  1.47  1.47
assign ( resid   59 and name HA   )   ( resid   62 and name HB1  )   3.47  1.67  1.67
assign ( resid   59 and name HA   )   ( resid   62 and name HB2  )   3.47  1.67  1.67
assign ( resid   56 and name HA   )   ( resid   59 and name HB   )   2.91  1.11  1.11
assign ( resid   59 and name HA   )   ( resid   62 and name HN   )   2.96  1.17  1.17
assign ( resid   59 and name HN   )   ( resid   60 and name HB*  )   3.62  1.82  1.82
assign ( resid   60 and name HA   )   ( resid   64 and name HA   )   2.48  0.68  0.68
assign ( resid   60 and name HA   )   ( resid   64 and name HB1  )   3.36  1.56  1.56
assign ( resid   64 and name HA   )   ( resid   67 and name HN   )   2.82  1.02  1.02
assign ( resid   64 and name HA   )   ( resid   66 and name HN   )   3.09  1.29  1.29
assign ( resid   66 and name HA   )   ( resid   69 and name HB2  )   2.75  0.95  0.95
assign ( resid   66 and name HA   )   ( resid   69 and name HB1  )   2.89  1.09  1.09
assign ( resid   72 and name HA2  )   ( resid   75 and name HB2  )   3.56  1.76  1.76
assign ( resid   72 and name HA2  )   ( resid   75 and name HB1  )   3.56  1.76  1.76
assign ( resid   72 and name HA1  )   ( resid   75 and name HB2  )   3.56  1.76  1.76
assign ( resid   72 and name HA1  )   ( resid   75 and name HB1  )   3.56  1.76  1.76
assign ( resid   74 and name HA   )   ( resid   77 and name HB   )   2.71  0.91  0.91
assign ( resid   71 and name HA   )   ( resid   74 and name HB   )   2.76  0.97  0.97
assign ( resid   77 and name HA   )   ( resid   80 and name HB1  )   2.93  1.13  1.13
assign ( resid   75 and name HA   )   ( resid   78 and name HB2  )   3.36  1.56  1.56
assign ( resid   77 and name HA   )   ( resid   80 and name HB2  )   3.09  1.29  1.29
assign ( resid   81 and name HA   )   ( resid   84 and name HB1  )   2.94  1.15  1.15
assign ( resid   81 and name HA   )   ( resid   84 and name HB2  )   2.93  1.13  1.13
assign ( resid   82 and name HA   )   ( resid   87 and name HN   )   2.71  0.91  0.91
assign ( resid   83 and name HA   )   ( resid   85 and name HN   )   3.25  1.45  1.45
assign ( resid   82 and name HA   )   ( resid   85 and name HN   )   3.00  1.20  1.20
assign ( resid    2 and name HA   )   ( resid   43 and name HN   )   3.12  1.33  1.33
assign ( resid   76 and name HA   )   ( resid   79 and name HB*  )   3.42  1.63  1.63
assign ( resid   96 and name HN   )   ( resid   96 and name HB1  )   2.66  0.86  0.86
assign ( resid    1 and name HA   )   ( resid    1 and name HG1  )   2.91  1.11  1.11
assign ( resid    1 and name HA   )   ( resid    1 and name HG2  )   2.91  1.11  1.11
assign ( resid    5 and name HA   )   ( resid    5 and name HG2  )   2.66  0.86  0.86
assign ( resid    5 and name HB1  )   ( resid    5 and name HG2  )   2.39  0.59  0.59
assign ( resid    5 and name HA   )   ( resid    5 and name HG1  )   2.66  0.86  0.86
assign ( resid    5 and name HB1  )   ( resid    5 and name HG1  )   2.39  0.59  0.59
assign ( resid    9 and name HA   )   ( resid    9 and name HG   )   2.62  0.82  0.82
assign ( resid    9 and name HB1  )   ( resid    9 and name HG   )   2.40  0.61  0.61
assign ( resid    9 and name HN   )   ( resid    9 and name HG   )   2.51  0.72  0.72
assign ( resid   11 and name HA   )   ( resid   11 and name HG12 )   2.69  0.90  0.90
assign ( resid   11 and name HA   )   ( resid   11 and name HG11 )   2.69  0.90  0.90
assign ( resid   12 and name HA   )   ( resid   12 and name HG2  )   2.66  0.86  0.86
assign ( resid   12 and name HN   )   ( resid   12 and name HG1  )   3.45  1.65  1.65
assign ( resid   12 and name HA   )   ( resid   12 and name HG1  )   2.66  0.86  0.86
assign ( resid   12 and name HA   )   ( resid   12 and name HD*  )   3.65  1.86  1.86
assign ( resid   12 and name HB*  )   ( resid   12 and name HE*  )   4.65  2.86  2.86
assign ( resid   15 and name HA   )   ( resid   15 and name HG1  )   2.82  1.02  1.02
assign ( resid   15 and name HA   )   ( resid   15 and name HG2  )   2.82  1.02  1.02
assign ( resid   19 and name HA   )   ( resid   19 and name HD*  )   3.82  2.02  2.02
assign ( resid   19 and name HN   )   ( resid   19 and name HG*  )   3.48  1.68  1.68
assign ( resid   19 and name HB*  )   ( resid   19 and name HE*  )   4.72  2.93  2.93
assign ( resid   22 and name HA   )   ( resid   22 and name HG2  )   2.76  0.97  0.97
assign ( resid   22 and name HN   )   ( resid   22 and name HG1  )   2.85  1.06  1.06
assign ( resid   22 and name HA   )   ( resid   22 and name HG1  )   2.76  0.97  0.97
assign ( resid   26 and name HA   )   ( resid   26 and name HG2  )   2.78  0.99  0.99
assign ( resid   26 and name HA   )   ( resid   26 and name HG1  )   2.78  0.99  0.99
assign ( resid   31 and name HA   )   ( resid   31 and name HG12 )   2.58  0.79  0.79
assign ( resid   31 and name HN   )   ( resid   31 and name HG11 )   2.66  0.86  0.86
assign ( resid   31 and name HA   )   ( resid   31 and name HG11 )   2.58  0.79  0.79
assign ( resid   32 and name HA   )   ( resid   32 and name HG2  )   2.76  0.97  0.97
assign ( resid   32 and name HA   )   ( resid   32 and name HD*  )   4.10  2.31  2.31
assign ( resid   32 and name HA   )   ( resid   32 and name HG1  )   2.76  0.97  0.97
assign ( resid   32 and name HN   )   ( resid   32 and name HD*  )   4.34  2.54  2.54
assign ( resid   39 and name HN   )   ( resid   39 and name HG12 )   2.80  1.00  1.00
assign ( resid   42 and name HA   )   ( resid   42 and name HG   )   2.80  1.00  1.00
assign ( resid   42 and name HB2  )   ( resid   42 and name HG   )   2.35  0.55  0.55
assign ( resid   50 and name HN   )   ( resid   50 and name HG2  )   3.12  1.33  1.33
assign ( resid   50 and name HN   )   ( resid   50 and name HG1  )   3.12  1.33  1.33
assign ( resid   51 and name HB1  )   ( resid   51 and name HG   )   2.39  0.59  0.59
assign ( resid   51 and name HN   )   ( resid   51 and name HG   )   2.67  0.88  0.88
assign ( resid   51 and name HA   )   ( resid   51 and name HG   )   2.76  0.97  0.97
assign ( resid   51 and name HB2  )   ( resid   51 and name HG   )   2.10  0.30  0.30
assign ( resid   52 and name HA   )   ( resid   52 and name HG12 )   2.75  0.95  0.95
assign ( resid   52 and name HA   )   ( resid   52 and name HG11 )   2.75  0.95  0.95
assign ( resid   52 and name HN   )   ( resid   52 and name HG12 )   3.02  1.22  1.22
assign ( resid   53 and name HA   )   ( resid   53 and name HG1  )   3.00  1.20  1.20
assign ( resid   53 and name HN   )   ( resid   53 and name HG2  )   2.85  1.06  1.06
assign ( resid   53 and name HA   )   ( resid   53 and name HG2  )   3.00  1.20  1.20
assign ( resid   54 and name HA   )   ( resid   54 and name HG1  )   2.84  1.04  1.04
assign ( resid   54 and name HA   )   ( resid   54 and name HD*  )   4.01  2.22  2.22
assign ( resid   54 and name HA   )   ( resid   54 and name HG2  )   2.84  1.04  1.04
assign ( resid   59 and name HN   )   ( resid   59 and name HG12 )   2.62  0.82  0.82
assign ( resid   59 and name HA   )   ( resid   59 and name HG12 )   3.00  1.20  1.20
assign ( resid   59 and name HN   )   ( resid   59 and name HG11 )   2.62  0.82  0.82
assign ( resid   59 and name HA   )   ( resid   59 and name HG11 )   3.00  1.20  1.20
assign ( resid   61 and name HA   )   ( resid   61 and name HG1  )   2.91  1.11  1.11
assign ( resid   61 and name HN   )   ( resid   61 and name HG2  )   2.82  1.02  1.02
assign ( resid   61 and name HA   )   ( resid   61 and name HG2  )   2.91  1.11  1.11
assign ( resid   61 and name HN   )   ( resid   61 and name HG1  )   2.82  1.02  1.02
assign ( resid   62 and name HA   )   ( resid   62 and name HG1  )   2.82  1.02  1.02
assign ( resid   62 and name HN   )   ( resid   62 and name HG2  )   3.02  1.22  1.22
assign ( resid   62 and name HA   )   ( resid   62 and name HG2  )   2.82  1.02  1.02
assign ( resid   63 and name HN   )   ( resid   63 and name HG2  )   3.25  1.45  1.45
assign ( resid   63 and name HA   )   ( resid   63 and name HG2  )   2.96  1.17  1.17
assign ( resid   63 and name HA   )   ( resid   63 and name HG1  )   2.96  1.17  1.17
assign ( resid   69 and name HA   )   ( resid   69 and name HG2  )   2.49  0.70  0.70
assign ( resid   69 and name HA   )   ( resid   69 and name HD2  )   3.63  1.83  1.83
assign ( resid   69 and name HA   )   ( resid   69 and name HD1  )   3.63  1.83  1.83
assign ( resid   69 and name HB2  )   ( resid   69 and name HG1  )   2.17  0.37  0.37
assign ( resid   69 and name HB1  )   ( resid   69 and name HG2  )   2.30  0.50  0.50
assign ( resid   69 and name HA   )   ( resid   69 and name HG1  )   2.69  0.90  0.90
assign ( resid   69 and name HB1  )   ( resid   69 and name HG1  )   2.37  0.57  0.57
assign ( resid   69 and name HB1  )   ( resid   69 and name HD2  )   2.82  1.02  1.02
assign ( resid   69 and name HB2  )   ( resid   69 and name HD2  )   2.84  1.04  1.04
assign ( resid   69 and name HB1  )   ( resid   69 and name HD1  )   2.82  1.02  1.02
assign ( resid   69 and name HB2  )   ( resid   69 and name HD1  )   2.84  1.04  1.04
assign ( resid   70 and name HA   )   ( resid   70 and name HG   )   2.87  1.08  1.08
assign ( resid   70 and name HB1  )   ( resid   70 and name HG   )   2.33  0.54  0.54
assign ( resid   71 and name HA   )   ( resid   71 and name HG2  )   2.76  0.97  0.97
assign ( resid   71 and name HA   )   ( resid   71 and name HG1  )   2.76  0.97  0.97
assign ( resid   73 and name HA   )   ( resid   73 and name HG2  )   2.96  1.17  1.17
assign ( resid   73 and name HA   )   ( resid   73 and name HG1  )   2.96  1.17  1.17
assign ( resid   73 and name HN   )   ( resid   73 and name HG2  )   2.96  1.17  1.17
assign ( resid   78 and name HB1  )   ( resid   78 and name HG   )   2.40  0.61  0.61
assign ( resid   78 and name HB2  )   ( resid   78 and name HG   )   2.22  0.43  0.43
assign ( resid   84 and name HA   )   ( resid   84 and name HG2  )   3.00  1.20  1.20
assign ( resid   84 and name HA   )   ( resid   84 and name HG1  )   3.00  1.20  1.20
assign ( resid   84 and name HN   )   ( resid   84 and name HD2  )   3.29  1.49  1.49
assign ( resid   84 and name HA   )   ( resid   84 and name HD2  )   2.73  0.93  0.93
assign ( resid   84 and name HN   )   ( resid   84 and name HD1  )   3.29  1.49  1.49
assign ( resid   84 and name HA   )   ( resid   84 and name HD1  )   2.73  0.93  0.93
assign ( resid   94 and name HN   )   ( resid   94 and name HG*  )   3.83  2.04  2.04
assign ( resid   94 and name HA   )   ( resid   94 and name HD2  )   3.86  2.07  2.07
assign ( resid   94 and name HA   )   ( resid   94 and name HD1  )   3.86  2.07  2.07
assign ( resid   96 and name HN   )   ( resid   96 and name HD*  )   4.34  2.54  2.54
assign ( resid   96 and name HA   )   ( resid   96 and name HD*  )   3.89  2.09  2.09
assign ( resid  100 and name HN   )   ( resid  100 and name HG*  )   3.60  1.81  1.81
assign ( resid    1 and name HG2  )   ( resid    2 and name HN   )   3.12  1.33  1.33
assign ( resid    1 and name HG1  )   ( resid    2 and name HN   )   3.12  1.33  1.33
assign ( resid   19 and name HG*  )   ( resid   20 and name HN   )   4.00  2.20  2.20
assign ( resid   37 and name HD2  )   ( resid   38 and name HN   )   3.52  1.72  1.72
assign ( resid   37 and name HD1  )   ( resid   38 and name HN   )   3.52  1.72  1.72
assign ( resid   41 and name HD2  )   ( resid   42 and name HN   )   3.11  1.31  1.31
assign ( resid   41 and name HD1  )   ( resid   42 and name HN   )   3.11  1.31  1.31
assign ( resid   58 and name HD2  )   ( resid   59 and name HN   )   3.05  1.26  1.26
assign ( resid   58 and name HD1  )   ( resid   59 and name HN   )   3.27  1.47  1.47
assign ( resid   64 and name HD1  )   ( resid   65 and name HN   )   3.43  1.63  1.63
assign ( resid   64 and name HG*  )   ( resid   65 and name HN   )   3.33  1.54  1.54
assign ( resid   65 and name HG*  )   ( resid   66 and name HN   )   3.96  2.17  2.17
assign ( resid    1 and name HG2  )   ( resid    6 and name HB1  )   3.11  1.31  1.31
assign ( resid    1 and name HG1  )   ( resid    6 and name HB1  )   3.11  1.31  1.31
assign ( resid    1 and name HG2  )   ( resid    6 and name HN   )   3.27  1.47  1.47
assign ( resid    1 and name HG1  )   ( resid    6 and name HN   )   3.27  1.47  1.47
assign ( resid    2 and name HN   )   ( resid    5 and name HG1  )   3.84  2.05  2.05
assign ( resid    2 and name HN   )   ( resid    5 and name HG2  )   3.84  2.05  2.05
assign ( resid    6 and name HA   )   ( resid    9 and name HG   )   2.75  0.95  0.95
assign ( resid    1 and name HG2  )   ( resid    6 and name HB2  )   3.11  1.31  1.31
assign ( resid    1 and name HG1  )   ( resid    6 and name HB2  )   3.11  1.31  1.31
assign ( resid   10 and name HD*  )   ( resid   11 and name HA   )   4.37  2.57  2.57
assign ( resid   12 and name HA   )   ( resid   15 and name HG2  )   3.12  1.33  1.33
assign ( resid   12 and name HA   )   ( resid   15 and name HG1  )   3.12  1.33  1.33
assign ( resid   15 and name HA   )   ( resid   15 and name HD2  )   3.90  2.10  2.10
assign ( resid   16 and name HA   )   ( resid   19 and name HG*  )   4.29  2.49  2.49
assign ( resid   19 and name HB*  )   ( resid   20 and name HB*  )   4.78  2.98  2.98
assign ( resid   27 and name HA   )   ( resid   73 and name HD1  )   3.14  1.35  1.35
assign ( resid   27 and name HA   )   ( resid   73 and name HD2  )   3.14  1.35  1.35
assign ( resid   30 and name HB   )   ( resid   33 and name HB   )   3.75  1.96  1.96
assign ( resid   35 and name HA   )   ( resid   39 and name HG12 )   3.30  1.51  1.51
assign ( resid   35 and name HB1  )   ( resid   39 and name HG11 )   2.75  0.95  0.95
assign ( resid   35 and name HB1  )   ( resid   39 and name HG12 )   2.75  0.95  0.95
assign ( resid    3 and name HE*  )   ( resid   35 and name HB2  )   4.84  3.04  3.04
assign ( resid   36 and name HN   )   ( resid   37 and name HD2  )   2.76  0.97  0.97
assign ( resid   36 and name HN   )   ( resid   37 and name HD1  )   2.76  0.97  0.97
assign ( resid   35 and name HA   )   ( resid   39 and name HG11 )   3.30  1.51  1.51
assign ( resid    3 and name HB2  )   ( resid   40 and name HA2  )   3.77  1.98  1.98
assign ( resid   40 and name HA1  )   ( resid   41 and name HD1  )   2.67  0.88  0.88
assign ( resid    3 and name HD*  )   ( resid   40 and name HA1  )   4.64  2.84  2.84
assign ( resid   41 and name HD2  )   ( resid   42 and name HG   )   3.90  2.10  2.10
assign ( resid   41 and name HD1  )   ( resid   42 and name HG   )   3.90  2.10  2.10
assign ( resid   40 and name HA1  )   ( resid   41 and name HD2  )   2.67  0.88  0.88
assign ( resid   40 and name HN   )   ( resid   41 and name HD2  )   2.78  0.99  0.99
assign ( resid   43 and name HB2  )   ( resid   46 and name HB2  )   3.63  1.83  1.83
assign ( resid   43 and name HB2  )   ( resid   46 and name HB1  )   3.63  1.83  1.83
assign ( resid   43 and name HB1  )   ( resid   46 and name HB2  )   3.63  1.83  1.83
assign ( resid   43 and name HB1  )   ( resid   46 and name HB1  )   3.63  1.83  1.83
assign ( resid    3 and name HD*  )   ( resid   44 and name HA   )   4.96  3.17  3.17
assign ( resid   42 and name HB1  )   ( resid   46 and name HB2  )   3.57  1.78  1.78
assign ( resid   42 and name HB1  )   ( resid   46 and name HB1  )   3.57  1.78  1.78
assign ( resid   49 and name HA   )   ( resid   92 and name HB2  )   2.85  1.06  1.06
assign ( resid   49 and name HA   )   ( resid   92 and name HB1  )   3.27  1.47  1.47
assign ( resid   56 and name HA   )   ( resid   56 and name HG   )   2.82  1.02  1.02
assign ( resid   57 and name HB1  )   ( resid   58 and name HG*  )   4.31  2.51  2.51
assign ( resid   57 and name HB2  )   ( resid   58 and name HG*  )   4.31  2.51  2.51
assign ( resid   57 and name HN   )   ( resid   58 and name HD2  )   2.80  1.00  1.00
assign ( resid   57 and name HB2  )   ( resid   58 and name HD2  )   2.71  0.91  0.91
assign ( resid   57 and name HB1  )   ( resid   58 and name HD2  )   2.71  0.91  0.91
assign ( resid   57 and name HB2  )   ( resid   58 and name HD1  )   2.48  0.68  0.68
assign ( resid   57 and name HB1  )   ( resid   58 and name HD1  )   2.48  0.68  0.68
assign ( resid   58 and name HG*  )   ( resid   59 and name HG11 )   4.14  2.35  2.35
assign ( resid   58 and name HG*  )   ( resid   59 and name HG12 )   4.14  2.35  2.35
assign ( resid   56 and name HA   )   ( resid   59 and name HG11 )   3.16  1.36  1.36
assign ( resid   56 and name HA   )   ( resid   59 and name HG12 )   3.16  1.36  1.36
assign ( resid   62 and name HB2  )   ( resid   63 and name HG1  )   3.67  1.87  1.87
assign ( resid   62 and name HB1  )   ( resid   63 and name HG1  )   3.67  1.87  1.87
assign ( resid   63 and name HA   )   ( resid   64 and name HD2  )   2.22  0.43  0.43
assign ( resid   63 and name HA   )   ( resid   64 and name HD1  )   2.35  0.55  0.55
assign ( resid   63 and name HN   )   ( resid   64 and name HD2  )   3.14  1.35  1.35
assign ( resid   63 and name HB2  )   ( resid   66 and name HB   )   2.44  0.64  0.64
assign ( resid   63 and name HB1  )   ( resid   66 and name HB   )   2.35  0.55  0.55
assign ( resid   59 and name HB   )   ( resid   67 and name HA   )   3.25  1.45  1.45
assign ( resid   70 and name HA   )   ( resid   73 and name HD1  )   3.88  2.08  2.08
assign ( resid   70 and name HA   )   ( resid   73 and name HD2  )   3.88  2.08  2.08
assign ( resid    3 and name HE*  )   ( resid   74 and name HA   )   4.96  3.17  3.17
assign ( resid   75 and name HA   )   ( resid   91 and name HD21 )   2.58  0.79  0.79
assign ( resid   75 and name HG2  )   ( resid   91 and name HD21 )   3.30  1.51  1.51
assign ( resid   78 and name HB1  )   ( resid   91 and name HD21 )   3.36  1.56  1.56
assign ( resid    3 and name HE*  )   ( resid   78 and name HG   )   4.82  3.02  3.02
assign ( resid   79 and name HB*  )   ( resid   91 and name HD22 )   4.34  2.54  2.54
assign ( resid   79 and name HB*  )   ( resid   91 and name HD21 )   4.34  2.54  2.54
assign ( resid   82 and name HA   )   ( resid   87 and name HG2  )   2.98  1.18  1.18
assign ( resid   82 and name HA   )   ( resid   87 and name HG1  )   2.98  1.18  1.18
assign ( resid   81 and name HA   )   ( resid   86 and name HB2  )   3.25  1.45  1.45
assign ( resid   81 and name HA   )   ( resid   86 and name HB1  )   3.61  1.81  1.81
assign ( resid   91 and name HA   )   ( resid   92 and name HD1  )   2.37  0.57  0.57
assign ( resid   91 and name HA   )   ( resid   92 and name HD2  )   2.37  0.57  0.57
assign ( resid   48 and name HA   )   ( resid   92 and name HB2  )   2.98  1.18  1.18
assign ( resid   48 and name HA   )   ( resid   92 and name HB1  )   2.98  1.18  1.18
assign ( resid   93 and name HA   )   ( resid   95 and name HZ3  )   3.20  1.40  1.40
assign ( resid   80 and name HE1  )   ( resid   84 and name HD2  )   3.90  2.10  2.10
assign ( resid    2 and name HB   )   ( resid   41 and name HA   )   2.60  0.81  0.81
assign ( resid   10 and name HE*  )   ( resid   76 and name HB1  )   4.96  3.17  3.17
assign ( resid    3 and name HB1  )   ( resid   40 and name HA2  )   3.77  1.98  1.98
assign ( resid   12 and name HA   )   ( resid   15 and name HD2  )   3.41  1.62  1.62
assign ( resid   12 and name HA   )   ( resid   15 and name HD1  )   3.41  1.62  1.62
assign ( resid   15 and name HA   )   ( resid   15 and name HD1  )   3.90  2.10  2.10
assign ( resid    3 and name HE*  )   ( resid   35 and name HB1  )   4.14  2.34  2.34
assign ( resid    3 and name HA   )   ( resid   44 and name HB   )   2.58  0.79  0.79
assign ( resid   45 and name HA   )   ( resid   87 and name HB2  )   3.18  1.38  1.38
assign ( resid   39 and name HA   )   ( resid   42 and name HG   )   2.64  0.84  0.84
assign ( resid   96 and name HA   )   ( resid   96 and name HG1  )   2.85  1.06  1.06
assign ( resid   96 and name HA   )   ( resid   96 and name HG2  )   2.85  1.06  1.06
assign ( resid   96 and name HN   )   ( resid   96 and name HG1  )   3.12  1.33  1.33
assign ( resid   18 and name HB*  )   ( resid   24 and name HN   )   4.34  2.54  2.54
assign ( resid    3 and name HD*  )   ( resid   35 and name HB2  )   4.85  3.06  3.06
assign ( resid   45 and name HA   )   ( resid   87 and name HB1  )   3.18  1.38  1.38
assign ( resid    1 and name HA   )   ( resid    1 and name HE*  )   3.69  1.89  1.89
assign ( resid    1 and name HB2  )   ( resid    1 and name HE*  )   2.91  1.12  1.12
assign ( resid    1 and name HB1  )   ( resid    1 and name HE*  )   2.91  1.12  1.12
assign ( resid    2 and name HA   )   ( resid    2 and name HG2* )   2.77  0.97  0.97
assign ( resid    8 and name HN   )   ( resid    8 and name HB*  )   2.61  0.81  0.81
assign ( resid    9 and name HA   )   ( resid    9 and name HD1* )   3.54  1.75  1.75
assign ( resid    9 and name HA   )   ( resid    9 and name HD2* )   2.61  0.81  0.81
assign ( resid    9 and name HB1  )   ( resid    9 and name HD2* )   2.77  0.97  0.97
assign ( resid   11 and name HA   )   ( resid   11 and name HD1* )   3.15  1.35  1.35
assign ( resid   11 and name HB   )   ( resid   11 and name HD1* )   2.75  0.96  0.96
assign ( resid   21 and name HN   )   ( resid   21 and name HG2* )   3.02  1.23  1.23
assign ( resid   21 and name HA   )   ( resid   21 and name HG2* )   2.77  0.97  0.97
assign ( resid   28 and name HN   )   ( resid   28 and name HG2* )   3.16  1.37  1.37
assign ( resid   28 and name HA   )   ( resid   28 and name HG2* )   2.68  0.88  0.88
assign ( resid   30 and name HN   )   ( resid   30 and name HG2* )   2.97  1.17  1.17
assign ( resid   30 and name HA   )   ( resid   30 and name HG2* )   2.71  0.92  0.92
assign ( resid   31 and name HN   )   ( resid   31 and name HD1* )   3.49  1.69  1.69
assign ( resid   31 and name HA   )   ( resid   31 and name HD1* )   3.15  1.35  1.35
assign ( resid   33 and name HA   )   ( resid   33 and name HG2* )   2.77  0.97  0.97
assign ( resid   38 and name HA   )   ( resid   38 and name HG1* )   2.75  0.96  0.96
assign ( resid   38 and name HA   )   ( resid   38 and name HG2* )   2.73  0.94  0.94
assign ( resid   39 and name HA   )   ( resid   39 and name HG2* )   2.77  0.97  0.97
assign ( resid   39 and name HN   )   ( resid   39 and name HD1* )   3.67  1.87  1.87
assign ( resid   42 and name HA   )   ( resid   42 and name HD1* )   3.42  1.62  1.62
assign ( resid   42 and name HA   )   ( resid   42 and name HD2* )   2.68  0.88  0.88
assign ( resid   44 and name HN   )   ( resid   44 and name HG1* )   2.91  1.12  1.12
assign ( resid   44 and name HN   )   ( resid   44 and name HG2* )   3.13  1.33  1.33
assign ( resid   49 and name HN   )   ( resid   49 and name HG2* )   3.34  1.55  1.55
assign ( resid   51 and name HA   )   ( resid   51 and name HD1* )   3.56  1.77  1.77
assign ( resid   51 and name HA   )   ( resid   51 and name HD2* )   2.61  0.81  0.81
assign ( resid   52 and name HA   )   ( resid   52 and name HD1* )   3.15  1.35  1.35
assign ( resid   53 and name HA   )   ( resid   53 and name HE*  )   3.43  1.64  1.64
assign ( resid   55 and name HA   )   ( resid   55 and name HG2* )   2.73  0.94  0.94
assign ( resid   56 and name HA   )   ( resid   56 and name HD1* )   3.18  1.39  1.39
assign ( resid   56 and name HA   )   ( resid   56 and name HD2* )   2.73  0.94  0.94
assign ( resid   59 and name HA   )   ( resid   59 and name HG2* )   2.62  0.83  0.83
assign ( resid   66 and name HA   )   ( resid   66 and name HG2* )   2.70  0.90  0.90
assign ( resid   70 and name HA   )   ( resid   70 and name HD1* )   2.77  0.97  0.97
assign ( resid   70 and name HB2  )   ( resid   70 and name HD1* )   2.77  0.97  0.97
assign ( resid   70 and name HA   )   ( resid   70 and name HD2* )   3.60  1.80  1.80
assign ( resid   70 and name HB2  )   ( resid   70 and name HD2* )   2.77  0.97  0.97
assign ( resid   74 and name HA   )   ( resid   74 and name HD1* )   3.26  1.46  1.46
assign ( resid   74 and name HB   )   ( resid   74 and name HD1* )   2.79  0.99  0.99
assign ( resid   77 and name HN   )   ( resid   77 and name HG2* )   2.77  0.97  0.97
assign ( resid   78 and name HA   )   ( resid   78 and name HD1* )   3.33  1.53  1.53
assign ( resid   78 and name HA   )   ( resid   78 and name HD2* )   2.70  0.90  0.90
assign ( resid   78 and name HB2  )   ( resid   78 and name HD1* )   2.72  0.92  0.92
assign ( resid   82 and name HA   )   ( resid   82 and name HG2* )   2.77  0.97  0.97
assign ( resid   83 and name HN   )   ( resid   83 and name HG2* )   2.71  0.92  0.92
assign ( resid   83 and name HA   )   ( resid   83 and name HG2* )   2.70  0.90  0.90
assign ( resid   93 and name HN   )   ( resid   93 and name HB*  )   2.71  0.92  0.92
assign ( resid   99 and name HA   )   ( resid   99 and name HD1* )   3.54  1.75  1.75
assign ( resid   99 and name HN   )   ( resid   99 and name HD2* )   3.56  1.77  1.77
assign ( resid   99 and name HA   )   ( resid   99 and name HD2* )   2.71  0.92  0.92
assign ( resid    1 and name HE*  )   ( resid    2 and name HN   )   4.41  2.61  2.61
assign ( resid   11 and name HD1* )   ( resid   12 and name HN   )   4.41  2.61  2.61
assign ( resid   21 and name HG2* )   ( resid   22 and name HN   )   3.15  1.35  1.35
assign ( resid   28 and name HG2* )   ( resid   29 and name HN   )   3.25  1.46  1.46
assign ( resid   38 and name HG1* )   ( resid   39 and name HN   )   3.11  1.32  1.32
assign ( resid   38 and name HG2* )   ( resid   39 and name HN   )   3.49  1.69  1.69
assign ( resid   47 and name HG2* )   ( resid   48 and name HN   )   3.47  1.68  1.68
assign ( resid   70 and name HD1* )   ( resid   71 and name HN   )   3.80  2.00  2.00
assign ( resid   83 and name HG2* )   ( resid   84 and name HN   )   3.47  1.68  1.68
assign ( resid    4 and name HA   )   ( resid    7 and name HB*  )   3.04  1.24  1.24
assign ( resid    5 and name HA   )   ( resid    8 and name HB*  )   2.77  0.97  0.97
assign ( resid   10 and name HA   )   ( resid   13 and name HB*  )   3.11  1.32  1.32
assign ( resid    1 and name HB1  )   ( resid   44 and name HG1* )   3.81  2.02  2.02
assign ( resid    1 and name HG2  )   ( resid   44 and name HG2* )   3.79  2.00  2.00
assign ( resid    1 and name HG2  )   ( resid   44 and name HG1* )   3.71  1.91  1.91
assign ( resid    1 and name HG1  )   ( resid   44 and name HG2* )   3.79  2.00  2.00
assign ( resid    1 and name HE*  )   ( resid    9 and name HD1* )   3.39  1.59  1.59
assign ( resid    1 and name HE*  )   ( resid   86 and name HB1  )   3.97  2.18  2.18
assign ( resid    1 and name HE*  )   ( resid    6 and name HA   )   3.54  1.75  1.75
assign ( resid    1 and name HE*  )   ( resid    6 and name HN   )   4.41  2.61  2.61
assign ( resid    1 and name HE*  )   ( resid   86 and name HD*  )   4.73  2.94  2.94
assign ( resid    1 and name HA   )   ( resid    2 and name HG2* )   3.42  1.62  1.62
assign ( resid    3 and name HB2  )   ( resid   47 and name HG2* )   3.27  1.48  1.48
assign ( resid    2 and name HG2* )   ( resid    4 and name HB*  )   4.33  2.53  2.53
assign ( resid    6 and name HA   )   ( resid    9 and name HD1* )   3.02  1.23  1.23
assign ( resid    6 and name HA   )   ( resid   44 and name HG2* )   4.17  2.38  2.38
assign ( resid    6 and name HB1  )   ( resid   77 and name HG1* )   3.47  1.68  1.68
assign ( resid    6 and name HB2  )   ( resid   77 and name HG1* )   3.47  1.68  1.68
assign ( resid    7 and name HB*  )   ( resid   77 and name HG1* )   3.94  2.15  2.15
assign ( resid    7 and name HB*  )   ( resid   31 and name HB   )   3.79  2.00  2.00
assign ( resid    7 and name HB*  )   ( resid    8 and name HA   )   3.67  1.87  1.87
assign ( resid    3 and name HE*  )   ( resid    7 and name HB*  )   4.68  2.89  2.89
assign ( resid    7 and name HB*  )   ( resid    9 and name HN   )   4.23  2.43  2.43
assign ( resid    7 and name HN   )   ( resid    8 and name HB*  )   3.90  2.11  2.11
assign ( resid    8 and name HA   )   ( resid   11 and name HD1* )   2.99  1.19  1.19
assign ( resid    8 and name HB*  )   ( resid   11 and name HD1* )   4.67  2.87  2.87
assign ( resid    9 and name HD2* )   ( resid   12 and name HD*  )   4.02  2.23  2.23
assign ( resid    9 and name HD2* )   ( resid   80 and name HH2  )   3.72  1.93  1.93
assign ( resid   10 and name HB1  )   ( resid   77 and name HG1* )   3.83  2.04  2.04
assign ( resid   11 and name HG2* )   ( resid   24 and name HB*  )   3.76  1.97  1.97
assign ( resid   11 and name HD1* )   ( resid   27 and name HB1  )   3.11  1.32  1.32
assign ( resid   11 and name HD1* )   ( resid   24 and name HA   )   4.12  2.32  2.32
assign ( resid   11 and name HG2* )   ( resid   27 and name HB1  )   3.69  1.89  1.89
assign ( resid   11 and name HG2* )   ( resid   24 and name HA   )   3.51  1.71  1.71
assign ( resid    8 and name HA   )   ( resid   11 and name HG2* )   3.72  1.93  1.93
assign ( resid   11 and name HG2* )   ( resid   14 and name HN   )   3.96  2.16  2.16
assign ( resid   11 and name HD1* )   ( resid   28 and name HA   )   2.86  1.06  1.06
assign ( resid   11 and name HD1* )   ( resid   18 and name HZ3  )   4.10  2.31  2.31
assign ( resid   11 and name HD1* )   ( resid   27 and name HZ3  )   4.41  2.61  2.61
assign ( resid   11 and name HG2* )   ( resid   12 and name HA   )   3.16  1.37  1.37
assign ( resid    9 and name HD2* )   ( resid   12 and name HB*  )   3.80  2.01  2.01
assign ( resid   13 and name HB*  )   ( resid   80 and name HE1  )   3.56  1.77  1.77
assign ( resid   12 and name HN   )   ( resid   13 and name HB*  )   3.87  2.07  2.07
assign ( resid   12 and name HB*  )   ( resid   13 and name HB*  )   4.49  2.69  2.69
assign ( resid   15 and name HA   )   ( resid   24 and name HB*  )   3.49  1.69  1.69
assign ( resid   24 and name HB*  )   ( resid   25 and name HA   )   3.36  1.57  1.57
assign ( resid   11 and name HD1* )   ( resid   28 and name HB   )   3.96  2.16  2.16
assign ( resid   29 and name HB2  )   ( resid   30 and name HG2* )   4.24  2.45  2.45
assign ( resid   30 and name HA   )   ( resid   70 and name HD2* )   4.41  2.61  2.61
assign ( resid   30 and name HG2* )   ( resid   31 and name HA   )   3.69  1.89  1.89
assign ( resid   30 and name HG2* )   ( resid   33 and name HB   )   4.28  2.49  2.49
assign ( resid   29 and name HB1  )   ( resid   30 and name HG2* )   4.24  2.45  2.45
assign ( resid   30 and name HG2* )   ( resid   70 and name HD2* )   4.43  2.64  2.64
assign ( resid   31 and name HG12 )   ( resid   70 and name HD1* )   3.33  1.53  1.53
assign ( resid   31 and name HG11 )   ( resid   70 and name HD1* )   3.33  1.53  1.53
assign ( resid    7 and name HB*  )   ( resid   31 and name HD1* )   3.66  1.86  1.86
assign ( resid   30 and name HG2* )   ( resid   31 and name HD1* )   4.92  3.12  3.12
assign ( resid   31 and name HD1* )   ( resid   77 and name HG1* )   4.16  2.37  2.37
assign ( resid    7 and name HB*  )   ( resid   31 and name HG2* )   3.53  1.74  1.74
assign ( resid   31 and name HG2* )   ( resid   35 and name HB2  )   2.93  1.14  1.14
assign ( resid   28 and name HA   )   ( resid   31 and name HD1* )   3.29  1.50  1.50
assign ( resid   31 and name HD1* )   ( resid   74 and name HA   )   4.35  2.56  2.56
assign ( resid   27 and name HB2  )   ( resid   31 and name HD1* )   4.41  2.61  2.61
assign ( resid   27 and name HB1  )   ( resid   31 and name HD1* )   3.76  1.96  1.96
assign ( resid    3 and name HD*  )   ( resid   31 and name HG2* )   4.46  2.67  2.67
assign ( resid   30 and name HN   )   ( resid   31 and name HD1* )   4.16  2.36  2.36
assign ( resid   31 and name HD1* )   ( resid   74 and name HN   )   4.23  2.43  2.43
assign ( resid   31 and name HG2* )   ( resid   32 and name HA   )   3.47  1.68  1.68
assign ( resid   30 and name HA   )   ( resid   33 and name HG2* )   4.41  2.61  2.61
assign ( resid   33 and name HG2* )   ( resid   34 and name HA   )   4.39  2.59  2.59
assign ( resid   34 and name HB1  )   ( resid   55 and name HG1* )   3.15  1.35  1.35
assign ( resid   34 and name HB1  )   ( resid   70 and name HD1* )   4.07  2.27  2.27
assign ( resid   34 and name HB1  )   ( resid   70 and name HD2* )   3.15  1.35  1.35
assign ( resid   34 and name HB2  )   ( resid   55 and name HG1* )   3.40  1.60  1.60
assign ( resid   34 and name HB2  )   ( resid   59 and name HD1* )   3.87  2.07  2.07
assign ( resid   35 and name HA   )   ( resid   55 and name HG2* )   3.07  1.28  1.28
assign ( resid   35 and name HA   )   ( resid   38 and name HG2* )   3.72  1.93  1.93
assign ( resid   35 and name HA   )   ( resid   55 and name HG1* )   3.09  1.30  1.30
assign ( resid   31 and name HG2* )   ( resid   35 and name HB1  )   3.25  1.46  1.46
assign ( resid   35 and name HB2  )   ( resid   39 and name HD1* )   3.63  1.84  1.84
assign ( resid   37 and name HD2  )   ( resid   38 and name HG2* )   4.41  2.61  2.61
assign ( resid   37 and name HD1  )   ( resid   38 and name HG2* )   4.41  2.61  2.61
assign ( resid   37 and name HA   )   ( resid   38 and name HG2* )   3.78  1.98  1.98
assign ( resid   37 and name HB2  )   ( resid   38 and name HG2* )   3.79  2.00  2.00
assign ( resid   37 and name HB1  )   ( resid   38 and name HG2* )   3.79  2.00  2.00
assign ( resid   37 and name HG2  )   ( resid   38 and name HG2* )   3.90  2.11  2.11
assign ( resid   38 and name HB   )   ( resid   39 and name HG2* )   3.33  1.53  1.53
assign ( resid   38 and name HG1* )   ( resid   39 and name HG2* )   3.62  1.83  1.83
assign ( resid   38 and name HG1* )   ( resid   54 and name HB*  )   3.71  1.92  1.92
assign ( resid   37 and name HG1  )   ( resid   38 and name HG2* )   3.90  2.11  2.11
assign ( resid   38 and name HG2* )   ( resid   55 and name HG2* )   3.31  1.52  1.52
assign ( resid   38 and name HG1* )   ( resid   55 and name HA   )   3.74  1.95  1.95
assign ( resid   38 and name HG1* )   ( resid   54 and name HE*  )   4.49  2.69  2.69
assign ( resid   35 and name HA   )   ( resid   38 and name HG1* )   4.41  2.61  2.61
assign ( resid   38 and name HG1* )   ( resid   39 and name HA   )   3.83  2.04  2.04
assign ( resid   38 and name HG2* )   ( resid   54 and name HE*  )   4.85  3.05  3.05
assign ( resid   39 and name HG2* )   ( resid   47 and name HG2* )   3.94  2.15  2.15
assign ( resid   39 and name HD1* )   ( resid   74 and name HD1* )   4.00  2.20  2.20
assign ( resid   38 and name HG1* )   ( resid   39 and name HD1* )   4.63  2.83  2.83
assign ( resid   39 and name HG2* )   ( resid   51 and name HB1  )   2.84  1.05  1.05
assign ( resid   39 and name HD1* )   ( resid   51 and name HB2  )   3.53  1.73  1.73
assign ( resid   35 and name HB1  )   ( resid   39 and name HD1* )   3.31  1.51  1.51
assign ( resid   39 and name HG2* )   ( resid   47 and name HA   )   3.63  1.84  1.84
assign ( resid   39 and name HG2* )   ( resid   51 and name HA   )   3.74  1.95  1.95
assign ( resid   38 and name HA   )   ( resid   39 and name HG2* )   4.41  2.61  2.61
assign ( resid   39 and name HD1* )   ( resid   52 and name HA   )   3.80  2.00  2.00
assign ( resid   35 and name HA   )   ( resid   39 and name HD1* )   3.96  2.16  2.16
assign ( resid    3 and name HD*  )   ( resid   39 and name HD1* )   4.75  2.96  2.96
assign ( resid   39 and name HG2* )   ( resid   48 and name HN   )   4.12  2.32  2.32
assign ( resid    3 and name HD*  )   ( resid   39 and name HG2* )   5.47  3.68  3.68
assign ( resid   41 and name HD2  )   ( resid   42 and name HD2* )   4.35  2.56  2.56
assign ( resid   41 and name HD1  )   ( resid   42 and name HD2* )   4.35  2.56  2.56
assign ( resid    2 and name HG2* )   ( resid   42 and name HA   )   4.23  2.43  2.43
assign ( resid   42 and name HB1  )   ( resid   47 and name HG2* )   3.45  1.66  1.66
assign ( resid   39 and name HA   )   ( resid   42 and name HD2* )   3.67  1.87  1.87
assign ( resid   39 and name HA   )   ( resid   42 and name HD1* )   2.95  1.15  1.15
assign ( resid   42 and name HD2* )   ( resid   46 and name HB1  )   4.41  2.61  2.61
assign ( resid   42 and name HD2* )   ( resid   46 and name HB2  )   4.41  2.61  2.61
assign ( resid    2 and name HG2* )   ( resid   43 and name HA   )   3.40  1.60  1.60
assign ( resid   44 and name HG1* )   ( resid   87 and name HB1  )   3.90  2.11  2.11
assign ( resid   44 and name HG1* )   ( resid   81 and name HB*  )   4.11  2.31  2.31
assign ( resid    1 and name HB2  )   ( resid   44 and name HG1* )   3.81  2.02  2.02
assign ( resid    1 and name HG1  )   ( resid   44 and name HG1* )   3.71  1.91  1.91
assign ( resid    6 and name HB2  )   ( resid   44 and name HG1* )   3.15  1.35  1.35
assign ( resid    6 and name HB1  )   ( resid   44 and name HG1* )   3.15  1.35  1.35
assign ( resid   44 and name HG2* )   ( resid   81 and name HB*  )   3.91  2.11  2.11
assign ( resid    6 and name HB2  )   ( resid   44 and name HG2* )   3.15  1.35  1.35
assign ( resid    6 and name HB1  )   ( resid   44 and name HG2* )   3.15  1.35  1.35
assign ( resid   44 and name HG1* )   ( resid   86 and name HB1  )   3.15  1.35  1.35
assign ( resid   43 and name HA   )   ( resid   44 and name HG1* )   4.07  2.27  2.27
assign ( resid    3 and name HA   )   ( resid   44 and name HG1* )   3.26  1.46  1.46
assign ( resid    3 and name HA   )   ( resid   44 and name HG2* )   3.34  1.55  1.55
assign ( resid   44 and name HG2* )   ( resid   45 and name HA   )   4.35  2.56  2.56
assign ( resid   44 and name HG2* )   ( resid   78 and name HA   )   4.15  2.36  2.36
assign ( resid    3 and name HD*  )   ( resid   44 and name HG2* )   4.36  2.56  2.56
assign ( resid   44 and name HG2* )   ( resid   46 and name HN   )   4.19  2.40  2.40
assign ( resid    3 and name HD*  )   ( resid   44 and name HG1* )   5.38  3.59  3.59
assign ( resid   44 and name HG1* )   ( resid   46 and name HN   )   4.34  2.54  2.54
assign ( resid    6 and name HN   )   ( resid   44 and name HG1* )   4.41  2.61  2.61
assign ( resid    3 and name HN   )   ( resid   44 and name HG1* )   4.30  2.50  2.50
assign ( resid    3 and name HN   )   ( resid   44 and name HG2* )   4.32  2.52  2.52
assign ( resid   44 and name HG1* )   ( resid   45 and name HA   )   3.63  1.84  1.84
assign ( resid   46 and name HB1  )   ( resid   51 and name HD1* )   4.41  2.61  2.61
assign ( resid   47 and name HA   )   ( resid   51 and name HD1* )   2.93  1.14  1.14
assign ( resid    3 and name HD*  )   ( resid   47 and name HG1* )   5.17  3.37  3.37
assign ( resid   44 and name HA   )   ( resid   47 and name HG2* )   2.84  1.05  1.05
assign ( resid   44 and name HA   )   ( resid   47 and name HG1* )   4.41  2.61  2.61
assign ( resid    3 and name HB1  )   ( resid   47 and name HG2* )   3.27  1.48  1.48
assign ( resid   39 and name HB   )   ( resid   47 and name HG2* )   2.98  1.19  1.19
assign ( resid   42 and name HB2  )   ( resid   47 and name HG2* )   2.98  1.19  1.19
assign ( resid   47 and name HG1* )   ( resid   51 and name HB2  )   3.36  1.57  1.57
assign ( resid   39 and name HB   )   ( resid   47 and name HG1* )   3.63  1.84  1.84
assign ( resid   47 and name HA   )   ( resid   51 and name HD2* )   3.52  1.73  1.73
assign ( resid   47 and name HB   )   ( resid   78 and name HD2* )   3.34  1.55  1.55
assign ( resid   47 and name HG1* )   ( resid   52 and name HD1* )   3.71  1.92  1.92
assign ( resid   39 and name HD1* )   ( resid   47 and name HG2* )   4.04  2.24  2.24
assign ( resid   39 and name HD1* )   ( resid   47 and name HG1* )   3.91  2.11  2.11
assign ( resid   49 and name HA   )   ( resid   52 and name HG2* )   3.43  1.64  1.64
assign ( resid   49 and name HG2* )   ( resid   52 and name HB   )   3.54  1.75  1.75
assign ( resid   49 and name HG2* )   ( resid   53 and name HG2  )   3.83  2.04  2.04
assign ( resid   39 and name HG2* )   ( resid   51 and name HB2  )   3.16  1.37  1.37
assign ( resid   51 and name HD2* )   ( resid   54 and name HD*  )   3.57  1.78  1.78
assign ( resid   51 and name HD2* )   ( resid   54 and name HE*  )   4.47  2.67  2.67
assign ( resid   52 and name HA   )   ( resid   55 and name HG2* )   3.20  1.41  1.41
assign ( resid   52 and name HG2* )   ( resid   93 and name HB*  )   4.07  2.28  2.28
assign ( resid   52 and name HG2* )   ( resid   56 and name HB2  )   3.04  1.24  1.24
assign ( resid   52 and name HD1* )   ( resid   92 and name HB2  )   3.17  1.37  1.37
assign ( resid   52 and name HD1* )   ( resid   74 and name HB   )   3.78  1.98  1.98
assign ( resid   52 and name HD1* )   ( resid   92 and name HG2  )   3.76  1.96  1.96
assign ( resid   49 and name HA   )   ( resid   52 and name HD1* )   3.27  1.48  1.48
assign ( resid   52 and name HD1* )   ( resid   93 and name HA   )   3.22  1.42  1.42
assign ( resid   52 and name HD1* )   ( resid   93 and name HN   )   3.74  1.95  1.95
assign ( resid   49 and name HG2* )   ( resid   53 and name HE*  )   3.91  2.11  2.11
assign ( resid   52 and name HG2* )   ( resid   53 and name HE*  )   4.72  2.92  2.92
assign ( resid   52 and name HG2* )   ( resid   53 and name HA   )   3.36  1.57  1.57
assign ( resid   49 and name HG2* )   ( resid   53 and name HG1  )   3.83  2.04  2.04
assign ( resid   50 and name HA   )   ( resid   53 and name HE*  )   3.43  1.64  1.64
assign ( resid   53 and name HE*  )   ( resid   95 and name HZ2  )   3.72  1.93  1.93
assign ( resid   53 and name HE*  )   ( resid   95 and name HH2  )   3.61  1.82  1.82
assign ( resid   53 and name HE*  )   ( resid   95 and name HE1  )   3.81  2.02  2.02
assign ( resid   38 and name HG1* )   ( resid   54 and name HA   )   4.05  2.25  2.25
assign ( resid   54 and name HB*  )   ( resid   55 and name HG2* )   4.20  2.40  2.40
assign ( resid   51 and name HD2* )   ( resid   54 and name HB*  )   4.02  2.22  2.22
assign ( resid   51 and name HD2* )   ( resid   54 and name HG2  )   3.83  2.04  2.04
assign ( resid   51 and name HD2* )   ( resid   54 and name HG1  )   3.83  2.04  2.04
assign ( resid   34 and name HN   )   ( resid   55 and name HG1* )   4.21  2.41  2.41
assign ( resid   54 and name HN   )   ( resid   55 and name HG2* )   3.65  1.86  1.86
assign ( resid   55 and name HG1* )   ( resid   56 and name HA   )   3.42  1.62  1.62
assign ( resid   52 and name HA   )   ( resid   55 and name HG1* )   4.25  2.45  2.45
assign ( resid   38 and name HG2* )   ( resid   55 and name HA   )   3.09  1.30  1.30
assign ( resid   38 and name HB   )   ( resid   55 and name HG1* )   3.13  1.33  1.33
assign ( resid   55 and name HG1* )   ( resid   56 and name HD2* )   3.82  2.02  2.02
assign ( resid   55 and name HG1* )   ( resid   59 and name HD1* )   4.20  2.40  2.40
assign ( resid   39 and name HG2* )   ( resid   55 and name HG2* )   3.73  1.93  1.93
assign ( resid   38 and name HB   )   ( resid   55 and name HG2* )   2.80  1.01  1.01
assign ( resid   39 and name HD1* )   ( resid   55 and name HG2* )   4.11  2.31  2.31
assign ( resid   39 and name HD1* )   ( resid   55 and name HG1* )   4.83  3.03  3.03
assign ( resid   56 and name HD1* )   ( resid   59 and name HD1* )   4.83  3.03  3.03
assign ( resid   56 and name HD2* )   ( resid   70 and name HG   )   3.07  1.28  1.28
assign ( resid   56 and name HD2* )   ( resid   70 and name HB1  )   3.20  1.41  1.41
assign ( resid   56 and name HD2* )   ( resid   71 and name HA   )   3.69  1.89  1.89
assign ( resid   56 and name HD1* )   ( resid   71 and name HB1  )   3.71  1.91  1.91
assign ( resid   58 and name HG*  )   ( resid   59 and name HG2* )   4.85  3.06  3.06
assign ( resid   59 and name HG2* )   ( resid   70 and name HD2* )   3.46  1.66  1.66
assign ( resid   59 and name HG2* )   ( resid   63 and name HB2  )   3.06  1.26  1.26
assign ( resid   59 and name HG2* )   ( resid   63 and name HB1  )   3.24  1.44  1.44
assign ( resid   59 and name HD1* )   ( resid   70 and name HD2* )   3.86  2.06  2.06
assign ( resid   34 and name HB1  )   ( resid   59 and name HD1* )   3.51  1.71  1.71
assign ( resid   56 and name HA   )   ( resid   59 and name HD1* )   3.11  1.32  1.32
assign ( resid   34 and name HD*  )   ( resid   59 and name HG2* )   5.47  3.68  3.68
assign ( resid   59 and name HG2* )   ( resid   67 and name HN   )   3.18  1.39  1.39
assign ( resid   60 and name HB*  )   ( resid   67 and name HB*  )   4.00  2.21  2.21
assign ( resid   63 and name HB1  )   ( resid   66 and name HG2* )   3.72  1.93  1.93
assign ( resid   64 and name HB2  )   ( resid   67 and name HB*  )   4.05  2.25  2.25
assign ( resid   64 and name HB1  )   ( resid   67 and name HB*  )   3.90  2.11  2.11
assign ( resid   59 and name HG2* )   ( resid   66 and name HB   )   3.20  1.41  1.41
assign ( resid   59 and name HG2* )   ( resid   66 and name HG2* )   3.82  2.02  2.02
assign ( resid   66 and name HG2* )   ( resid   70 and name HD2* )   4.86  3.07  3.07
assign ( resid   59 and name HD1* )   ( resid   66 and name HG2* )   4.21  2.42  2.42
assign ( resid   30 and name HG2* )   ( resid   66 and name HG2* )   4.52  2.73  2.73
assign ( resid   63 and name HB2  )   ( resid   66 and name HG2* )   3.36  1.57  1.57
assign ( resid   66 and name HG2* )   ( resid   67 and name HA   )   3.99  2.20  2.20
assign ( resid   66 and name HG2* )   ( resid   70 and name HN   )   4.15  2.36  2.36
assign ( resid   59 and name HD1* )   ( resid   67 and name HA   )   3.36  1.57  1.57
assign ( resid   59 and name HD1* )   ( resid   67 and name HB*  )   4.56  2.76  2.76
assign ( resid   56 and name HD2* )   ( resid   67 and name HA   )   3.04  1.24  1.24
assign ( resid   60 and name HA   )   ( resid   67 and name HB*  )   2.86  1.06  1.06
assign ( resid   64 and name HA   )   ( resid   67 and name HB*  )   2.91  1.12  1.12
assign ( resid   67 and name HB*  )   ( resid   70 and name HN   )   4.41  2.61  2.61
assign ( resid   59 and name HD1* )   ( resid   70 and name HD1* )   4.49  2.69  2.69
assign ( resid   30 and name HG2* )   ( resid   70 and name HD1* )   4.00  2.20  2.20
assign ( resid   34 and name HB2  )   ( resid   70 and name HD1* )   3.87  2.07  2.07
assign ( resid   34 and name HB2  )   ( resid   70 and name HD2* )   3.20  1.41  1.41
assign ( resid   31 and name HA   )   ( resid   70 and name HD1* )   3.17  1.37  1.37
assign ( resid   30 and name HB   )   ( resid   70 and name HD1* )   3.08  1.28  1.28
assign ( resid   31 and name HA   )   ( resid   70 and name HD2* )   3.88  2.09  2.09
assign ( resid   30 and name HB   )   ( resid   70 and name HD2* )   3.76  1.96  1.96
assign ( resid   31 and name HN   )   ( resid   70 and name HD1* )   4.41  2.61  2.61
assign ( resid   71 and name HA   )   ( resid   93 and name HB*  )   3.58  1.78  1.78
assign ( resid   56 and name HD1* )   ( resid   71 and name HA   )   3.29  1.50  1.50
assign ( resid   71 and name HA   )   ( resid   74 and name HD1* )   3.06  1.26  1.26
assign ( resid   52 and name HD1* )   ( resid   74 and name HG2* )   3.42  1.63  1.63
assign ( resid   39 and name HD1* )   ( resid   74 and name HG2* )   4.29  2.49  2.49
assign ( resid   74 and name HG2* )   ( resid   77 and name HB   )   3.00  1.21  1.21
assign ( resid   52 and name HD1* )   ( resid   74 and name HD1* )   3.39  1.59  1.59
assign ( resid   55 and name HG2* )   ( resid   74 and name HD1* )   4.68  2.89  2.89
assign ( resid   70 and name HG   )   ( resid   74 and name HD1* )   3.24  1.44  1.44
assign ( resid   55 and name HB   )   ( resid   74 and name HD1* )   4.10  2.31  2.31
assign ( resid   71 and name HA   )   ( resid   74 and name HG2* )   3.74  1.95  1.95
assign ( resid    3 and name HE*  )   ( resid   74 and name HD1* )   5.47  3.68  3.68
assign ( resid    3 and name HZ   )   ( resid   74 and name HD1* )   3.83  2.04  2.04
assign ( resid   75 and name HA   )   ( resid   78 and name HD1* )   3.60  1.80  1.80
assign ( resid   10 and name HB2  )   ( resid   77 and name HG2* )   3.52  1.73  1.73
assign ( resid   10 and name HB2  )   ( resid   77 and name HG1* )   3.83  2.04  2.04
assign ( resid   10 and name HB1  )   ( resid   77 and name HG2* )   3.52  1.73  1.73
assign ( resid   74 and name HA   )   ( resid   77 and name HG2* )   3.52  1.73  1.73
assign ( resid    7 and name HA   )   ( resid   77 and name HG2* )   2.98  1.19  1.19
assign ( resid   76 and name HB2  )   ( resid   77 and name HG2* )   4.41  2.61  2.61
assign ( resid   76 and name HB1  )   ( resid   77 and name HG2* )   4.41  2.61  2.61
assign ( resid    7 and name HA   )   ( resid   77 and name HG1* )   2.97  1.17  1.17
assign ( resid   77 and name HG1* )   ( resid   78 and name HA   )   3.92  2.13  2.13
assign ( resid    3 and name HE*  )   ( resid   77 and name HG2* )   4.97  3.17  3.17
assign ( resid   52 and name HD1* )   ( resid   78 and name HD1* )   4.00  2.20  2.20
assign ( resid   44 and name HA   )   ( resid   78 and name HD2* )   3.40  1.60  1.60
assign ( resid   78 and name HD2* )   ( resid   87 and name HD1  )   3.33  1.53  1.53
assign ( resid   78 and name HD2* )   ( resid   87 and name HD2  )   3.33  1.53  1.53
assign ( resid    3 and name HE*  )   ( resid   78 and name HD1* )   4.70  2.90  2.90
assign ( resid   78 and name HD2* )   ( resid   81 and name HN   )   4.41  2.61  2.61
assign ( resid   80 and name HA   )   ( resid   83 and name HG1* )   3.51  1.71  1.71
assign ( resid   81 and name HB*  )   ( resid   86 and name HB1  )   3.04  1.24  1.24
assign ( resid   81 and name HB*  )   ( resid   86 and name HB2  )   2.95  1.15  1.15
assign ( resid   77 and name HG1* )   ( resid   81 and name HB*  )   4.50  2.71  2.71
assign ( resid   78 and name HD2* )   ( resid   81 and name HB*  )   4.12  2.33  2.33
assign ( resid   78 and name HA   )   ( resid   81 and name HB*  )   2.79  0.99  0.99
assign ( resid   81 and name HB*  )   ( resid   87 and name HN   )   3.65  1.86  1.86
assign ( resid   80 and name HE3  )   ( resid   81 and name HB*  )   3.51  1.71  1.71
assign ( resid   81 and name HB*  )   ( resid   82 and name HA   )   3.69  1.89  1.89
assign ( resid   82 and name HG2* )   ( resid   83 and name HA   )   3.61  1.82  1.82
assign ( resid   80 and name HA   )   ( resid   83 and name HG2* )   3.11  1.32  1.32
assign ( resid   82 and name HB   )   ( resid   83 and name HG2* )   3.69  1.89  1.89
assign ( resid   83 and name HG1* )   ( resid   84 and name HD2  )   4.01  2.22  2.22
assign ( resid   83 and name HG1* )   ( resid   84 and name HD1  )   4.01  2.22  2.22
assign ( resid   44 and name HG2* )   ( resid   86 and name HB2  )   4.10  2.31  2.31
assign ( resid   44 and name HG1* )   ( resid   86 and name HB2  )   3.54  1.75  1.75
assign ( resid   44 and name HG2* )   ( resid   86 and name HB1  )   3.78  1.98  1.98
assign ( resid   78 and name HD1* )   ( resid   92 and name HD2  )   3.29  1.50  1.50
assign ( resid   78 and name HD1* )   ( resid   92 and name HD1  )   3.29  1.50  1.50
assign ( resid   49 and name HG2* )   ( resid   92 and name HA   )   3.52  1.73  1.73
assign ( resid   49 and name HG2* )   ( resid   92 and name HB2  )   4.26  2.47  2.47
assign ( resid   78 and name HD1* )   ( resid   92 and name HB2  )   3.47  1.68  1.68
assign ( resid   52 and name HD1* )   ( resid   92 and name HB1  )   3.63  1.84  1.84
assign ( resid   78 and name HD1* )   ( resid   92 and name HB1  )   3.60  1.80  1.80
assign ( resid   78 and name HD1* )   ( resid   92 and name HG2  )   3.22  1.42  1.42
assign ( resid   47 and name HG1* )   ( resid   92 and name HG2  )   3.72  1.93  1.93
assign ( resid   78 and name HD1* )   ( resid   92 and name HG1  )   3.22  1.42  1.42
assign ( resid   47 and name HG1* )   ( resid   92 and name HG1  )   3.72  1.93  1.93
assign ( resid   52 and name HD1* )   ( resid   92 and name HG1  )   3.76  1.96  1.96
assign ( resid   52 and name HG2* )   ( resid   93 and name HA   )   3.24  1.44  1.44
assign ( resid   74 and name HG2* )   ( resid   93 and name HB*  )   3.60  1.81  1.81
assign ( resid   52 and name HD1* )   ( resid   93 and name HB*  )   3.87  2.08  2.08
assign ( resid   74 and name HB   )   ( resid   93 and name HB*  )   3.07  1.28  1.28
assign ( resid   75 and name HG1  )   ( resid   93 and name HB*  )   3.40  1.60  1.60
assign ( resid   75 and name HG2  )   ( resid   93 and name HB*  )   3.40  1.60  1.60
assign ( resid   75 and name HB2  )   ( resid   93 and name HB*  )   3.51  1.71  1.71
assign ( resid   75 and name HA   )   ( resid   93 and name HB*  )   2.79  0.99  0.99
assign ( resid   91 and name HD21 )   ( resid   93 and name HB*  )   3.54  1.75  1.75
assign ( resid    7 and name HB*  )   ( resid   77 and name HG2* )   3.98  2.19  2.19
assign ( resid    7 and name HB*  )   ( resid   11 and name HD1* )   4.36  2.56  2.56
assign ( resid   11 and name HD1* )   ( resid   24 and name HB*  )   4.92  3.12  3.12
assign ( resid   11 and name HD1* )   ( resid   27 and name HB2  )   3.20  1.41  1.41
assign ( resid   11 and name HG2* )   ( resid   27 and name HB2  )   3.87  2.07  2.07
assign ( resid   39 and name HG2* )   ( resid   42 and name HD1* )   3.89  2.10  2.10
assign ( resid   39 and name HG2* )   ( resid   51 and name HD1* )   3.85  2.06  2.06
assign ( resid   39 and name HB   )   ( resid   42 and name HD1* )   3.47  1.68  1.68
assign ( resid   39 and name HB   )   ( resid   51 and name HD1* )   3.54  1.75  1.75
assign ( resid   39 and name HD1* )   ( resid   51 and name HD1* )   4.56  2.76  2.76
assign ( resid    3 and name HE*  )   ( resid   39 and name HD1* )   4.77  2.98  2.98
assign ( resid   38 and name HG2* )   ( resid   54 and name HB*  )   4.43  2.64  2.64
assign ( resid   55 and name HG1* )   ( resid   70 and name HD2* )   3.87  2.08  2.08
assign ( resid   56 and name HD2* )   ( resid   59 and name HD1* )   3.98  2.19  2.19
assign ( resid   67 and name HA   )   ( resid   70 and name HD2* )   3.85  2.05  2.05
assign ( resid   56 and name HD1* )   ( resid   70 and name HD2* )   4.47  2.67  2.67
assign ( resid   55 and name HG1* )   ( resid   70 and name HD1* )   4.63  2.83  2.83
assign ( resid   31 and name HD1* )   ( resid   70 and name HD1* )   4.00  2.20  2.20
assign ( resid   74 and name HG2* )   ( resid   75 and name HA   )   3.54  1.75  1.75
assign ( resid   78 and name HD1* )   ( resid   93 and name HB*  )   3.98  2.19  2.19
assign ( resid   75 and name HB1  )   ( resid   93 and name HB*  )   3.51  1.71  1.71
assign ( resid   38 and name HG1* )   ( resid   51 and name HA   )   3.65  1.86  1.86
assign ( resid   59 and name HB   )   ( resid   67 and name HB*  )   3.09  1.30  1.30
assign ( resid   59 and name HG2* )   ( resid   67 and name HA   )   3.27  1.48  1.48
assign ( resid    2 and name HG2* )   ( resid   41 and name HA   )   2.88  1.08  1.08
assign ( resid   46 and name HB2  )   ( resid   51 and name HD1* )   4.41  2.61  2.61
assign ( resid   52 and name HG2* )   ( resid   55 and name HB   )   3.81  2.02  2.02
assign ( resid   59 and name HG2* )   ( resid   63 and name HD*  )   4.33  2.53  2.53
assign ( resid   63 and name HE*  )   ( resid   66 and name HG2* )   4.52  2.73  2.73
assign ( resid   59 and name HG2* )   ( resid   63 and name HE*  )   4.49  2.69  2.69
assign ( resid   63 and name HD*  )   ( resid   66 and name HG2* )   3.75  1.96  1.96
assign ( resid   59 and name HG2* )   ( resid   66 and name HA   )   4.10  2.31  2.31
assign ( resid   56 and name HD1* )   ( resid   71 and name HG2  )   3.51  1.71  1.71
assign ( resid   56 and name HD1* )   ( resid   71 and name HG1  )   3.51  1.71  1.71
assign ( resid   56 and name HD1* )   ( resid   71 and name HB2  )   3.71  1.91  1.91
assign ( resid   44 and name HG1* )   ( resid   87 and name HB2  )   3.90  2.11  2.11
assign ( resid   60 and name HE3  )   ( resid   67 and name HB*  )   3.36  1.57  1.57
assign ( resid   25 and name HA   )   ( resid   28 and name HG2* )   3.92  2.13  2.13
assign ( resid   28 and name HG2* )   ( resid   29 and name HA   )   3.58  1.78  1.78
assign ( resid    8 and name HB*  )   ( resid    9 and name HD2* )   4.92  3.12  3.12
assign ( resid   78 and name HD2* )   ( resid   87 and name HE   )   3.72  1.93  1.93
assign ( resid   18 and name HB*  )   ( resid   24 and name HB*  )   4.58  2.78  2.78
assign ( resid   39 and name HD1* )   ( resid   52 and name HD1* )   4.59  2.80  2.80
assign ( resid   52 and name HG2* )   ( resid   74 and name HD1* )   3.78  1.99  1.99
assign ( resid   52 and name HG2* )   ( resid   71 and name HA   )   3.72  1.93  1.93
assign ( resid   74 and name HD1* )   ( resid   93 and name HB*  )   4.31  2.51  2.51
assign ( resid   27 and name HA   )   ( resid   31 and name HD1* )   3.71  1.91  1.91
assign ( resid   14 and name HA   )   ( resid   14 and name HD2  )   2.94  1.15  1.15
assign ( resid   23 and name HA   )   ( resid   23 and name HD2  )   3.21  1.42  1.42
assign ( resid   27 and name HN   )   ( resid   27 and name HD1  )   2.51  0.72  0.72
assign ( resid   27 and name HA   )   ( resid   27 and name HD1  )   3.27  1.47  1.47
assign ( resid   27 and name HB2  )   ( resid   27 and name HD1  )   2.73  0.93  0.93
assign ( resid   27 and name HA   )   ( resid   27 and name HE3  )   3.09  1.29  1.29
assign ( resid   27 and name HB1  )   ( resid   27 and name HE3  )   2.22  0.43  0.43
assign ( resid   60 and name HA   )   ( resid   60 and name HE3  )   2.62  0.82  0.82
assign ( resid   80 and name HA   )   ( resid   80 and name HD1  )   2.58  0.79  0.79
assign ( resid   80 and name HB2  )   ( resid   80 and name HD1  )   2.49  0.70  0.70
assign ( resid   80 and name HB1  )   ( resid   80 and name HE3  )   2.91  1.11  1.11
assign ( resid   10 and name HD*  )   ( resid   11 and name HN   )   4.04  2.25  2.25
assign ( resid   34 and name HD*  )   ( resid   35 and name HN   )   3.94  2.14  2.14
assign ( resid   98 and name HD*  )   ( resid   99 and name HN   )   3.90  2.10  2.10
assign ( resid    3 and name HE*  )   ( resid   77 and name HB   )   3.88  2.09  2.09
assign ( resid    3 and name HZ   )   ( resid   74 and name HA   )   2.55  0.75  0.75
assign ( resid    3 and name HD*  )   ( resid   40 and name HA2  )   3.76  1.96  1.96
assign ( resid   10 and name HD*  )   ( resid   11 and name HG11 )   4.26  2.46  2.46
assign ( resid   10 and name HD*  )   ( resid   11 and name HG12 )   4.26  2.46  2.46
assign ( resid   10 and name HD*  )   ( resid   77 and name HA   )   3.43  1.64  1.64
assign ( resid   10 and name HD*  )   ( resid   80 and name HB2  )   3.74  1.94  1.94
assign ( resid    7 and name HA   )   ( resid   10 and name HD*  )   4.06  2.27  2.27
assign ( resid   10 and name HD*  )   ( resid   80 and name HB1  )   3.68  1.89  1.89
assign ( resid   10 and name HE*  )   ( resid   77 and name HA   )   3.96  2.16  2.16
assign ( resid   10 and name HE*  )   ( resid   80 and name HB2  )   3.70  1.91  1.91
assign ( resid   10 and name HE*  )   ( resid   80 and name HB1  )   3.97  2.18  2.18
assign ( resid   10 and name HE*  )   ( resid   18 and name HH2  )   3.97  2.18  2.18
assign ( resid   10 and name HD*  )   ( resid   80 and name HN   )   4.58  2.79  2.79
assign ( resid   10 and name HD*  )   ( resid   80 and name HE3  )   3.97  2.18  2.18
assign ( resid   10 and name HE*  )   ( resid   80 and name HD1  )   4.96  3.17  3.17
assign ( resid   27 and name HH2  )   ( resid   73 and name HA   )   2.53  0.73  0.73
assign ( resid   27 and name HH2  )   ( resid   76 and name HB2  )   2.84  1.04  1.04
assign ( resid   27 and name HH2  )   ( resid   76 and name HB1  )   2.84  1.04  1.04
assign ( resid   27 and name HZ3  )   ( resid   73 and name HA   )   2.94  1.15  1.15
assign ( resid   24 and name HA   )   ( resid   27 and name HD1  )   3.79  1.99  1.99
assign ( resid   23 and name HA   )   ( resid   27 and name HD1  )   2.85  1.06  1.06
assign ( resid   26 and name HB2  )   ( resid   27 and name HD1  )   3.16  1.36  1.36
assign ( resid   30 and name HA   )   ( resid   34 and name HD*  )   3.65  1.85  1.85
assign ( resid   33 and name HB   )   ( resid   34 and name HD*  )   3.86  2.07  2.07
assign ( resid   30 and name HB   )   ( resid   34 and name HE*  )   3.81  2.02  2.02
assign ( resid   84 and name HB2  )   ( resid   86 and name HD*  )   4.31  2.52  2.52
assign ( resid   84 and name HD1  )   ( resid   86 and name HE*  )   4.42  2.63  2.63
assign ( resid   84 and name HD2  )   ( resid   86 and name HE*  )   4.42  2.63  2.63
assign ( resid   84 and name HB1  )   ( resid   86 and name HE*  )   4.17  2.38  2.38
assign ( resid   84 and name HB2  )   ( resid   86 and name HE*  )   4.26  2.47  2.47
assign ( resid   81 and name HA   )   ( resid   86 and name HD*  )   3.41  1.62  1.62
assign ( resid   81 and name HA   )   ( resid   86 and name HE*  )   4.06  2.27  2.27
assign ( resid   80 and name HH2  )   ( resid   86 and name HE*  )   3.83  2.04  2.04
assign ( resid   80 and name HZ3  )   ( resid   86 and name HE*  )   3.79  2.00  2.00
assign ( resid   95 and name HA   )   ( resid   95 and name HD1  )   2.21  0.41  0.41
assign ( resid   98 and name HD*  )   ( resid   99 and name HA   )   4.28  2.48  2.48
assign ( resid   98 and name HD*  )   ( resid   99 and name HG   )   4.06  2.27  2.27
assign ( resid   30 and name HB   )   ( resid   34 and name HD*  )   3.56  1.76  1.76
assign ( resid   30 and name HA   )   ( resid   34 and name HE*  )   4.17  2.38  2.38
assign ( resid   80 and name HZ3  )   ( resid   86 and name HD*  )   4.15  2.36  2.36
assign ( resid   10 and name HE*  )   ( resid   76 and name HB2  )   4.96  3.17  3.17
assign ( resid   60 and name HE3  )   ( resid   64 and name HA   )   2.75  0.95  0.95
assign ( resid    9 and name HB1  )   ( resid   80 and name HH2  )   2.22  0.43  0.43
assign ( resid    9 and name HB2  )   ( resid   80 and name HH2  )   2.40  0.61  0.61
assign ( resid    9 and name HB1  )   ( resid   80 and name HZ3  )   2.89  1.09  1.09
assign ( resid    9 and name HB2  )   ( resid   80 and name HZ3  )   2.80  1.00  1.00
assign ( resid    6 and name HA   )   ( resid   80 and name HZ3  )   3.02  1.22  1.22
assign ( resid    9 and name HB2  )   ( resid   80 and name HZ2  )   3.29  1.49  1.49
assign ( resid   18 and name HA   )   ( resid   18 and name HD1  )   2.10  0.30  0.30
assign ( resid   15 and name HA   )   ( resid   18 and name HE3  )   2.49  0.70  0.70
assign ( resid   18 and name HE3  )   ( resid   24 and name HA   )   2.67  0.88  0.88
assign ( resid   18 and name HZ3  )   ( resid   24 and name HA   )   2.40  0.61  0.61
assign ( resid   11 and name HA   )   ( resid   18 and name HZ3  )   2.46  0.66  0.66
assign ( resid   11 and name HA   )   ( resid   18 and name HH2  )   2.78  0.99  0.99
assign ( resid   10 and name HE*  )   ( resid   18 and name HZ2  )   3.83  2.04  2.04
assign ( resid   80 and name HE3  )   ( resid   81 and name HN   )   2.76  0.97  0.97
assign ( resid   60 and name HN   )   ( resid   60 and name HD1  )   3.02  1.22  1.22
assign ( resid    3 and name HD*  )   ( resid   47 and name HG2* )   4.21  2.42  2.42
assign ( resid    3 and name HD*  )   ( resid   78 and name HD2* )   4.23  2.43  2.43
assign ( resid    3 and name HE*  )   ( resid   78 and name HD2* )   4.14  2.35  2.35
assign ( resid    3 and name HE*  )   ( resid   74 and name HG2* )   4.43  2.63  2.63
assign ( resid    3 and name HE*  )   ( resid   77 and name HG1* )   4.41  2.62  2.62
assign ( resid    3 and name HZ   )   ( resid   31 and name HG2* )   3.07  1.28  1.28
assign ( resid    3 and name HZ   )   ( resid   74 and name HG2* )   2.89  1.10  1.10
assign ( resid    3 and name HZ   )   ( resid   77 and name HG1* )   3.26  1.46  1.46
assign ( resid   10 and name HD*  )   ( resid   11 and name HD1* )   4.48  2.69  2.69
assign ( resid   10 and name HD*  )   ( resid   77 and name HG1* )   4.52  2.72  2.72
assign ( resid   10 and name HE*  )   ( resid   77 and name HG2* )   4.68  2.89  2.89
assign ( resid   56 and name HD1* )   ( resid   60 and name HH2  )   3.89  2.09  2.09
assign ( resid   11 and name HD1* )   ( resid   27 and name HE3  )   2.84  1.05  1.05
assign ( resid   27 and name HE3  )   ( resid   31 and name HD1* )   2.81  1.01  1.01
assign ( resid   27 and name HE3  )   ( resid   77 and name HG2* )   3.54  1.75  1.75
assign ( resid   27 and name HZ3  )   ( resid   31 and name HD1* )   3.22  1.42  1.42
assign ( resid   27 and name HZ3  )   ( resid   77 and name HG2* )   2.64  0.85  0.85
assign ( resid   27 and name HH2  )   ( resid   77 and name HG2* )   3.11  1.32  1.32
assign ( resid   30 and name HG2* )   ( resid   34 and name HD*  )   4.23  2.43  2.43
assign ( resid   34 and name HD*  )   ( resid   55 and name HG1* )   4.54  2.74  2.74
assign ( resid   34 and name HD*  )   ( resid   70 and name HD2* )   4.01  2.22  2.22
assign ( resid   34 and name HD*  )   ( resid   70 and name HD1* )   4.36  2.56  2.56
assign ( resid   33 and name HG2* )   ( resid   34 and name HD*  )   4.35  2.56  2.56
assign ( resid   34 and name HD*  )   ( resid   59 and name HD1* )   4.14  2.34  2.34
assign ( resid   30 and name HG2* )   ( resid   34 and name HE*  )   4.02  2.22  2.22
assign ( resid   34 and name HE*  )   ( resid   66 and name HG2* )   4.11  2.31  2.31
assign ( resid   34 and name HE*  )   ( resid   59 and name HG2* )   4.16  2.36  2.36
assign ( resid   34 and name HE*  )   ( resid   70 and name HD2* )   4.81  3.01  3.01
assign ( resid   33 and name HG2* )   ( resid   34 and name HE*  )   4.21  2.42  2.42
assign ( resid   34 and name HE*  )   ( resid   59 and name HD1* )   4.48  2.69  2.69
assign ( resid   56 and name HD1* )   ( resid   60 and name HZ2  )   3.31  1.51  1.51
assign ( resid   13 and name HB*  )   ( resid   80 and name HZ2  )   2.64  0.85  0.85
assign ( resid   81 and name HB*  )   ( resid   86 and name HD*  )   4.03  2.24  2.24
assign ( resid   44 and name HG1* )   ( resid   86 and name HD*  )   4.61  2.81  2.81
assign ( resid   81 and name HB*  )   ( resid   86 and name HE*  )   4.74  2.94  2.94
assign ( resid    1 and name HE*  )   ( resid   86 and name HE*  )   4.41  2.62  2.62
assign ( resid    9 and name HD1* )   ( resid   86 and name HE*  )   4.50  2.71  2.71
assign ( resid   52 and name HG2* )   ( resid   95 and name HZ3  )   3.36  1.57  1.57
assign ( resid   98 and name HD*  )   ( resid   99 and name HD2* )   4.52  2.72  2.72
assign ( resid   98 and name HE*  )   ( resid   99 and name HD1* )   4.72  2.92  2.92
assign ( resid   98 and name HE*  )   ( resid   99 and name HD2* )   4.30  2.51  2.51
assign ( resid    3 and name HE*  )   ( resid   31 and name HG2* )   4.11  2.31  2.31
assign ( resid    3 and name HD*  )   ( resid    7 and name HB*  )   4.72  2.92  2.92
assign ( resid    3 and name HE*  )   ( resid   31 and name HD1* )   4.45  2.65  2.65
assign ( resid    3 and name HZ   )   ( resid   77 and name HG2* )   3.15  1.35  1.35
assign ( resid    3 and name HZ   )   ( resid   31 and name HD1* )   3.00  1.21  1.21
assign ( resid   10 and name HD*  )   ( resid   77 and name HG2* )   4.35  2.56  2.56
assign ( resid    3 and name HZ   )   ( resid   39 and name HD1* )   3.83  2.04  2.04
assign ( resid    9 and name HD1* )   ( resid   80 and name HH2  )   2.91  1.12  1.12
assign ( resid   13 and name HB*  )   ( resid   80 and name HH2  )   3.22  1.42  1.42
assign ( resid    9 and name HD1* )   ( resid   80 and name HZ3  )   3.51  1.71  1.71
assign ( resid   18 and name HE3  )   ( resid   24 and name HB*  )   2.68  0.88  0.88
assign ( resid   18 and name HZ3  )   ( resid   24 and name HB*  )   3.20  1.41  1.41
assign ( resid   11 and name HG2* )   ( resid   18 and name HZ3  )   2.70  0.90  0.90
assign ( resid   11 and name HG2* )   ( resid   18 and name HH2  )   3.40  1.60  1.60
assign ( resid   52 and name HG2* )   ( resid   95 and name HZ2  )   3.16  1.37  1.37
assign ( resid   21 and name HG2* )   ( resid   23 and name HD2  )   3.49  1.69  1.69
assign ( resid   60 and name HD1  )   ( resid   67 and name HB*  )   3.42  1.62  1.62
assign ( resid   52 and name HG2* )   ( resid   95 and name HH2  )   3.04  1.24  1.24
assign ( resid   56 and name HD1* )   ( resid   95 and name HH2  )   2.93  1.14  1.14
assign ( resid   60 and name HD1  )   ( resid   99 and name HD2* )   4.17  2.38  2.38
assign ( resid    1 and name HA   )   ( resid    1 and name HG*  )   2.72  0.93  0.93
assign ( resid    1 and name HB*  )   ( resid    2 and name HN   )   2.98  1.19  1.19
assign ( resid    1 and name HB*  )   ( resid   44 and name HG1* )   3.61  1.82  1.82
assign ( resid    1 and name HB*  )   ( resid   44 and name HG2* )   4.70  2.91  2.91
assign ( resid    1 and name HB*  )   ( resid   86 and name HD*  )   4.66  2.87  2.87
assign ( resid    1 and name HG*  )   ( resid    2 and name HN   )   3.05  1.26  1.26
assign ( resid    1 and name HG*  )   ( resid    5 and name HB1  )   3.22  1.43  1.43
assign ( resid    1 and name HG*  )   ( resid    6 and name HN   )   3.16  1.37  1.37
assign ( resid    1 and name HG*  )   ( resid    6 and name HB*  )   2.87  1.07  1.07
assign ( resid    1 and name HG*  )   ( resid    9 and name HD1* )   4.51  2.71  2.71
assign ( resid    1 and name HG*  )   ( resid   44 and name HG1* )   3.50  1.71  1.71
assign ( resid    1 and name HG*  )   ( resid   44 and name HG2* )   3.65  1.86  1.86
assign ( resid    2 and name HN   )   ( resid    5 and name HG*  )   3.74  1.94  1.94
assign ( resid    2 and name HG2* )   ( resid    5 and name HG*  )   4.43  2.64  2.64
assign ( resid    2 and name HG2* )   ( resid   41 and name HB*  )   4.22  2.42  2.42
assign ( resid    3 and name HA   )   ( resid    6 and name HB*  )   2.61  0.81  0.81
assign ( resid    3 and name HB*  )   ( resid    4 and name HN   )   2.80  1.00  1.00
assign ( resid    3 and name HB*  )   ( resid   39 and name HG2* )   4.85  3.05  3.05
assign ( resid    3 and name HB*  )   ( resid   39 and name HD1* )   4.85  3.05  3.05
assign ( resid    3 and name HB*  )   ( resid   40 and name HA2  )   3.42  1.63  1.63
assign ( resid    3 and name HB*  )   ( resid   44 and name HA   )   3.51  1.71  1.71
assign ( resid    3 and name HB*  )   ( resid   44 and name HG2* )   4.83  3.03  3.03
assign ( resid    3 and name HB*  )   ( resid   47 and name HG2* )   3.12  1.33  1.33
assign ( resid    3 and name HD*  )   ( resid   39 and name HG1* )   4.47  2.67  2.67
assign ( resid    3 and name HZ   )   ( resid   74 and name HG1* )   3.28  1.48  1.48
assign ( resid    5 and name HN   )   ( resid    5 and name HG*  )   2.74  0.95  0.95
assign ( resid    5 and name HN   )   ( resid    6 and name HB*  )   3.74  1.95  1.95
assign ( resid    5 and name HG*  )   ( resid    6 and name HN   )   3.28  1.49  1.49
assign ( resid    5 and name HG*  )   ( resid    9 and name HD1* )   4.27  2.48  2.48
assign ( resid    6 and name HB*  )   ( resid    7 and name HN   )   2.55  0.75  0.75
assign ( resid    6 and name HB*  )   ( resid   44 and name HB   )   3.71  1.91  1.91
assign ( resid    6 and name HB*  )   ( resid   44 and name HG2* )   2.99  1.19  1.19
assign ( resid    6 and name HB*  )   ( resid   81 and name HB*  )   3.68  1.88  1.88
assign ( resid    7 and name HB*  )   ( resid   31 and name HG1* )   3.71  1.92  1.92
assign ( resid   10 and name HN   )   ( resid   10 and name HB*  )   2.53  0.73  0.73
assign ( resid   10 and name HB*  )   ( resid   11 and name HN   )   2.66  0.87  0.87
assign ( resid   10 and name HB*  )   ( resid   77 and name HG1* )   3.74  1.95  1.95
assign ( resid   10 and name HD*  )   ( resid   11 and name HG1* )   3.95  2.15  2.15
assign ( resid   11 and name HN   )   ( resid   11 and name HG1* )   2.65  0.86  0.86
assign ( resid   11 and name HA   )   ( resid   11 and name HG1* )   2.58  0.79  0.79
assign ( resid   11 and name HA   )   ( resid   14 and name HB*  )   3.42  1.62  1.62
assign ( resid   11 and name HG2* )   ( resid   15 and name HB*  )   3.93  2.13  2.13
assign ( resid   11 and name HG1* )   ( resid   12 and name HN   )   4.18  2.38  2.38
assign ( resid   11 and name HG1* )   ( resid   18 and name HZ3  )   3.51  1.71  1.71
assign ( resid   11 and name HG1* )   ( resid   27 and name HB1  )   4.18  2.38  2.38
assign ( resid   11 and name HG1* )   ( resid   27 and name HE3  )   3.08  1.28  1.28
assign ( resid   12 and name HN   )   ( resid   12 and name HG*  )   3.15  1.36  1.36
assign ( resid   12 and name HA   )   ( resid   12 and name HG*  )   2.57  0.78  0.78
assign ( resid   12 and name HA   )   ( resid   15 and name HB*  )   2.84  1.05  1.05
assign ( resid   12 and name HA   )   ( resid   15 and name HG*  )   3.03  1.23  1.23
assign ( resid   12 and name HA   )   ( resid   15 and name HD*  )   3.27  1.47  1.47
assign ( resid   12 and name HG*  )   ( resid   13 and name HN   )   3.75  1.95  1.95
assign ( resid   14 and name HN   )   ( resid   14 and name HB*  )   2.79  0.99  0.99
assign ( resid   14 and name HN   )   ( resid   15 and name HB*  )   3.73  1.93  1.93
assign ( resid   14 and name HB*  )   ( resid   18 and name HE1  )   3.83  2.03  2.03
assign ( resid   15 and name HN   )   ( resid   15 and name HB*  )   2.51  0.72  0.72
assign ( resid   15 and name HN   )   ( resid   15 and name HG*  )   2.54  0.75  0.75
assign ( resid   15 and name HN   )   ( resid   15 and name HD*  )   3.89  2.09  2.09
assign ( resid   15 and name HA   )   ( resid   15 and name HG*  )   2.73  0.94  0.94
assign ( resid   15 and name HA   )   ( resid   15 and name HD*  )   3.57  1.78  1.78
assign ( resid   15 and name HB*  )   ( resid   16 and name HN   )   2.80  1.01  1.01
assign ( resid   15 and name HG*  )   ( resid   16 and name HN   )   3.24  1.44  1.44
assign ( resid   17 and name HB*  )   ( resid   18 and name HN   )   2.83  1.04  1.04
assign ( resid   17 and name HB*  )   ( resid   18 and name HD1  )   3.11  1.32  1.32
assign ( resid   17 and name HB*  )   ( resid   18 and name HE1  )   4.16  2.36  2.36
assign ( resid   22 and name HN   )   ( resid   22 and name HB*  )   2.53  0.73  0.73
assign ( resid   22 and name HA   )   ( resid   22 and name HD*  )   3.64  1.84  1.84
assign ( resid   22 and name HB*  )   ( resid   22 and name HD*  )   2.55  0.76  0.76
assign ( resid   22 and name HB*  )   ( resid   23 and name HN   )   2.90  1.10  1.10
assign ( resid   22 and name HB*  )   ( resid   26 and name HE2* )   4.62  2.83  2.83
assign ( resid   22 and name HG*  )   ( resid   23 and name HN   )   4.34  2.54  2.54
assign ( resid   22 and name HD*  )   ( resid   26 and name HE2* )   4.63  2.83  2.83
assign ( resid   23 and name HN   )   ( resid   23 and name HB*  )   2.57  0.78  0.78
assign ( resid   23 and name HB*  )   ( resid   27 and name HD1  )   3.26  1.46  1.46
assign ( resid   23 and name HB*  )   ( resid   27 and name HE1  )   4.34  2.54  2.54
assign ( resid   25 and name HB*  )   ( resid   26 and name HN   )   2.67  0.88  0.88
assign ( resid   25 and name HB*  )   ( resid   29 and name HD2* )   4.13  2.33  2.33
assign ( resid   25 and name HB2  )   ( resid   29 and name HD21 )   4.63  2.84  2.84
assign ( resid   25 and name HB2  )   ( resid   29 and name HD22 )   4.63  2.84  2.84
assign ( resid   26 and name HN   )   ( resid   26 and name HG*  )   2.53  0.73  0.73
assign ( resid   26 and name HA   )   ( resid   26 and name HG*  )   2.62  0.83  0.83
assign ( resid   26 and name HA   )   ( resid   29 and name HB*  )   2.83  1.04  1.04
assign ( resid   26 and name HA   )   ( resid   29 and name HD2* )   4.33  2.53  2.53
assign ( resid   27 and name HA   )   ( resid   73 and name HD*  )   3.03  1.23  1.23
assign ( resid   27 and name HE1  )   ( resid   73 and name HD*  )   4.34  2.54  2.54
assign ( resid   27 and name HZ3  )   ( resid   73 and name HD*  )   3.15  1.35  1.35
assign ( resid   27 and name HZ3  )   ( resid   76 and name HB*  )   3.65  1.86  1.86
assign ( resid   27 and name HH2  )   ( resid   76 and name HB*  )   2.63  0.83  0.83
assign ( resid   28 and name HG2* )   ( resid   29 and name HB*  )   4.34  2.55  2.55
assign ( resid   29 and name HN   )   ( resid   29 and name HB*  )   2.42  0.63  0.63
assign ( resid   29 and name HN   )   ( resid   29 and name HD2* )   4.33  2.53  2.53
assign ( resid   29 and name HA   )   ( resid   32 and name HB*  )   2.67  0.88  0.88
assign ( resid   29 and name HB*  )   ( resid   30 and name HN   )   2.69  0.90  0.90
assign ( resid   29 and name HB*  )   ( resid   30 and name HG2* )   4.06  2.27  2.27
assign ( resid   31 and name HN   )   ( resid   31 and name HG1* )   2.54  0.74  0.74
assign ( resid   31 and name HG1* )   ( resid   32 and name HN   )   3.85  2.06  2.06
assign ( resid   31 and name HG1* )   ( resid   70 and name HD1* )   3.21  1.42  1.42
assign ( resid   31 and name HD1* )   ( resid   73 and name HB*  )   3.71  1.92  1.92
assign ( resid   31 and name HD1* )   ( resid   74 and name HG1* )   4.67  2.87  2.87
assign ( resid   32 and name HN   )   ( resid   32 and name HG*  )   3.09  1.30  1.30
assign ( resid   32 and name HA   )   ( resid   36 and name HA*  )   3.28  1.48  1.48
assign ( resid   32 and name HB*  )   ( resid   33 and name HN   )   2.69  0.89  0.89
assign ( resid   32 and name HG*  )   ( resid   33 and name HN   )   4.01  2.22  2.22
assign ( resid   34 and name HE*  )   ( resid   59 and name HG1* )   4.47  2.67  2.67
assign ( resid   35 and name HA   )   ( resid   39 and name HG1* )   2.95  1.15  1.15
assign ( resid   36 and name HA*  )   ( resid   40 and name HN   )   3.15  1.36  1.36
assign ( resid   36 and name HA*  )   ( resid   40 and name HA2  )   2.90  1.10  1.10
assign ( resid   36 and name HA*  )   ( resid   40 and name HA1  )   2.95  1.16  1.16
assign ( resid   37 and name HB*  )   ( resid   38 and name HN   )   3.01  1.21  1.21
assign ( resid   37 and name HB*  )   ( resid   38 and name HG2* )   3.48  1.68  1.68
assign ( resid   37 and name HG*  )   ( resid   38 and name HG2* )   3.64  1.85  1.85
assign ( resid   37 and name HD*  )   ( resid   38 and name HN   )   3.25  1.46  1.46
assign ( resid   37 and name HD*  )   ( resid   38 and name HG2* )   4.03  2.23  2.23
assign ( resid   38 and name HG1* )   ( resid   39 and name HG1* )   3.66  1.86  1.86
assign ( resid   38 and name HG1* )   ( resid   54 and name HG*  )   3.97  2.17  2.17
assign ( resid   39 and name HG1* )   ( resid   40 and name HN   )   3.40  1.60  1.60
assign ( resid   39 and name HG1* )   ( resid   42 and name HD1* )   4.02  2.22  2.22
assign ( resid   39 and name HG1* )   ( resid   55 and name HG2* )   3.71  1.92  1.92
assign ( resid   40 and name HN   )   ( resid   41 and name HD*  )   2.67  0.87  0.87
assign ( resid   40 and name HA1  )   ( resid   41 and name HD*  )   2.52  0.72  0.72
assign ( resid   41 and name HB*  )   ( resid   42 and name HD2* )   4.65  2.85  2.85
assign ( resid   41 and name HG*  )   ( resid   42 and name HN   )   3.39  1.60  1.60
assign ( resid   41 and name HD*  )   ( resid   42 and name HN   )   2.93  1.13  1.13
assign ( resid   41 and name HD*  )   ( resid   42 and name HG   )   3.59  1.79  1.79
assign ( resid   41 and name HD*  )   ( resid   42 and name HD1* )   4.38  2.59  2.59
assign ( resid   41 and name HD*  )   ( resid   42 and name HD2* )   4.16  2.37  2.37
assign ( resid   43 and name HN   )   ( resid   46 and name HB*  )   3.20  1.40  1.40
assign ( resid   43 and name HB*  )   ( resid   44 and name HN   )   2.87  1.07  1.07
assign ( resid   43 and name HB*  )   ( resid   45 and name HN   )   3.12  1.32  1.32
assign ( resid   43 and name HB*  )   ( resid   46 and name HN   )   2.60  0.80  0.80
assign ( resid   43 and name HB*  )   ( resid   46 and name HB*  )   3.25  1.46  1.46
assign ( resid   44 and name HG1* )   ( resid   87 and name HB*  )   3.75  1.96  1.96
assign ( resid   45 and name HA   )   ( resid   45 and name HE2* )   3.62  1.83  1.83
assign ( resid   45 and name HA   )   ( resid   87 and name HB*  )   3.10  1.30  1.30
assign ( resid   45 and name HB2  )   ( resid   45 and name HE21 )   4.78  2.98  2.98
assign ( resid   45 and name HB2  )   ( resid   45 and name HE22 )   4.78  2.98  2.98
assign ( resid   45 and name HB*  )   ( resid   46 and name HN   )   2.93  1.14  1.14
assign ( resid   45 and name HG*  )   ( resid   46 and name HN   )   4.34  2.54  2.54
assign ( resid   45 and name HE2* )   ( resid   88 and name HN   )   3.18  1.39  1.39
assign ( resid   46 and name HN   )   ( resid   46 and name HB*  )   2.52  0.72  0.72
assign ( resid   46 and name HB*  )   ( resid   47 and name HN   )   3.12  1.32  1.32
assign ( resid   46 and name HB*  )   ( resid   51 and name HD1* )   4.27  2.48  2.48
assign ( resid   47 and name HG1* )   ( resid   52 and name HG1* )   3.46  1.67  1.67
assign ( resid   47 and name HG1* )   ( resid   92 and name HG*  )   3.61  1.81  1.81
assign ( resid   48 and name HB*  )   ( resid   49 and name HN   )   2.53  0.73  0.73
assign ( resid   48 and name HB*  )   ( resid   50 and name HN   )   3.20  1.41  1.41
assign ( resid   49 and name HG2* )   ( resid   53 and name HG*  )   3.54  1.74  1.74
assign ( resid   50 and name HN   )   ( resid   50 and name HB*  )   2.39  0.60  0.60
assign ( resid   50 and name HN   )   ( resid   50 and name HG*  )   2.93  1.13  1.13
assign ( resid   50 and name HB*  )   ( resid   51 and name HN   )   2.61  0.82  0.82
assign ( resid   50 and name HG*  )   ( resid   51 and name HN   )   3.71  1.91  1.91
assign ( resid   51 and name HD2* )   ( resid   54 and name HG*  )   3.56  1.76  1.76
assign ( resid   52 and name HN   )   ( resid   52 and name HG1* )   2.74  0.94  0.94
assign ( resid   52 and name HA   )   ( resid   52 and name HG1* )   2.64  0.84  0.84
assign ( resid   52 and name HG1* )   ( resid   74 and name HG2* )   3.96  2.17  2.17
assign ( resid   52 and name HG1* )   ( resid   74 and name HD1* )   4.42  2.62  2.62
assign ( resid   52 and name HD1* )   ( resid   92 and name HG*  )   3.52  1.73  1.73
assign ( resid   53 and name HN   )   ( resid   53 and name HG*  )   2.71  0.92  0.92
assign ( resid   53 and name HA   )   ( resid   53 and name HG*  )   2.83  1.04  1.04
assign ( resid   54 and name HN   )   ( resid   54 and name HG*  )   3.12  1.33  1.33
assign ( resid   54 and name HA   )   ( resid   54 and name HG*  )   2.64  0.85  0.85
assign ( resid   56 and name HA   )   ( resid   59 and name HG1* )   3.08  1.28  1.28
assign ( resid   56 and name HD1* )   ( resid   71 and name HB*  )   3.57  1.78  1.78
assign ( resid   56 and name HD1* )   ( resid   71 and name HG*  )   3.33  1.53  1.53
assign ( resid   56 and name HD2* )   ( resid   59 and name HG1* )   3.91  2.12  2.12
assign ( resid   57 and name HN   )   ( resid   57 and name HB*  )   2.53  0.73  0.73
assign ( resid   57 and name HB*  )   ( resid   58 and name HG*  )   4.22  2.43  2.43
assign ( resid   57 and name HB*  )   ( resid   58 and name HD2  )   2.59  0.79  0.79
assign ( resid   57 and name HB*  )   ( resid   58 and name HD1  )   2.39  0.59  0.59
assign ( resid   58 and name HB*  )   ( resid   59 and name HN   )   3.11  1.32  1.32
assign ( resid   58 and name HG*  )   ( resid   59 and name HG1* )   3.94  2.14  2.14
assign ( resid   58 and name HD2  )   ( resid   59 and name HG1* )   3.67  1.88  1.88
assign ( resid   58 and name HD1  )   ( resid   59 and name HG1* )   4.00  2.20  2.20
assign ( resid   59 and name HN   )   ( resid   59 and name HG1* )   2.50  0.70  0.70
assign ( resid   59 and name HA   )   ( resid   59 and name HG1* )   2.83  1.04  1.04
assign ( resid   59 and name HA   )   ( resid   62 and name HB*  )   3.15  1.35  1.35
assign ( resid   59 and name HG1* )   ( resid   60 and name HN   )   3.70  1.91  1.91
assign ( resid   59 and name HG1* )   ( resid   67 and name HB*  )   4.18  2.39  2.39
assign ( resid   61 and name HN   )   ( resid   61 and name HB*  )   2.42  0.63  0.63
assign ( resid   61 and name HA   )   ( resid   61 and name HG*  )   2.79  0.99  0.99
assign ( resid   62 and name HN   )   ( resid   62 and name HB*  )   2.54  0.74  0.74
assign ( resid   62 and name HN   )   ( resid   62 and name HG*  )   2.93  1.14  1.14
assign ( resid   62 and name HA   )   ( resid   62 and name HG*  )   2.69  0.89  0.89
assign ( resid   62 and name HB*  )   ( resid   63 and name HN   )   2.65  0.86  0.86
assign ( resid   62 and name HB*  )   ( resid   63 and name HG*  )   3.14  1.34  1.34
assign ( resid   62 and name HB2  )   ( resid   63 and name HG2  )   3.67  1.87  1.87
assign ( resid   62 and name HB1  )   ( resid   63 and name HG2  )   3.67  1.87  1.87
assign ( resid   62 and name HG*  )   ( resid   63 and name HG*  )   4.29  2.50  2.50
assign ( resid   63 and name HN   )   ( resid   63 and name HG*  )   3.15  1.36  1.36
assign ( resid   63 and name HA   )   ( resid   63 and name HG*  )   2.81  1.01  1.01
assign ( resid   65 and name HB*  )   ( resid   66 and name HN   )   2.72  0.93  0.93
assign ( resid   69 and name HB2  )   ( resid   69 and name HD*  )   2.69  0.89  0.89
assign ( resid   69 and name HB1  )   ( resid   69 and name HD*  )   2.56  0.76  0.76
assign ( resid   70 and name HA   )   ( resid   73 and name HB*  )   3.49  1.70  1.70
assign ( resid   70 and name HA   )   ( resid   73 and name HD*  )   3.51  1.71  1.71
assign ( resid   70 and name HD1* )   ( resid   73 and name HD*  )   4.09  2.30  2.30
assign ( resid   70 and name HD1* )   ( resid   74 and name HG1* )   3.75  1.95  1.95
assign ( resid   71 and name HN   )   ( resid   71 and name HB*  )   2.49  0.70  0.70
assign ( resid   71 and name HN   )   ( resid   71 and name HG*  )   3.17  1.38  1.38
assign ( resid   71 and name HA   )   ( resid   71 and name HG*  )   2.53  0.74  0.74
assign ( resid   71 and name HB*  )   ( resid   71 and name HE   )   3.65  1.86  1.86
assign ( resid   71 and name HG*  )   ( resid   74 and name HD1* )   3.84  2.04  2.04
assign ( resid   72 and name HA*  )   ( resid   75 and name HB*  )   3.10  1.30  1.30
assign ( resid   73 and name HN   )   ( resid   73 and name HB*  )   2.64  0.85  0.85
assign ( resid   73 and name HN   )   ( resid   73 and name HG*  )   2.87  1.07  1.07
assign ( resid   73 and name HN   )   ( resid   73 and name HD*  )   4.19  2.40  2.40
assign ( resid   73 and name HA   )   ( resid   73 and name HG*  )   2.80  1.00  1.00
assign ( resid   73 and name HB*  )   ( resid   74 and name HN   )   2.86  1.07  1.07
assign ( resid   74 and name HN   )   ( resid   74 and name HG1* )   2.77  0.97  0.97
assign ( resid   74 and name HA   )   ( resid   74 and name HG1* )   2.82  1.03  1.03
assign ( resid   75 and name HN   )   ( resid   75 and name HB*  )   2.62  0.82  0.82
assign ( resid   75 and name HN   )   ( resid   75 and name HG*  )   3.30  1.50  1.50
assign ( resid   75 and name HB*  )   ( resid   76 and name HN   )   2.61  0.82  0.82
assign ( resid   75 and name HB*  )   ( resid   93 and name HB*  )   3.25  1.46  1.46
assign ( resid   75 and name HG*  )   ( resid   76 and name HN   )   3.62  1.82  1.82
assign ( resid   75 and name HG*  )   ( resid   91 and name HD21 )   3.20  1.40  1.40
assign ( resid   75 and name HG*  )   ( resid   91 and name HD22 )   3.73  1.93  1.93
assign ( resid   75 and name HG*  )   ( resid   93 and name HB*  )   3.27  1.47  1.47
assign ( resid   76 and name HN   )   ( resid   76 and name HB*  )   2.60  0.81  0.81
assign ( resid   76 and name HB*  )   ( resid   77 and name HN   )   2.84  1.05  1.05
assign ( resid   76 and name HB*  )   ( resid   77 and name HG2* )   4.21  2.42  2.42
assign ( resid   78 and name HD1* )   ( resid   92 and name HG*  )   3.10  1.31  1.31
assign ( resid   78 and name HD1* )   ( resid   92 and name HD*  )   3.17  1.37  1.37
assign ( resid   78 and name HD2* )   ( resid   87 and name HD*  )   3.20  1.40  1.40
assign ( resid   80 and name HE1  )   ( resid   84 and name HD*  )   3.71  1.91  1.91
assign ( resid   80 and name HZ2  )   ( resid   84 and name HD*  )   3.24  1.44  1.44
assign ( resid   81 and name HB*  )   ( resid   87 and name HG*  )   3.73  1.94  1.94
assign ( resid   82 and name HA   )   ( resid   87 and name HB*  )   3.96  2.16  2.16
assign ( resid   82 and name HA   )   ( resid   87 and name HG*  )   2.84  1.05  1.05
assign ( resid   83 and name HG1* )   ( resid   84 and name HD*  )   3.85  2.05  2.05
assign ( resid   84 and name HN   )   ( resid   84 and name HG*  )   2.80  1.01  1.01
assign ( resid   84 and name HN   )   ( resid   84 and name HD*  )   3.14  1.34  1.34
assign ( resid   84 and name HA   )   ( resid   84 and name HG*  )   2.75  0.95  0.95
assign ( resid   84 and name HG*  )   ( resid   86 and name HE*  )   5.40  3.61  3.61
assign ( resid   84 and name HD*  )   ( resid   86 and name HE*  )   4.24  2.45  2.45
assign ( resid   87 and name HB*  )   ( resid   88 and name HN   )   2.71  0.91  0.91
assign ( resid   87 and name HG*  )   ( resid   88 and name HN   )   3.83  2.04  2.04
assign ( resid   88 and name HN   )   ( resid   88 and name HB*  )   2.79  0.99  0.99
assign ( resid   89 and name HA*  )   ( resid   90 and name HN   )   2.43  0.64  0.64
assign ( resid   90 and name HN   )   ( resid   90 and name HB*  )   2.50  0.71  0.71
assign ( resid   90 and name HB*  )   ( resid   91 and name HN   )   2.74  0.94  0.94
assign ( resid   91 and name HA   )   ( resid   92 and name HD*  )   2.26  0.47  0.47
assign ( resid   91 and name HB*  )   ( resid   91 and name HD22 )   2.80  1.00  1.00
assign ( resid   92 and name HG*  )   ( resid   93 and name HN   )   3.19  1.40  1.40
assign ( resid   92 and name HD*  )   ( resid   93 and name HN   )   3.41  1.61  1.61
assign ( resid   94 and name HA   )   ( resid   94 and name HD*  )   3.65  1.86  1.86
assign ( resid   94 and name HB*  )   ( resid   95 and name HN   )   2.71  0.92  0.92
assign ( resid   96 and name HN   )   ( resid   96 and name HG*  )   3.05  1.26  1.26
assign ( resid   96 and name HA   )   ( resid   96 and name HG*  )   2.75  0.95  0.95
assign ( resid   98 and name HD*  )   ( resid   99 and name HB*  )   4.79  2.99  2.99
assign ( resid   98 and name HE*  )   ( resid   99 and name HB*  )   4.67  2.87  2.87
assign ( resid    3 and name HN   )   ( resid   42 and name O    )   2.00  0.20  0.30
assign ( resid    3 and name N    )   ( resid   42 and name O    )   3.00  0.30  0.30
assign ( resid    4 and name HN   )   ( resid   40 and name O    )   2.00  0.20  0.30
assign ( resid    4 and name N    )   ( resid   40 and name O    )   3.00  0.30  0.30
assign ( resid    2 and name C    )   ( resid    3 and name N    ) 
        (resid    3 and name CA   )   ( resid    3 and name C    )  1  -61.00    6.00 2
assign ( resid    3 and name N    )   ( resid    3 and name CA   ) 
        (resid    3 and name C    )   ( resid    4 and name N    )  1  -37.00    6.00 2
assign ( resid    3 and name C    )   ( resid    4 and name N    ) 
        (resid    4 and name CA   )   ( resid    4 and name C    )  1  -62.00    7.00 2
assign ( resid    4 and name N    )   ( resid    4 and name CA   ) 
        (resid    4 and name C    )   ( resid    5 and name N    )  1  -40.00    7.00 2
assign ( resid    4 and name C    )   ( resid    5 and name N    ) 
        (resid    5 and name CA   )   ( resid    5 and name C    )  1  -70.00    9.00 2
assign ( resid    5 and name N    )   ( resid    5 and name CA   ) 
        (resid    5 and name C    )   ( resid    6 and name N    )  1  -40.00    9.00 2
assign ( resid    5 and name C    )   ( resid    6 and name N    ) 
        (resid    6 and name CA   )   ( resid    6 and name C    )  1  -65.00    8.00 2
assign ( resid    6 and name N    )   ( resid    6 and name CA   ) 
        (resid    6 and name C    )   ( resid    7 and name N    )  1  -43.00    6.00 2
assign ( resid    6 and name C    )   ( resid    7 and name N    ) 
        (resid    7 and name CA   )   ( resid    7 and name C    )  1  -61.00    6.00 2
assign ( resid    7 and name N    )   ( resid    7 and name CA   ) 
        (resid    7 and name C    )   ( resid    8 and name N    )  1  -41.00    6.00 2
assign ( resid    7 and name C    )   ( resid    8 and name N    ) 
        (resid    8 and name CA   )   ( resid    8 and name C    )  1  -65.00    6.00 2
assign ( resid    8 and name N    )   ( resid    8 and name CA   ) 
        (resid    8 and name C    )   ( resid    9 and name N    )  1  -38.00    7.00 2
assign ( resid    8 and name C    )   ( resid    9 and name N    ) 
        (resid    9 and name CA   )   ( resid    9 and name C    )  1  -67.00    6.00 2
assign ( resid    9 and name N    )   ( resid    9 and name CA   ) 
        (resid    9 and name C    )   ( resid   10 and name N    )  1  -42.00    7.00 2
assign ( resid    9 and name C    )   ( resid   10 and name N    ) 
        (resid   10 and name CA   )   ( resid   10 and name C    )  1  -64.00    7.00 2
assign ( resid   10 and name N    )   ( resid   10 and name CA   ) 
        (resid   10 and name C    )   ( resid   11 and name N    )  1  -43.00    6.00 2
assign ( resid   10 and name C    )   ( resid   11 and name N    ) 
        (resid   11 and name CA   )   ( resid   11 and name C    )  1  -65.00    6.00 2
assign ( resid   11 and name N    )   ( resid   11 and name CA   ) 
        (resid   11 and name C    )   ( resid   12 and name N    )  1  -43.00    6.00 2
assign ( resid   11 and name C    )   ( resid   12 and name N    ) 
        (resid   12 and name CA   )   ( resid   12 and name C    )  1  -62.00    9.00 2
assign ( resid   12 and name N    )   ( resid   12 and name CA   ) 
        (resid   12 and name C    )   ( resid   13 and name N    )  1  -44.00    9.00 2
assign ( resid   22 and name C    )   ( resid   23 and name N    ) 
        (resid   23 and name CA   )   ( resid   23 and name C    )  1  -61.00    6.00 2
assign ( resid   23 and name N    )   ( resid   23 and name CA   ) 
        (resid   23 and name C    )   ( resid   24 and name N    )  1  -43.00   12.00 2
assign ( resid   23 and name C    )   ( resid   24 and name N    ) 
        (resid   24 and name CA   )   ( resid   24 and name C    )  1  -63.00    6.00 2
assign ( resid   24 and name N    )   ( resid   24 and name CA   ) 
        (resid   24 and name C    )   ( resid   25 and name N    )  1  -42.00    9.00 2
assign ( resid   24 and name C    )   ( resid   25 and name N    ) 
        (resid   25 and name CA   )   ( resid   25 and name C    )  1  -65.00    8.00 2
assign ( resid   25 and name N    )   ( resid   25 and name CA   ) 
        (resid   25 and name C    )   ( resid   26 and name N    )  1  -44.00    7.00 2
assign ( resid   25 and name C    )   ( resid   26 and name N    ) 
        (resid   26 and name CA   )   ( resid   26 and name C    )  1  -67.00    8.00 2
assign ( resid   26 and name N    )   ( resid   26 and name CA   ) 
        (resid   26 and name C    )   ( resid   27 and name N    )  1  -39.00    8.00 2
assign ( resid   26 and name C    )   ( resid   27 and name N    ) 
        (resid   27 and name CA   )   ( resid   27 and name C    )  1  -66.00   11.00 2
assign ( resid   27 and name N    )   ( resid   27 and name CA   ) 
        (resid   27 and name C    )   ( resid   28 and name N    )  1  -42.00    9.00 2
assign ( resid   27 and name C    )   ( resid   28 and name N    ) 
        (resid   28 and name CA   )   ( resid   28 and name C    )  1  -63.00    6.00 2
assign ( resid   28 and name N    )   ( resid   28 and name CA   ) 
        (resid   28 and name C    )   ( resid   29 and name N    )  1  -44.00    7.00 2
assign ( resid   28 and name C    )   ( resid   29 and name N    ) 
        (resid   29 and name CA   )   ( resid   29 and name C    )  1  -61.00    6.00 2
assign ( resid   29 and name N    )   ( resid   29 and name CA   ) 
        (resid   29 and name C    )   ( resid   30 and name N    )  1  -42.00    7.00 2
assign ( resid   29 and name C    )   ( resid   30 and name N    ) 
        (resid   30 and name CA   )   ( resid   30 and name C    )  1  -67.00    6.00 2
assign ( resid   30 and name N    )   ( resid   30 and name CA   ) 
        (resid   30 and name C    )   ( resid   31 and name N    )  1  -39.00   16.00 2
assign ( resid   30 and name C    )   ( resid   31 and name N    ) 
        (resid   31 and name CA   )   ( resid   31 and name C    )  1  -67.00    6.00 2
assign ( resid   31 and name N    )   ( resid   31 and name CA   ) 
        (resid   31 and name C    )   ( resid   32 and name N    )  1  -41.00    6.00 2
assign ( resid   31 and name C    )   ( resid   32 and name N    ) 
        (resid   32 and name CA   )   ( resid   32 and name C    )  1  -65.00    6.00 2
assign ( resid   32 and name N    )   ( resid   32 and name CA   ) 
        (resid   32 and name C    )   ( resid   33 and name N    )  1  -36.00   11.00 2
assign ( resid   32 and name C    )   ( resid   33 and name N    ) 
        (resid   33 and name CA   )   ( resid   33 and name C    )  1  -69.00   12.00 2
assign ( resid   33 and name N    )   ( resid   33 and name CA   ) 
        (resid   33 and name C    )   ( resid   34 and name N    )  1  -45.00    6.00 2
assign ( resid   33 and name C    )   ( resid   34 and name N    ) 
        (resid   34 and name CA   )   ( resid   34 and name C    )  1  -66.00   11.00 2
assign ( resid   34 and name N    )   ( resid   34 and name CA   ) 
        (resid   34 and name C    )   ( resid   35 and name N    )  1  -37.00   12.00 2
assign ( resid   48 and name C    )   ( resid   49 and name N    ) 
        (resid   49 and name CA   )   ( resid   49 and name C    )  1  -62.00    9.00 2
assign ( resid   49 and name N    )   ( resid   49 and name CA   ) 
        (resid   49 and name C    )   ( resid   50 and name N    )  1  -39.00   10.00 2
assign ( resid   49 and name C    )   ( resid   50 and name N    ) 
        (resid   50 and name CA   )   ( resid   50 and name C    )  1  -63.00    8.00 2
assign ( resid   50 and name N    )   ( resid   50 and name CA   ) 
        (resid   50 and name C    )   ( resid   51 and name N    )  1  -39.00    6.00 2
assign ( resid   50 and name C    )   ( resid   51 and name N    ) 
        (resid   51 and name CA   )   ( resid   51 and name C    )  1  -65.00    6.00 2
assign ( resid   51 and name N    )   ( resid   51 and name CA   ) 
        (resid   51 and name C    )   ( resid   52 and name N    )  1  -45.00    6.00 2
assign ( resid   51 and name C    )   ( resid   52 and name N    ) 
        (resid   52 and name CA   )   ( resid   52 and name C    )  1  -63.00    6.00 2
assign ( resid   52 and name N    )   ( resid   52 and name CA   ) 
        (resid   52 and name C    )   ( resid   53 and name N    )  1  -41.00    6.00 2
assign ( resid   52 and name C    )   ( resid   53 and name N    ) 
        (resid   53 and name CA   )   ( resid   53 and name C    )  1  -61.00    6.00 2
assign ( resid   53 and name N    )   ( resid   53 and name CA   ) 
        (resid   53 and name C    )   ( resid   54 and name N    )  1  -42.00    7.00 2
assign ( resid   53 and name C    )   ( resid   54 and name N    ) 
        (resid   54 and name CA   )   ( resid   54 and name C    )  1  -63.00    6.00 2
assign ( resid   54 and name N    )   ( resid   54 and name CA   ) 
        (resid   54 and name C    )   ( resid   55 and name N    )  1  -45.00    6.00 2
assign ( resid   54 and name C    )   ( resid   55 and name N    ) 
        (resid   55 and name CA   )   ( resid   55 and name C    )  1  -69.00   12.00 2
assign ( resid   55 and name N    )   ( resid   55 and name CA   ) 
        (resid   55 and name C    )   ( resid   56 and name N    )  1  -42.00    7.00 2
assign ( resid   55 and name C    )   ( resid   56 and name N    ) 
        (resid   56 and name CA   )   ( resid   56 and name C    )  1  -69.00   10.00 2
assign ( resid   56 and name N    )   ( resid   56 and name CA   ) 
        (resid   56 and name C    )   ( resid   57 and name N    )  1  -36.00   11.00 2
assign ( resid   64 and name C    )   ( resid   65 and name N    ) 
        (resid   65 and name CA   )   ( resid   65 and name C    )  1  -67.00    6.00 2
assign ( resid   65 and name N    )   ( resid   65 and name CA   ) 
        (resid   65 and name C    )   ( resid   66 and name N    )  1  -39.00    6.00 2
assign ( resid   65 and name C    )   ( resid   66 and name N    ) 
        (resid   66 and name CA   )   ( resid   66 and name C    )  1  -65.00    6.00 2
assign ( resid   66 and name N    )   ( resid   66 and name CA   ) 
        (resid   66 and name C    )   ( resid   67 and name N    )  1  -42.00    9.00 2
assign ( resid   66 and name C    )   ( resid   67 and name N    ) 
        (resid   67 and name CA   )   ( resid   67 and name C    )  1  -63.00    6.00 2
assign ( resid   67 and name N    )   ( resid   67 and name CA   ) 
        (resid   67 and name C    )   ( resid   68 and name N    )  1  -45.00    8.00 2
assign ( resid   67 and name C    )   ( resid   68 and name N    ) 
        (resid   68 and name CA   )   ( resid   68 and name C    )  1  -65.00    6.00 2
assign ( resid   68 and name N    )   ( resid   68 and name CA   ) 
        (resid   68 and name C    )   ( resid   69 and name N    )  1  -38.00    9.00 2
assign ( resid   68 and name C    )   ( resid   69 and name N    ) 
        (resid   69 and name CA   )   ( resid   69 and name C    )  1  -67.00    6.00 2
assign ( resid   69 and name N    )   ( resid   69 and name CA   ) 
        (resid   69 and name C    )   ( resid   70 and name N    )  1  -39.00    6.00 2
assign ( resid   69 and name C    )   ( resid   70 and name N    ) 
        (resid   70 and name CA   )   ( resid   70 and name C    )  1  -66.00    9.00 2
assign ( resid   70 and name N    )   ( resid   70 and name CA   ) 
        (resid   70 and name C    )   ( resid   71 and name N    )  1  -41.00    6.00 2
assign ( resid   70 and name C    )   ( resid   71 and name N    ) 
        (resid   71 and name CA   )   ( resid   71 and name C    )  1  -61.00    6.00 2
assign ( resid   71 and name N    )   ( resid   71 and name CA   ) 
        (resid   71 and name C    )   ( resid   72 and name N    )  1  -43.00    6.00 2
assign ( resid   71 and name C    )   ( resid   72 and name N    ) 
        (resid   72 and name CA   )   ( resid   72 and name C    )  1  -67.00    6.00 2
assign ( resid   72 and name N    )   ( resid   72 and name CA   ) 
        (resid   72 and name C    )   ( resid   73 and name N    )  1  -37.00    6.00 2
assign ( resid   72 and name C    )   ( resid   73 and name N    ) 
        (resid   73 and name CA   )   ( resid   73 and name C    )  1  -65.00    6.00 2
assign ( resid   73 and name N    )   ( resid   73 and name CA   ) 
        (resid   73 and name C    )   ( resid   74 and name N    )  1  -42.00    7.00 2
assign ( resid   73 and name C    )   ( resid   74 and name N    ) 
        (resid   74 and name CA   )   ( resid   74 and name C    )  1  -65.00    6.00 2
assign ( resid   74 and name N    )   ( resid   74 and name CA   ) 
        (resid   74 and name C    )   ( resid   75 and name N    )  1  -44.00    5.00 2
assign ( resid   74 and name C    )   ( resid   75 and name N    ) 
        (resid   75 and name CA   )   ( resid   75 and name C    )  1  -59.00    6.00 2
assign ( resid   75 and name N    )   ( resid   75 and name CA   ) 
        (resid   75 and name C    )   ( resid   76 and name N    )  1  -41.00    6.00 2
assign ( resid   75 and name C    )   ( resid   76 and name N    ) 
        (resid   76 and name CA   )   ( resid   76 and name C    )  1  -69.00    8.00 2
assign ( resid   76 and name N    )   ( resid   76 and name CA   ) 
        (resid   76 and name C    )   ( resid   77 and name N    )  1  -39.00   10.00 2
assign ( resid   76 and name C    )   ( resid   77 and name N    ) 
        (resid   77 and name CA   )   ( resid   77 and name C    )  1  -65.00    6.00 2
assign ( resid   77 and name N    )   ( resid   77 and name CA   ) 
        (resid   77 and name C    )   ( resid   78 and name N    )  1  -43.00    6.00 2
assign ( resid   77 and name C    )   ( resid   78 and name N    ) 
        (resid   78 and name CA   )   ( resid   78 and name C    )  1  -60.00    7.00 2
assign ( resid   78 and name N    )   ( resid   78 and name CA   ) 
        (resid   78 and name C    )   ( resid   79 and name N    )  1  -40.00    7.00 2
assign ( resid   78 and name C    )   ( resid   79 and name N    ) 
        (resid   79 and name CA   )   ( resid   79 and name C    )  1  -67.00    6.00 2
assign ( resid   79 and name N    )   ( resid   79 and name CA   ) 
        (resid   79 and name C    )   ( resid   80 and name N    )  1  -38.00    9.00 2
assign ( resid   79 and name C    )   ( resid   80 and name N    ) 
        (resid   80 and name CA   )   ( resid   80 and name C    )  1  -64.00    5.00 2
assign ( resid   80 and name N    )   ( resid   80 and name CA   ) 
        (resid   80 and name C    )   ( resid   81 and name N    )  1  -44.00    7.00 2
assign ( resid   80 and name C    )   ( resid   81 and name N    ) 
        (resid   81 and name CA   )   ( resid   81 and name C    )  1  -62.00    9.00 2
assign ( resid   81 and name N    )   ( resid   81 and name CA   ) 
        (resid   81 and name C    )   ( resid   82 and name N    )  1  -38.00    7.00 2
assign ( resid   81 and name C    )   ( resid   82 and name N    ) 
        (resid   82 and name CA   )   ( resid   82 and name C    )  1  -65.00    6.00 2
assign ( resid   82 and name N    )   ( resid   82 and name CA   ) 
        (resid   82 and name C    )   ( resid   83 and name N    )  1  -40.00    9.00 2
assign ( resid   82 and name C    )   ( resid   83 and name N    ) 
        (resid   83 and name CA   )   ( resid   83 and name C    )  1  -69.00   12.00 2
assign ( resid   83 and name N    )   ( resid   83 and name CA   ) 
        (resid   83 and name C    )   ( resid   84 and name N    )  1  -39.00    8.00 2
assign ( resid   83 and name C    )   ( resid   84 and name N    ) 
        (resid   84 and name CA   )   ( resid   84 and name C    )  1  -80.00   13.00 2
assign ( resid   84 and name N    )   ( resid   84 and name CA   ) 
        (resid   84 and name C    )   ( resid   85 and name N    )  1   -7.00   18.00 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  -45.00  110.00 2
assign ( resid    2 and name N    )   ( resid    2 and name CA   ) 
        (resid    2 and name C    )   ( resid    3 and name N    )  1  160.00   35.00 2
assign ( resid   12 and name C    )   ( resid   13 and name N    ) 
        (resid   13 and name CA   )   ( resid   13 and name C    )  1 -180.00  135.00 2
assign ( resid   12 and name C    )   ( resid   13 and name N    ) 
        (resid   13 and name CA   )   ( resid   13 and name C    )  1  -55.00  130.00 2
assign ( resid   13 and name N    )   ( resid   13 and name CA   ) 
        (resid   13 and name C    )   ( resid   14 and name N    )  1   10.00   95.00 2
assign ( resid   13 and name C    )   ( resid   14 and name N    ) 
        (resid   14 and name CA   )   ( resid   14 and name C    )  1 -180.00  135.00 2
assign ( resid   13 and name C    )   ( resid   14 and name N    ) 
        (resid   14 and name CA   )   ( resid   14 and name C    )  1  -55.00  130.00 2
assign ( resid   14 and name N    )   ( resid   14 and name CA   ) 
        (resid   14 and name C    )   ( resid   15 and name N    )  1    5.00   90.00 2
assign ( resid   14 and name C    )   ( resid   15 and name N    ) 
        (resid   15 and name CA   )   ( resid   15 and name C    )  1  -85.00   40.00 2
assign ( resid   15 and name N    )   ( resid   15 and name CA   ) 
        (resid   15 and name C    )   ( resid   16 and name N    )  1  -45.00   40.00 2
assign ( resid   15 and name C    )   ( resid   16 and name N    ) 
        (resid   16 and name CA   )   ( resid   16 and name C    )  1 -115.00   70.00 2
assign ( resid   16 and name N    )   ( resid   16 and name CA   ) 
        (resid   16 and name C    )   ( resid   17 and name N    )  1  -35.00   50.00 2
assign ( resid   16 and name C    )   ( resid   17 and name N    ) 
        (resid   17 and name CA   )   ( resid   17 and name C    )  1 -180.00  135.00 2
assign ( resid   16 and name C    )   ( resid   17 and name N    ) 
        (resid   17 and name CA   )   ( resid   17 and name C    )  1  -60.00  125.00 2
assign ( resid   17 and name N    )   ( resid   17 and name CA   ) 
        (resid   17 and name C    )   ( resid   18 and name N    )  1 -125.00  140.00 2
assign ( resid   17 and name N    )   ( resid   17 and name CA   ) 
        (resid   17 and name C    )   ( resid   18 and name N    )  1   60.00  145.00 2
assign ( resid   17 and name C    )   ( resid   18 and name N    ) 
        (resid   18 and name CA   )   ( resid   18 and name C    )  1 -180.00  135.00 2
assign ( resid   17 and name C    )   ( resid   18 and name N    ) 
        (resid   18 and name CA   )   ( resid   18 and name C    )  1  -55.00  130.00 2
assign ( resid   18 and name N    )   ( resid   18 and name CA   ) 
        (resid   18 and name C    )   ( resid   19 and name N    )  1    5.00   90.00 2
assign ( resid   18 and name C    )   ( resid   19 and name N    ) 
        (resid   19 and name CA   )   ( resid   19 and name C    )  1 -180.00  135.00 2
assign ( resid   18 and name C    )   ( resid   19 and name N    ) 
        (resid   19 and name CA   )   ( resid   19 and name C    )  1  -55.00  130.00 2
assign ( resid   19 and name N    )   ( resid   19 and name CA   ) 
        (resid   19 and name C    )   ( resid   20 and name N    )  1  100.00   95.00 2
assign ( resid   19 and name C    )   ( resid   20 and name N    ) 
        (resid   20 and name CA   )   ( resid   20 and name C    )  1  175.00  130.00 2
assign ( resid   19 and name C    )   ( resid   20 and name N    ) 
        (resid   20 and name CA   )   ( resid   20 and name C    )  1  -55.00  130.00 2
assign ( resid   20 and name N    )   ( resid   20 and name CA   ) 
        (resid   20 and name C    )   ( resid   21 and name N    )  1   50.00   75.00 2
assign ( resid   20 and name C    )   ( resid   21 and name N    ) 
        (resid   21 and name CA   )   ( resid   21 and name C    )  1 -180.00  135.00 2
assign ( resid   20 and name C    )   ( resid   21 and name N    ) 
        (resid   21 and name CA   )   ( resid   21 and name C    )  1  -50.00  115.00 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  110.00 2
assign ( resid   21 and name N    )   ( resid   21 and name CA   ) 
        (resid   21 and name C    )   ( resid   22 and name N    )  1   55.00  140.00 2
assign ( resid   21 and name C    )   ( resid   22 and name N    ) 
        (resid   22 and name CA   )   ( resid   22 and name C    )  1  -95.00   50.00 2
assign ( resid   22 and name N    )   ( resid   22 and name CA   ) 
        (resid   22 and name C    )   ( resid   23 and name N    )  1  -25.00   60.00 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   35 and name N    )   ( resid   35 and name CA   ) 
        (resid   35 and name C    )   ( resid   36 and name N    )  1   20.00  105.00 2
assign ( resid   35 and name C    )   ( resid   36 and name N    ) 
        (resid   36 and name CA   )   ( resid   36 and name C    )  1 -180.00  135.00 2
assign ( resid   36 and name N    )   ( resid   36 and name CA   ) 
        (resid   36 and name C    )   ( resid   37 and name N    )  1  175.00  120.00 2
assign ( resid   36 and name N    )   ( resid   36 and name CA   ) 
        (resid   36 and name C    )   ( resid   37 and name N    )  1   -5.00   90.00 2
assign ( resid   37 and name N    )   ( resid   37 and name CA   ) 
        (resid   37 and name C    )   ( resid   38 and name N    )  1  -30.00   25.00 2
assign ( resid   37 and name C    )   ( resid   38 and name N    ) 
        (resid   38 and name CA   )   ( resid   38 and name C    )  1 -100.00   55.00 2
assign ( resid   38 and name N    )   ( resid   38 and name CA   ) 
        (resid   38 and name C    )   ( resid   39 and name N    )  1  -50.00   35.00 2
assign ( resid   38 and name C    )   ( resid   39 and name N    ) 
        (resid   39 and name CA   )   ( resid   39 and name C    )  1 -105.00   60.00 2
assign ( resid   39 and name N    )   ( resid   39 and name CA   ) 
        (resid   39 and name C    )   ( resid   40 and name N    )  1    5.00   90.00 2
assign ( resid   39 and name C    )   ( resid   40 and name N    ) 
        (resid   40 and name CA   )   ( resid   40 and name C    )  1 -125.00   80.00 2
assign ( resid   40 and name N    )   ( resid   40 and name CA   ) 
        (resid   40 and name C    )   ( resid   41 and name N    )  1  -80.00   15.00 2
assign ( resid   41 and name N    )   ( resid   41 and name CA   ) 
        (resid   41 and name C    )   ( resid   42 and name N    )  1  -25.00   30.00 2
assign ( resid   41 and name C    )   ( resid   42 and name N    ) 
        (resid   42 and name CA   )   ( resid   42 and name C    )  1  -85.00   40.00 2
assign ( resid   42 and name N    )   ( resid   42 and name CA   ) 
        (resid   42 and name C    )   ( resid   43 and name N    )  1  165.00   40.00 2
assign ( resid   42 and name C    )   ( resid   43 and name N    ) 
        (resid   43 and name CA   )   ( resid   43 and name C    )  1 -105.00   60.00 2
assign ( resid   43 and name N    )   ( resid   43 and name CA   ) 
        (resid   43 and name C    )   ( resid   44 and name N    )  1  165.00   40.00 2
assign ( resid   43 and name C    )   ( resid   44 and name N    ) 
        (resid   44 and name CA   )   ( resid   44 and name C    )  1  -95.00   50.00 2
assign ( resid   44 and name N    )   ( resid   44 and name CA   ) 
        (resid   44 and name C    )   ( resid   45 and name N    )  1  -15.00   40.00 2
assign ( resid   44 and name C    )   ( resid   45 and name N    ) 
        (resid   45 and name CA   )   ( resid   45 and name C    )  1 -115.00   70.00 2
assign ( resid   45 and name N    )   ( resid   45 and name CA   ) 
        (resid   45 and name C    )   ( resid   46 and name N    )  1  -25.00   60.00 2
assign ( resid   45 and name C    )   ( resid   46 and name N    ) 
        (resid   46 and name CA   )   ( resid   46 and name C    )  1 -115.00   70.00 2
assign ( resid   46 and name N    )   ( resid   46 and name CA   ) 
        (resid   46 and name C    )   ( resid   47 and name N    )  1  -15.00   70.00 2
assign ( resid   46 and name C    )   ( resid   47 and name N    ) 
        (resid   47 and name CA   )   ( resid   47 and name C    )  1 -100.00   55.00 2
assign ( resid   47 and name N    )   ( resid   47 and name CA   ) 
        (resid   47 and name C    )   ( resid   48 and name N    )  1  125.00   40.00 2
assign ( resid   47 and name C    )   ( resid   48 and name N    ) 
        (resid   48 and name CA   )   ( resid   48 and name C    )  1 -180.00  135.00 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  130.00 2
assign ( resid   48 and name N    )   ( resid   48 and name CA   ) 
        (resid   48 and name C    )   ( resid   49 and name N    )  1 -120.00  105.00 2
assign ( resid   48 and name N    )   ( resid   48 and name CA   ) 
        (resid   48 and name C    )   ( resid   49 and name N    )  1   60.00  145.00 2
assign ( resid   58 and name N    )   ( resid   58 and name CA   ) 
        (resid   58 and name C    )   ( resid   59 and name N    )  1  -25.00   30.00 2
assign ( resid   58 and name C    )   ( resid   59 and name N    ) 
        (resid   59 and name CA   )   ( resid   59 and name C    )  1  -95.00   50.00 2
assign ( resid   59 and name N    )   ( resid   59 and name CA   ) 
        (resid   59 and name C    )   ( resid   60 and name N    )  1  -35.00   50.00 2
assign ( resid   59 and name C    )   ( resid   60 and name N    ) 
        (resid   60 and name CA   )   ( resid   60 and name C    )  1 -180.00  135.00 2
assign ( resid   59 and name C    )   ( resid   60 and name N    ) 
        (resid   60 and name CA   )   ( resid   60 and name C    )  1  -45.00  120.00 2
assign ( resid   60 and name N    )   ( resid   60 and name CA   ) 
        (resid   60 and name C    )   ( resid   61 and name N    )  1   20.00  105.00 2
assign ( resid   60 and name C    )   ( resid   61 and name N    ) 
        (resid   61 and name CA   )   ( resid   61 and name C    )  1  -75.00   30.00 2
assign ( resid   61 and name N    )   ( resid   61 and name CA   ) 
        (resid   61 and name C    )   ( resid   62 and name N    )  1  -40.00   45.00 2
assign ( resid   61 and name C    )   ( resid   62 and name N    ) 
        (resid   62 and name CA   )   ( resid   62 and name C    )  1 -100.00   55.00 2
assign ( resid   62 and name N    )   ( resid   62 and name CA   ) 
        (resid   62 and name C    )   ( resid   63 and name N    )  1  -45.00   40.00 2
assign ( resid   62 and name C    )   ( resid   63 and name N    ) 
        (resid   63 and name CA   )   ( resid   63 and name C    )  1  150.00  105.00 2
assign ( resid   62 and name C    )   ( resid   63 and name N    ) 
        (resid   63 and name CA   )   ( resid   63 and name C    )  1  -55.00  130.00 2
assign ( resid   63 and name N    )   ( resid   63 and name CA   ) 
        (resid   63 and name C    )   ( resid   64 and name N    )  1   75.00   10.00 2
assign ( resid   64 and name N    )   ( resid   64 and name CA   ) 
        (resid   64 and name C    )   ( resid   65 and name N    )  1  -35.00   20.00 2
assign ( resid   84 and name C    )   ( resid   85 and name N    ) 
        (resid   85 and name CA   )   ( resid   85 and name C    )  1 -180.00  135.00 2
assign ( resid   85 and name N    )   ( resid   85 and name CA   ) 
        (resid   85 and name C    )   ( resid   86 and name N    )  1    0.00  115.00 2
assign ( resid   85 and name C    )   ( resid   86 and name N    ) 
        (resid   86 and name CA   )   ( resid   86 and name C    )  1 -175.00  130.00 2
assign ( resid   85 and name C    )   ( resid   86 and name N    ) 
        (resid   86 and name CA   )   ( resid   86 and name C    )  1  -60.00  125.00 2
assign ( resid   86 and name N    )   ( resid   86 and name CA   ) 
        (resid   86 and name C    )   ( resid   87 and name N    )  1  -15.00   70.00 2
assign ( resid   86 and name C    )   ( resid   87 and name N    ) 
        (resid   87 and name CA   )   ( resid   87 and name C    )  1 -180.00  135.00 2
assign ( resid   86 and name C    )   ( resid   87 and name N    ) 
        (resid   87 and name CA   )   ( resid   87 and name C    )  1  -55.00  130.00 2
assign ( resid   87 and name N    )   ( resid   87 and name CA   ) 
        (resid   87 and name C    )   ( resid   88 and name N    )  1 -125.00  120.00 2
assign ( resid   87 and name N    )   ( resid   87 and name CA   ) 
        (resid   87 and name C    )   ( resid   88 and name N    )  1   55.00  140.00 2
assign ( resid   87 and name C    )   ( resid   88 and name N    ) 
        (resid   88 and name CA   )   ( resid   88 and name C    )  1 -180.00  135.00 2
assign ( resid   87 and name C    )   ( resid   88 and name N    ) 
        (resid   88 and name CA   )   ( resid   88 and name C    )  1  -55.00  130.00 2
assign ( resid   88 and name N    )   ( resid   88 and name CA   ) 
        (resid   88 and name C    )   ( resid   89 and name N    )  1  170.00   35.00 2
assign ( resid   88 and name C    )   ( resid   89 and name N    ) 
        (resid   89 and name CA   )   ( resid   89 and name C    )  1 -180.00  135.00 2
assign ( resid   89 and name N    )   ( resid   89 and name CA   ) 
        (resid   89 and name C    )   ( resid   90 and name N    )  1 -120.00  145.00 2
assign ( resid   89 and name N    )   ( resid   89 and name CA   ) 
        (resid   89 and name C    )   ( resid   90 and name N    )  1  120.00  145.00 2
assign ( resid   89 and name C    )   ( resid   90 and name N    ) 
        (resid   90 and name CA   )   ( resid   90 and name C    )  1 -175.00  130.00 2
assign ( resid   89 and name C    )   ( resid   90 and name N    ) 
        (resid   90 and name CA   )   ( resid   90 and name C    )  1  -60.00  125.00 2
assign ( resid   90 and name N    )   ( resid   90 and name CA   ) 
        (resid   90 and name C    )   ( resid   91 and name N    )  1  160.00   45.00 2
assign ( resid   90 and name C    )   ( resid   91 and name N    ) 
        (resid   91 and name CA   )   ( resid   91 and name C    )  1 -180.00  135.00 2
assign ( resid   90 and name C    )   ( resid   91 and name N    ) 
        (resid   91 and name CA   )   ( resid   91 and name C    )  1  -60.00  125.00 2
assign ( resid   91 and name N    )   ( resid   91 and name CA   ) 
        (resid   91 and name C    )   ( resid   92 and name N    )  1  115.00   50.00 2
assign ( resid   91 and name N    )   ( resid   91 and name CA   ) 
        (resid   91 and name C    )   ( resid   92 and name N    )  1  -65.00  150.00 2
assign ( resid   92 and name N    )   ( resid   92 and name CA   ) 
        (resid   92 and name C    )   ( resid   93 and name N    )  1  -25.00   30.00 2
assign ( resid   92 and name C    )   ( resid   93 and name N    ) 
        (resid   93 and name CA   )   ( resid   93 and name C    )  1 -180.00  135.00 2
assign ( resid   92 and name C    )   ( resid   93 and name N    ) 
        (resid   93 and name CA   )   ( resid   93 and name C    )  1  -55.00  130.00 2
assign ( resid   93 and name N    )   ( resid   93 and name CA   ) 
        (resid   93 and name C    )   ( resid   94 and name N    )  1    5.00   90.00 2
assign ( resid   93 and name C    )   ( resid   94 and name N    ) 
        (resid   94 and name CA   )   ( resid   94 and name C    )  1 -115.00   70.00 2
assign ( resid   94 and name N    )   ( resid   94 and name CA   ) 
        (resid   94 and name C    )   ( resid   95 and name N    )  1 -125.00  120.00 2
assign ( resid   94 and name N    )   ( resid   94 and name CA   ) 
        (resid   94 and name C    )   ( resid   95 and name N    )  1   55.00  140.00 2
assign ( resid   94 and name C    )   ( resid   95 and name N    ) 
        (resid   95 and name CA   )   ( resid   95 and name C    )  1 -180.00  135.00 2
assign ( resid   94 and name C    )   ( resid   95 and name N    ) 
        (resid   95 and name CA   )   ( resid   95 and name C    )  1  -55.00  130.00 2
assign ( resid   95 and name N    )   ( resid   95 and name CA   ) 
        (resid   95 and name C    )   ( resid   96 and name N    )  1   55.00  140.00 2
assign ( resid   95 and name C    )   ( resid   96 and name N    ) 
        (resid   96 and name CA   )   ( resid   96 and name C    )  1 -180.00  135.00 2
assign ( resid   95 and name C    )   ( resid   96 and name N    ) 
        (resid   96 and name CA   )   ( resid   96 and name C    )  1  -55.00  110.00 2
assign ( resid   96 and name N    )   ( resid   96 and name CA   ) 
        (resid   96 and name C    )   ( resid   97 and name N    )  1   55.00  140.00 2
assign ( resid   96 and name C    )   ( resid   97 and name N    ) 
        (resid   97 and name CA   )   ( resid   97 and name C    )  1 -180.00  135.00 2
assign ( resid   97 and name N    )   ( resid   97 and name CA   ) 
        (resid   97 and name C    )   ( resid   98 and name N    )  1    0.00  125.00 2
assign ( resid   97 and name C    )   ( resid   98 and name N    ) 
        (resid   98 and name CA   )   ( resid   98 and name C    )  1 -175.00  130.00 2
assign ( resid   97 and name C    )   ( resid   98 and name N    ) 
        (resid   98 and name CA   )   ( resid   98 and name C    )  1  -60.00  125.00 2
assign ( resid   98 and name N    )   ( resid   98 and name CA   ) 
        (resid   98 and name C    )   ( resid   99 and name N    )  1 -120.00  155.00 2
assign ( resid   98 and name N    )   ( resid   98 and name CA   ) 
        (resid   98 and name C    )   ( resid   99 and name N    )  1   55.00  140.00 2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           H1       MET   1 -15.084   2.934   5.955
    2    H2   MET   1           H2       MET   1 -16.127   2.129   4.889
    3    H3   MET   1           H3       MET   1 -16.160   3.823   4.989
    4    HA   MET   1           HA       MET   1 -15.017   2.999   3.000
    5    HB2  MET   1           2HB      MET   1 -14.440   5.196   4.001
    6    HB3  MET   1           1HB      MET   1 -13.195   4.407   4.962
    7    HG2  MET   1           2HG      MET   1 -12.128   5.401   3.088
    8    HG3  MET   1           1HG      MET   1 -12.131   3.662   2.835
    9    HE1  MET   1           2HE      MET   1 -15.108   6.495   0.734
   10    HE2  MET   1           3HE      MET   1 -13.915   7.044   1.910
   11    HE3  MET   1           1HE      MET   1 -15.252   6.016   2.425
   12    H    THR   2           HN       THR   2 -13.944   1.333   2.202
   13    HA   THR   2           HA       THR   2 -12.305  -0.284   4.007
   14    HB   THR   2           HB       THR   2 -12.323  -1.969   2.182
   15    HG1  THR   2           1HG      THR   2 -14.285  -0.382   0.888
   16   HG21  THR   2          3HG2      THR   2 -15.048  -0.946   2.985
   17   HG22  THR   2          1HG2      THR   2 -14.043  -2.067   3.906
   18   HG23  THR   2          2HG2      THR   2 -14.707  -2.552   2.345
   19    H    PHE   3           HN       PHE   3 -10.298  -1.270   2.919
   20    HA   PHE   3           HA       PHE   3  -8.558   0.864   2.249
   21    HB2  PHE   3           2HB      PHE   3  -7.820  -1.204   3.399
   22    HB3  PHE   3           1HB      PHE   3  -8.105  -2.111   1.917
   23    HD1  PHE   3           1HD      PHE   3  -6.111   0.695   3.314
   24    HD2  PHE   3           2HD      PHE   3  -6.420  -2.308   0.314
   25    HE1  PHE   3           1HE      PHE   3  -3.819   1.203   2.572
   26    HE2  PHE   3           2HE      PHE   3  -4.128  -1.809  -0.427
   27    HZ   PHE   3           HZ       PHE   3  -2.825  -0.051   0.701
   28    H    SER   4           HN       SER   4 -10.251  -1.564   0.372
   29    HA   SER   4           HA       SER   4  -9.004  -1.098  -2.110
   30    HB2  SER   4           2HB      SER   4 -10.489  -3.062  -1.490
   31    HB3  SER   4           1HB      SER   4 -11.869  -1.983  -1.688
   32    HG   SER   4           HG       SER   4 -10.448  -3.296  -3.561
   33    H    GLU   5           HN       GLU   5 -11.899   0.313  -0.608
   34    HA   GLU   5           HA       GLU   5 -12.640   1.980  -2.755
   35    HB2  GLU   5           2HB      GLU   5 -13.095   2.198   0.216
   36    HB3  GLU   5           1HB      GLU   5 -13.813   3.288  -0.950
   37    HG2  GLU   5           2HG      GLU   5 -15.068   1.512  -1.934
   38    HG3  GLU   5           1HG      GLU   5 -14.235   0.321  -0.938
   39    H    CYS   6           HN       CYS   6 -10.699   2.592   0.148
   40    HA   CYS   6           HA       CYS   6 -10.340   5.352  -0.325
   41    HB2  CYS   6           2HB      CYS   6 -10.024   4.023   1.838
   42    HB3  CYS   6           1HB      CYS   6  -8.435   3.625   1.227
   43    HG   CYS   6           HG       CYS   6  -8.087   6.601   0.841
   44    H    ALA   7           HN       ALA   7  -8.366   2.527  -1.058
   45    HA   ALA   7           HA       ALA   7  -6.144   3.805  -2.161
   46    HB1  ALA   7           1HB      ALA   7  -5.740   1.739  -3.391
   47    HB2  ALA   7           2HB      ALA   7  -7.384   1.202  -3.045
   48    HB3  ALA   7           3HB      ALA   7  -6.226   1.398  -1.729
   49    H    ALA   8           HN       ALA   8  -9.184   2.821  -3.697
   50    HA   ALA   8           HA       ALA   8  -8.554   3.697  -6.299
   51    HB1  ALA   8           1HB      ALA   8 -10.388   2.148  -5.801
   52    HB2  ALA   8           2HB      ALA   8 -10.943   3.536  -6.739
   53    HB3  ALA   8           3HB      ALA   8 -11.270   3.453  -5.008
   54    H    LEU   9           HN       LEU   9  -9.868   5.362  -3.495
   55    HA   LEU   9           HA       LEU   9 -10.625   7.738  -4.850
   56    HB2  LEU   9           2HB      LEU   9  -9.837   7.347  -1.962
   57    HB3  LEU   9           1HB      LEU   9 -10.594   8.785  -2.615
   58    HG   LEU   9           HG       LEU   9 -11.846   6.040  -2.505
   59   HD11  LEU   9          1HD1      LEU   9 -12.404   8.548  -0.928
   60   HD12  LEU   9          2HD1      LEU   9 -11.657   7.075  -0.313
   61   HD13  LEU   9          3HD1      LEU   9 -13.336   7.054  -0.850
   62   HD21  LEU   9          3HD2      LEU   9 -13.891   7.204  -3.222
   63   HD22  LEU   9          1HD2      LEU   9 -12.620   7.270  -4.445
   64   HD23  LEU   9          2HD2      LEU   9 -12.956   8.683  -3.446
   65    H    TYR  10           HN       TYR  10  -7.655   6.742  -3.180
   66    HA   TYR  10           HA       TYR  10  -6.162   9.075  -3.509
   67    HB2  TYR  10           2HB      TYR  10  -5.264   7.285  -2.181
   68    HB3  TYR  10           1HB      TYR  10  -5.325   6.167  -3.535
   69    HD1  TYR  10           2HD      TYR  10  -3.546   9.115  -2.172
   70    HD2  TYR  10           1HD      TYR  10  -3.553   6.059  -5.129
   71    HE1  TYR  10           2HE      TYR  10  -1.236   9.703  -2.781
   72    HE2  TYR  10           1HE      TYR  10  -1.246   6.641  -5.745
   73    HH   TYR  10           HH       TYR  10   0.692   8.797  -3.861
   74    H    ILE  11           HN       ILE  11  -6.571   6.307  -5.628
   75    HA   ILE  11           HA       ILE  11  -4.960   7.129  -7.755
   76    HB   ILE  11           HB       ILE  11  -7.427   5.389  -7.739
   77   HG12  ILE  11          2HG1      ILE  11  -4.498   4.627  -7.790
   78   HG13  ILE  11          1HG1      ILE  11  -5.470   4.704  -6.322
   79   HG21  ILE  11          1HG2      ILE  11  -5.341   5.695  -9.894
   80   HG22  ILE  11          2HG2      ILE  11  -7.020   6.223  -9.990
   81   HG23  ILE  11          3HG2      ILE  11  -6.639   4.504  -9.880
   82   HD11  ILE  11          3HD1      ILE  11  -5.229   2.428  -7.177
   83   HD12  ILE  11          1HD1      ILE  11  -6.018   2.915  -8.677
   84   HD13  ILE  11          2HD1      ILE  11  -6.910   2.955  -7.156
   85    H    LYS  12           HN       LYS  12  -8.466   7.586  -7.256
   86    HA   LYS  12           HA       LYS  12  -8.965   9.009  -9.627
   87    HB2  LYS  12           2HB      LYS  12 -10.353   8.951  -6.958
   88    HB3  LYS  12           1HB      LYS  12 -10.929   9.965  -8.277
   89    HG2  LYS  12           2HG      LYS  12 -11.238   8.016  -9.682
   90    HG3  LYS  12           1HG      LYS  12 -10.581   6.976  -8.415
   91    HD2  LYS  12           2HD      LYS  12 -12.426   7.414  -6.984
   92    HD3  LYS  12           1HD      LYS  12 -13.006   8.713  -8.029
   93    HE2  LYS  12           2HE      LYS  12 -12.837   5.816  -8.841
   94    HE3  LYS  12           1HE      LYS  12 -14.298   6.598  -8.236
   95    HZ1  LYS  12           3HZ      LYS  12 -14.221   8.126 -10.094
   96    HZ2  LYS  12           1HZ      LYS  12 -14.249   6.528 -10.659
   97    HZ3  LYS  12           2HZ      LYS  12 -12.801   7.408 -10.673
   98    H    ALA  13           HN       ALA  13  -7.955  10.149  -6.433
   99    HA   ALA  13           HA       ALA  13  -8.170  12.916  -7.057
  100    HB1  ALA  13           1HB      ALA  13  -8.210  12.071  -4.767
  101    HB2  ALA  13           2HB      ALA  13  -6.944  13.279  -4.990
  102    HB3  ALA  13           3HB      ALA  13  -6.527  11.565  -4.923
  103    H    HIS  14           HN       HIS  14  -6.065  10.643  -8.242
  104    HA   HIS  14           HA       HIS  14  -4.088  12.727  -8.879
  105    HB2  HIS  14           2HB      HIS  14  -3.554   9.854  -8.106
  106    HB3  HIS  14           1HB      HIS  14  -2.357  10.871  -8.904
  107    HD1  HIS  14           1HD      HIS  14  -4.137  10.411  -5.642
  108    HD2  HIS  14           2HD      HIS  14  -1.174  12.806  -7.300
  109    HE1  HIS  14           1HE      HIS  14  -3.096  11.642  -3.706
  110    HE2  HIS  14           2HE      HIS  14  -1.434  13.218  -4.760
  111    H    ARG  15           HN       ARG  15  -6.491  11.119 -10.151
  112    HA   ARG  15           HA       ARG  15  -5.511   9.697 -12.348
  113    HB2  ARG  15           2HB      ARG  15  -8.081  11.131 -11.775
  114    HB3  ARG  15           1HB      ARG  15  -7.794  10.447 -13.366
  115    HG2  ARG  15           2HG      ARG  15  -7.489   8.818 -10.882
  116    HG3  ARG  15           1HG      ARG  15  -9.050   9.036 -11.668
  117    HD2  ARG  15           2HD      ARG  15  -6.592   8.005 -13.071
  118    HD3  ARG  15           1HD      ARG  15  -7.806   6.962 -12.331
  119    HE   ARG  15           HE       ARG  15  -9.329   8.423 -13.947
  120   HH11  ARG  15          1HH1      ARG  15  -6.224   6.961 -14.593
  121   HH12  ARG  15          2HH1      ARG  15  -6.590   6.597 -16.252
  122   HH21  ARG  15          1HH2      ARG  15  -9.830   7.945 -16.124
  123   HH22  ARG  15          2HH2      ARG  15  -8.638   7.157 -17.118
  124    H    SER  16           HN       SER  16  -6.195  13.142 -11.955
  125    HA   SER  16           HA       SER  16  -5.872  13.969 -14.588
  126    HB2  SER  16           2HB      SER  16  -5.005  15.567 -12.178
  127    HB3  SER  16           1HB      SER  16  -5.698  16.151 -13.688
  128    HG   SER  16           HG       SER  16  -7.597  14.782 -13.012
  129    H    SER  17           HN       SER  17  -3.515  13.274 -12.095
  130    HA   SER  17           HA       SER  17  -1.294  14.345 -13.574
  131    HB2  SER  17           2HB      SER  17  -1.249  12.567 -11.130
  132    HB3  SER  17           1HB      SER  17   0.002  13.674 -11.678
  133    HG   SER  17           HG       SER  17  -1.471  15.409 -11.269
  134    H    TRP  18           HN       TRP  18  -3.056  11.463 -13.558
  135    HA   TRP  18           HA       TRP  18  -0.779   9.899 -14.563
  136    HB2  TRP  18           2HB      TRP  18  -3.297   9.027 -13.155
  137    HB3  TRP  18           1HB      TRP  18  -2.215   7.904 -13.966
  138    HD1  TRP  18           1HD      TRP  18   0.323   9.906 -12.696
  139    HE1  TRP  18           1HE      TRP  18   1.066   9.257 -10.314
  140    HE3  TRP  18           3HE      TRP  18  -3.739   7.148 -11.324
  141    HZ2  TRP  18           2HZ      TRP  18   0.055   7.752  -8.143
  142    HZ3  TRP  18           3HZ      TRP  18  -3.775   6.123  -9.089
  143    HH2  TRP  18           2HH      TRP  18  -1.920   6.426  -7.529
  144    H    LYS  19           HN       LYS  19  -2.457  11.688 -16.231
  145    HA   LYS  19           HA       LYS  19  -2.965  11.607 -18.402
  146    HB2  LYS  19           2HB      LYS  19  -2.386   8.682 -18.151
  147    HB3  LYS  19           1HB      LYS  19  -2.678   9.531 -19.664
  148    HG2  LYS  19           2HG      LYS  19  -0.520  10.387 -17.771
  149    HG3  LYS  19           1HG      LYS  19  -0.257   9.128 -18.978
  150    HD2  LYS  19           2HD      LYS  19  -0.894  10.708 -20.747
  151    HD3  LYS  19           1HD      LYS  19  -1.126  11.964 -19.528
  152    HE2  LYS  19           2HE      LYS  19   1.185  11.950 -18.962
  153    HE3  LYS  19           1HE      LYS  19   1.476  10.502 -19.926
  154    HZ1  LYS  19           3HZ      LYS  19   2.232  12.500 -21.056
  155    HZ2  LYS  19           1HZ      LYS  19   0.666  13.151 -21.002
  156    HZ3  LYS  19           2HZ      LYS  19   0.973  11.758 -21.915
  157    H    ASN  20           HN       ASN  20  -5.909  10.502 -19.375
  158    HA   ASN  20           HA       ASN  20  -5.830   7.919 -18.583
  159    HB2  ASN  20           2HB      ASN  20  -6.104   9.169 -21.275
  160    HB3  ASN  20           1HB      ASN  20  -6.215   7.428 -21.042
  161   HD21  ASN  20          1HD2      ASN  20  -8.016   6.565 -20.105
  162   HD22  ASN  20          2HD2      ASN  20  -9.427   7.492 -19.711
  163    H    THR  21           HN       THR  21  -4.000   7.155 -17.872
  164    HA   THR  21           HA       THR  21  -2.813   5.535 -19.995
  165    HB   THR  21           HB       THR  21  -0.676   5.343 -18.584
  166    HG1  THR  21           1HG      THR  21  -1.901   7.571 -17.426
  167   HG21  THR  21          3HG2      THR  21  -1.186   7.863 -20.156
  168   HG22  THR  21          1HG2      THR  21  -0.683   6.303 -20.809
  169   HG23  THR  21          2HG2      THR  21   0.401   7.209 -19.753
  170    H    LYS  22           HN       LYS  22  -1.748   3.518 -18.938
  171    HA   LYS  22           HA       LYS  22  -3.817   2.463 -17.200
  172    HB2  LYS  22           2HB      LYS  22  -1.536   1.134 -18.651
  173    HB3  LYS  22           1HB      LYS  22  -2.640   0.279 -17.587
  174    HG2  LYS  22           2HG      LYS  22  -4.436   1.447 -19.169
  175    HG3  LYS  22           1HG      LYS  22  -3.082   1.374 -20.299
  176    HD2  LYS  22           2HD      LYS  22  -4.436  -0.618 -20.540
  177    HD3  LYS  22           1HD      LYS  22  -2.881  -1.055 -19.827
  178    HE2  LYS  22           2HE      LYS  22  -3.886  -1.091 -17.612
  179    HE3  LYS  22           1HE      LYS  22  -5.431  -0.587 -18.289
  180    HZ1  LYS  22           3HZ      LYS  22  -5.605  -2.651 -19.463
  181    HZ2  LYS  22           1HZ      LYS  22  -5.294  -2.983 -17.832
  182    HZ3  LYS  22           2HZ      LYS  22  -4.053  -3.127 -18.974
  183    H    HIS  23           HN       HIS  23  -1.256   4.178 -16.454
  184    HA   HIS  23           HA       HIS  23   0.092   2.666 -14.493
  185    HB2  HIS  23           2HB      HIS  23  -0.345   5.634 -14.798
  186    HB3  HIS  23           1HB      HIS  23   0.539   4.965 -13.432
  187    HD1  HIS  23           1HD      HIS  23   2.922   4.138 -13.847
  188    HD2  HIS  23           2HD      HIS  23   0.975   5.408 -17.303
  189    HE1  HIS  23           1HE      HIS  23   4.695   4.255 -15.622
  190    HE2  HIS  23           2HE      HIS  23   3.520   5.087 -17.690
  191    H    ALA  24           HN       ALA  24  -2.797   4.700 -14.334
  192    HA   ALA  24           HA       ALA  24  -3.346   4.390 -11.591
  193    HB1  ALA  24           1HB      ALA  24  -5.296   4.765 -13.870
  194    HB2  ALA  24           2HB      ALA  24  -4.457   6.055 -13.009
  195    HB3  ALA  24           3HB      ALA  24  -5.629   5.046 -12.162
  196    H    ASP  25           HN       ASP  25  -4.121   2.428 -14.410
  197    HA   ASP  25           HA       ASP  25  -5.796   0.545 -13.140
  198    HB2  ASP  25           2HB      ASP  25  -5.727   0.678 -15.556
  199    HB3  ASP  25           1HB      ASP  25  -4.017   0.281 -15.570
  200    H    GLN  26           HN       GLN  26  -2.328   0.578 -13.800
  201    HA   GLN  26           HA       GLN  26  -1.678  -1.891 -12.721
  202    HB2  GLN  26           2HB      GLN  26  -0.122   0.670 -12.971
  203    HB3  GLN  26           1HB      GLN  26   0.592  -0.812 -12.361
  204    HG2  GLN  26           2HG      GLN  26  -0.679  -0.477 -15.065
  205    HG3  GLN  26           1HG      GLN  26   1.051  -0.473 -14.735
  206   HE21  GLN  26          1HE2      GLN  26  -1.825  -2.409 -14.967
  207   HE22  GLN  26          2HE2      GLN  26  -1.024  -3.946 -14.956
  208    H    TRP  27           HN       TRP  27  -1.895   1.276 -11.102
  209    HA   TRP  27           HA       TRP  27  -1.121   0.407  -8.546
  210    HB2  TRP  27           2HB      TRP  27  -2.871   2.652  -9.509
  211    HB3  TRP  27           1HB      TRP  27  -2.703   2.332  -7.788
  212    HD1  TRP  27           1HD      TRP  27  -0.354   3.054 -10.803
  213    HE1  TRP  27           1HE      TRP  27   1.613   4.479  -9.954
  214    HE3  TRP  27           3HE      TRP  27  -1.546   3.184  -5.835
  215    HZ2  TRP  27           2HZ      TRP  27   2.542   5.512  -7.488
  216    HZ3  TRP  27           3HZ      TRP  27  -0.069   4.408  -4.300
  217    HH2  TRP  27           2HH      TRP  27   1.933   5.548  -5.109
  218    H    THR  28           HN       THR  28  -4.354   0.677  -9.982
  219    HA   THR  28           HA       THR  28  -5.815  -0.280  -7.791
  220    HB   THR  28           HB       THR  28  -6.578  -0.654 -10.692
  221    HG1  THR  28           1HG      THR  28  -6.051   1.513 -10.483
  222   HG21  THR  28          3HG2      THR  28  -8.870  -0.354  -9.828
  223   HG22  THR  28          1HG2      THR  28  -8.224  -0.247  -8.189
  224   HG23  THR  28          2HG2      THR  28  -8.061  -1.745  -9.106
  225    H    ASN  29           HN       ASN  29  -4.526  -1.959 -10.634
  226    HA   ASN  29           HA       ASN  29  -5.751  -4.445 -10.147
  227    HB2  ASN  29           2HB      ASN  29  -4.647  -3.504 -12.294
  228    HB3  ASN  29           1HB      ASN  29  -3.148  -4.138 -11.626
  229   HD21  ASN  29          1HD2      ASN  29  -4.564  -4.887 -14.036
  230   HD22  ASN  29          2HD2      ASN  29  -4.919  -6.577 -13.895
  231    H    THR  30           HN       THR  30  -2.490  -3.251  -9.407
  232    HA   THR  30           HA       THR  30  -1.478  -5.649  -8.357
  233    HB   THR  30           HB       THR  30  -0.680  -2.865  -7.499
  234    HG1  THR  30           1HG      THR  30  -0.542  -3.019  -9.758
  235   HG21  THR  30          3HG2      THR  30   0.831  -5.475  -7.536
  236   HG22  THR  30          1HG2      THR  30   0.263  -4.619  -6.104
  237   HG23  THR  30          2HG2      THR  30   1.518  -3.907  -7.117
  238    H    ILE  31           HN       ILE  31  -3.021  -2.880  -6.738
  239    HA   ILE  31           HA       ILE  31  -2.772  -3.931  -4.129
  240    HB   ILE  31           HB       ILE  31  -4.708  -1.883  -5.212
  241   HG12  ILE  31          2HG1      ILE  31  -2.134  -1.565  -3.649
  242   HG13  ILE  31          1HG1      ILE  31  -2.311  -1.282  -5.377
  243   HG21  ILE  31          1HG2      ILE  31  -4.057  -2.557  -2.343
  244   HG22  ILE  31          2HG2      ILE  31  -5.579  -2.896  -3.167
  245   HG23  ILE  31          3HG2      ILE  31  -5.081  -1.227  -2.888
  246   HD11  ILE  31          3HD1      ILE  31  -3.873   0.534  -4.917
  247   HD12  ILE  31          1HD1      ILE  31  -2.312   0.798  -4.136
  248   HD13  ILE  31          2HD1      ILE  31  -3.692   0.250  -3.186
  249    H    LYS  32           HN       LYS  32  -5.417  -4.009  -6.492
  250    HA   LYS  32           HA       LYS  32  -7.328  -5.291  -4.902
  251    HB2  LYS  32           2HB      LYS  32  -7.697  -4.238  -7.164
  252    HB3  LYS  32           1HB      LYS  32  -6.967  -5.668  -7.879
  253    HG2  LYS  32           2HG      LYS  32  -8.739  -7.032  -6.749
  254    HG3  LYS  32           1HG      LYS  32  -9.515  -5.515  -6.289
  255    HD2  LYS  32           2HD      LYS  32 -10.637  -6.033  -8.232
  256    HD3  LYS  32           1HD      LYS  32  -9.355  -4.989  -8.844
  257    HE2  LYS  32           2HE      LYS  32  -9.217  -8.002  -8.797
  258    HE3  LYS  32           1HE      LYS  32  -9.740  -7.060 -10.189
  259    HZ1  LYS  32           3HZ      LYS  32  -7.387  -7.749 -10.276
  260    HZ2  LYS  32           1HZ      LYS  32  -7.076  -6.804  -8.909
  261    HZ3  LYS  32           2HZ      LYS  32  -7.584  -6.064 -10.344
  262    H    THR  33           HN       THR  33  -4.623  -6.550  -6.717
  263    HA   THR  33           HA       THR  33  -5.520  -9.286  -6.520
  264    HB   THR  33           HB       THR  33  -2.866  -8.193  -7.485
  265    HG1  THR  33           1HG      THR  33  -4.186  -7.475  -9.014
  266   HG21  THR  33          3HG2      THR  33  -2.741 -10.566  -6.916
  267   HG22  THR  33          1HG2      THR  33  -2.688 -10.351  -8.665
  268   HG23  THR  33          2HG2      THR  33  -4.175 -10.893  -7.888
  269    H    TYR  34           HN       TYR  34  -2.766  -7.421  -5.195
  270    HA   TYR  34           HA       TYR  34  -1.893  -9.682  -3.644
  271    HB2  TYR  34           2HB      TYR  34  -0.918  -6.840  -3.871
  272    HB3  TYR  34           1HB      TYR  34  -0.212  -7.990  -2.740
  273    HD1  TYR  34           2HD      TYR  34  -0.865  -7.411  -6.359
  274    HD2  TYR  34           1HD      TYR  34   1.407  -9.527  -3.446
  275    HE1  TYR  34           2HE      TYR  34   0.606  -8.266  -8.134
  276    HE2  TYR  34           1HE      TYR  34   2.882 -10.390  -5.213
  277    HH   TYR  34           HH       TYR  34   2.808  -9.175  -8.432
  278    H    CYS  35           HN       CYS  35  -3.320  -6.514  -2.867
  279    HA   CYS  35           HA       CYS  35  -3.375  -7.265  -0.043
  280    HB2  CYS  35           2HB      CYS  35  -4.063  -4.622  -1.346
  281    HB3  CYS  35           1HB      CYS  35  -3.882  -4.920   0.380
  282    HG   CYS  35           HG       CYS  35  -1.092  -5.837  -0.271
  283    H    GLY  36           HN       GLY  36  -5.396  -7.224  -2.740
  284    HA2  GLY  36           2HA      GLY  36  -7.852  -6.345  -1.814
  285    HA3  GLY  36           1HA      GLY  36  -7.635  -7.545  -3.074
  286    HA   PRO  37           HA       PRO  37  -9.303 -10.783  -0.672
  287    HB2  PRO  37           2HB      PRO  37  -6.818 -12.375  -0.566
  288    HB3  PRO  37           1HB      PRO  37  -8.376 -12.763  -1.304
  289    HG2  PRO  37           2HG      PRO  37  -6.242 -12.156  -2.800
  290    HG3  PRO  37           1HG      PRO  37  -7.873 -11.641  -3.265
  291    HD2  PRO  37           2HD      PRO  37  -5.681 -10.057  -1.980
  292    HD3  PRO  37           1HD      PRO  37  -6.806  -9.585  -3.272
  293    H    VAL  38           HN       VAL  38  -6.634  -9.158   0.659
  294    HA   VAL  38           HA       VAL  38  -6.944 -10.572   3.220
  295    HB   VAL  38           HB       VAL  38  -4.685  -8.733   2.428
  296   HG11  VAL  38          1HG1      VAL  38  -5.020 -10.623   4.757
  297   HG12  VAL  38          2HG1      VAL  38  -5.027  -8.862   4.827
  298   HG13  VAL  38          3HG1      VAL  38  -3.552  -9.720   4.380
  299   HG21  VAL  38          3HG2      VAL  38  -3.339 -10.787   2.184
  300   HG22  VAL  38          1HG2      VAL  38  -4.646 -10.694   1.002
  301   HG23  VAL  38          2HG2      VAL  38  -4.798 -11.750   2.405
  302    H    ILE  39           HN       ILE  39  -6.026  -7.243   2.283
  303    HA   ILE  39           HA       ILE  39  -7.598  -6.313   4.591
  304    HB   ILE  39           HB       ILE  39  -6.183  -4.277   4.525
  305   HG12  ILE  39          2HG1      ILE  39  -4.568  -5.827   2.486
  306   HG13  ILE  39          1HG1      ILE  39  -5.557  -4.416   2.128
  307   HG21  ILE  39          1HG2      ILE  39  -4.184  -5.330   5.460
  308   HG22  ILE  39          2HG2      ILE  39  -4.688  -6.879   4.783
  309   HG23  ILE  39          3HG2      ILE  39  -5.661  -6.106   6.034
  310   HD11  ILE  39          3HD1      ILE  39  -3.113  -4.490   3.882
  311   HD12  ILE  39          1HD1      ILE  39  -4.128  -3.073   3.613
  312   HD13  ILE  39          2HD1      ILE  39  -3.239  -3.788   2.268
  313    H    GLY  40           HN       GLY  40  -7.866  -6.568   1.355
  314    HA2  GLY  40           2HA      GLY  40  -8.567  -4.104   0.320
  315    HA3  GLY  40           1HA      GLY  40  -9.266  -5.629  -0.193
  316    HA   PRO  41           HA       PRO  41 -13.114  -4.483   1.615
  317    HB2  PRO  41           2HB      PRO  41 -14.079  -6.675   2.821
  318    HB3  PRO  41           1HB      PRO  41 -13.825  -6.618   1.072
  319    HG2  PRO  41           2HG      PRO  41 -12.109  -7.843   3.196
  320    HG3  PRO  41           1HG      PRO  41 -12.555  -8.491   1.607
  321    HD2  PRO  41           2HD      PRO  41 -10.163  -7.267   2.135
  322    HD3  PRO  41           1HD      PRO  41 -10.917  -7.310   0.529
  323    H    LEU  42           HN       LEU  42 -10.565  -4.870   3.652
  324    HA   LEU  42           HA       LEU  42 -12.064  -4.512   6.116
  325    HB2  LEU  42           2HB      LEU  42  -9.091  -4.483   5.575
  326    HB3  LEU  42           1HB      LEU  42  -9.817  -4.326   7.163
  327    HG   LEU  42           HG       LEU  42  -9.972  -6.755   5.368
  328   HD11  LEU  42          1HD1      LEU  42  -8.530  -6.276   7.975
  329   HD12  LEU  42          2HD1      LEU  42  -7.784  -6.466   6.389
  330   HD13  LEU  42          3HD1      LEU  42  -8.637  -7.819   7.129
  331   HD21  LEU  42          3HD2      LEU  42 -11.073  -6.329   8.144
  332   HD22  LEU  42          1HD2      LEU  42 -11.104  -7.837   7.232
  333   HD23  LEU  42          2HD2      LEU  42 -12.028  -6.446   6.666
  334    H    SER  43           HN       SER  43 -11.765  -2.595   7.446
  335    HA   SER  43           HA       SER  43 -12.128  -0.222   5.964
  336    HB2  SER  43           2HB      SER  43 -13.087  -0.543   8.210
  337    HB3  SER  43           1HB      SER  43 -11.466  -0.542   8.903
  338    HG   SER  43           HG       SER  43 -12.998   1.568   7.914
  339    H    VAL  44           HN       VAL  44 -10.769   1.403   5.417
  340    HA   VAL  44           HA       VAL  44  -7.987   0.906   5.297
  341    HB   VAL  44           HB       VAL  44  -9.191   2.320   3.657
  342   HG11  VAL  44          1HG1      VAL  44  -9.737   4.640   4.203
  343   HG12  VAL  44          2HG1      VAL  44  -9.308   4.342   5.888
  344   HG13  VAL  44          3HG1      VAL  44 -10.680   3.501   5.166
  345   HG21  VAL  44          3HG2      VAL  44  -6.778   2.494   3.798
  346   HG22  VAL  44          1HG2      VAL  44  -6.913   3.697   5.080
  347   HG23  VAL  44          2HG2      VAL  44  -7.476   4.076   3.453
  348    H    GLN  45           HN       GLN  45 -10.018   2.232   7.706
  349    HA   GLN  45           HA       GLN  45  -7.888   3.624   9.081
  350    HB2  GLN  45           2HB      GLN  45 -10.236   4.440   9.136
  351    HB3  GLN  45           1HB      GLN  45 -10.693   2.992  10.022
  352    HG2  GLN  45           2HG      GLN  45  -9.423   3.636  11.910
  353    HG3  GLN  45           1HG      GLN  45  -8.618   4.924  11.014
  354   HE21  GLN  45          1HE2      GLN  45  -9.741   6.807  10.549
  355   HE22  GLN  45          2HE2      GLN  45 -11.162   7.269  11.409
  356    H    ASP  46           HN       ASP  46  -9.505   0.534   9.165
  357    HA   ASP  46           HA       ASP  46  -8.229  -0.207  11.672
  358    HB2  ASP  46           2HB      ASP  46 -10.318  -1.474   9.933
  359    HB3  ASP  46           1HB      ASP  46  -9.464  -2.435  11.136
  360    H    VAL  47           HN       VAL  47  -7.050   0.007   8.702
  361    HA   VAL  47           HA       VAL  47  -5.772  -2.516   8.358
  362    HB   VAL  47           HB       VAL  47  -4.938   0.221   7.358
  363   HG11  VAL  47          1HG1      VAL  47  -3.529  -0.986   5.760
  364   HG12  VAL  47          2HG1      VAL  47  -3.959  -2.512   6.534
  365   HG13  VAL  47          3HG1      VAL  47  -3.030  -1.303   7.423
  366   HG21  VAL  47          3HG2      VAL  47  -6.382  -2.041   5.977
  367   HG22  VAL  47          1HG2      VAL  47  -5.872  -0.533   5.222
  368   HG23  VAL  47          2HG2      VAL  47  -7.101  -0.512   6.486
  369    H    ASP  48           HN       ASP  48  -4.195  -3.374   9.542
  370    HA   ASP  48           HA       ASP  48  -2.669  -1.581  11.316
  371    HB2  ASP  48           2HB      ASP  48  -4.168  -3.000  12.586
  372    HB3  ASP  48           1HB      ASP  48  -3.543  -4.436  11.793
  373    H    THR  49           HN       THR  49  -0.576  -2.447  11.998
  374    HA   THR  49           HA       THR  49   1.115  -2.856   9.787
  375    HB   THR  49           HB       THR  49   1.842  -3.503  12.646
  376    HG1  THR  49           1HG      THR  49   1.293  -1.500  13.073
  377   HG21  THR  49          3HG2      THR  49   4.038  -2.644  11.975
  378   HG22  THR  49          1HG2      THR  49   3.425  -2.329  10.353
  379   HG23  THR  49          2HG2      THR  49   3.539  -3.986  10.946
  380    H    LYS  50           HN       LYS  50  -0.255  -5.038  12.181
  381    HA   LYS  50           HA       LYS  50   1.197  -7.369  11.632
  382    HB2  LYS  50           2HB      LYS  50  -0.442  -6.967  13.515
  383    HB3  LYS  50           1HB      LYS  50  -1.734  -7.216  12.353
  384    HG2  LYS  50           2HG      LYS  50  -0.395  -9.476  11.945
  385    HG3  LYS  50           1HG      LYS  50   0.094  -9.168  13.612
  386    HD2  LYS  50           2HD      LYS  50  -2.679  -9.552  12.519
  387    HD3  LYS  50           1HD      LYS  50  -1.853 -10.490  13.761
  388    HE2  LYS  50           2HE      LYS  50  -2.698  -7.608  14.045
  389    HE3  LYS  50           1HE      LYS  50  -3.604  -8.985  14.664
  390    HZ1  LYS  50           3HZ      LYS  50  -1.698  -9.541  16.064
  391    HZ2  LYS  50           1HZ      LYS  50  -2.285  -7.985  16.394
  392    HZ3  LYS  50           2HZ      LYS  50  -0.866  -8.177  15.495
  393    H    LEU  51           HN       LEU  51  -1.758  -6.086  10.210
  394    HA   LEU  51           HA       LEU  51  -2.367  -8.276   8.559
  395    HB2  LEU  51           2HB      LEU  51  -3.081  -5.358   8.238
  396    HB3  LEU  51           1HB      LEU  51  -3.853  -6.686   7.406
  397    HG   LEU  51           HG       LEU  51  -3.932  -6.150  10.366
  398   HD11  LEU  51          1HD1      LEU  51  -5.336  -4.660   9.029
  399   HD12  LEU  51          2HD1      LEU  51  -6.303  -5.765  10.002
  400   HD13  LEU  51          3HD1      LEU  51  -6.098  -6.059   8.275
  401   HD21  LEU  51          3HD2      LEU  51  -5.474  -8.045  10.491
  402   HD22  LEU  51          1HD2      LEU  51  -3.879  -8.549   9.933
  403   HD23  LEU  51          2HD2      LEU  51  -5.203  -8.379   8.782
  404    H    ILE  52           HN       ILE  52  -0.520  -5.316   8.007
  405    HA   ILE  52           HA       ILE  52  -0.127  -5.718   5.233
  406    HB   ILE  52           HB       ILE  52   1.554  -4.101   7.159
  407   HG12  ILE  52          2HG1      ILE  52  -0.791  -3.266   5.434
  408   HG13  ILE  52          1HG1      ILE  52  -0.836  -3.467   7.182
  409   HG21  ILE  52          1HG2      ILE  52   2.197  -2.823   5.153
  410   HG22  ILE  52          2HG2      ILE  52   1.299  -3.968   4.155
  411   HG23  ILE  52          3HG2      ILE  52   2.710  -4.509   5.067
  412   HD11  ILE  52          3HD1      ILE  52   0.729  -1.644   7.456
  413   HD12  ILE  52          1HD1      ILE  52  -0.664  -1.123   6.507
  414   HD13  ILE  52          2HD1      ILE  52   0.866  -1.476   5.706
  415    H    MET  53           HN       MET  53   1.825  -6.495   8.097
  416    HA   MET  53           HA       MET  53   4.067  -7.461   6.680
  417    HB2  MET  53           2HB      MET  53   3.092  -7.997   9.484
  418    HB3  MET  53           1HB      MET  53   4.599  -8.649   8.856
  419    HG2  MET  53           2HG      MET  53   5.350  -6.331   8.406
  420    HG3  MET  53           1HG      MET  53   3.883  -5.746   9.182
  421    HE1  MET  53           3HE      MET  53   3.538  -7.847  11.555
  422    HE2  MET  53           1HE      MET  53   3.328  -6.105  11.750
  423    HE3  MET  53           2HE      MET  53   4.365  -6.999  12.861
  424    H    LYS  54           HN       LYS  54   1.092  -8.991   7.748
  425    HA   LYS  54           HA       LYS  54   1.784 -11.662   7.251
  426    HB2  LYS  54           2HB      LYS  54  -0.881 -10.258   7.130
  427    HB3  LYS  54           1HB      LYS  54  -0.708 -11.992   6.897
  428    HG2  LYS  54           2HG      LYS  54   0.295 -12.159   9.149
  429    HG3  LYS  54           1HG      LYS  54   0.004 -10.432   9.375
  430    HD2  LYS  54           2HD      LYS  54  -1.774 -11.695  10.424
  431    HD3  LYS  54           1HD      LYS  54  -2.410 -10.831   9.022
  432    HE2  LYS  54           2HE      LYS  54  -2.257 -12.883   7.692
  433    HE3  LYS  54           1HE      LYS  54  -1.619 -13.744   9.093
  434    HZ1  LYS  54           3HZ      LYS  54  -3.703 -13.271  10.255
  435    HZ2  LYS  54           1HZ      LYS  54  -3.967 -14.169   8.839
  436    HZ3  LYS  54           2HZ      LYS  54  -4.314 -12.507   8.872
  437    H    VAL  55           HN       VAL  55   0.656  -9.123   5.097
  438    HA   VAL  55           HA       VAL  55   0.294 -10.883   2.854
  439    HB   VAL  55           HB       VAL  55   0.560  -7.872   2.834
  440   HG11  VAL  55          1HG1      VAL  55  -0.685  -9.765   0.846
  441   HG12  VAL  55          2HG1      VAL  55   0.843  -8.909   0.644
  442   HG13  VAL  55          3HG1      VAL  55  -0.669  -8.004   0.728
  443   HG21  VAL  55          3HG2      VAL  55  -1.230  -8.559   4.340
  444   HG22  VAL  55          1HG2      VAL  55  -1.925  -9.563   3.069
  445   HG23  VAL  55          2HG2      VAL  55  -1.884  -7.811   2.883
  446    H    LEU  56           HN       LEU  56   2.749  -8.501   3.819
  447    HA   LEU  56           HA       LEU  56   4.182  -8.652   1.380
  448    HB2  LEU  56           2HB      LEU  56   5.000  -7.600   4.080
  449    HB3  LEU  56           1HB      LEU  56   5.956  -7.413   2.623
  450    HG   LEU  56           HG       LEU  56   3.203  -6.269   3.102
  451   HD11  LEU  56          1HD1      LEU  56   4.352  -4.114   3.018
  452   HD12  LEU  56          2HD1      LEU  56   5.900  -4.944   2.873
  453   HD13  LEU  56          3HD1      LEU  56   4.944  -5.116   4.342
  454   HD21  LEU  56          3HD2      LEU  56   3.460  -6.876   0.769
  455   HD22  LEU  56          1HD2      LEU  56   5.018  -6.048   0.701
  456   HD23  LEU  56          2HD2      LEU  56   3.537  -5.123   0.954
  457    H    ASP  57           HN       ASP  57   4.530 -10.393   4.432
  458    HA   ASP  57           HA       ASP  57   7.196 -11.172   4.160
  459    HB2  ASP  57           2HB      ASP  57   5.655 -11.421   6.192
  460    HB3  ASP  57           1HB      ASP  57   5.148 -12.932   5.478
  461    HA   PRO  58           HA       PRO  58   5.540 -15.266   1.854
  462    HB2  PRO  58           2HB      PRO  58   3.177 -13.939   0.639
  463    HB3  PRO  58           1HB      PRO  58   3.382 -15.611   1.163
  464    HG2  PRO  58           2HG      PRO  58   1.940 -13.819   2.566
  465    HG3  PRO  58           1HG      PRO  58   2.842 -15.133   3.339
  466    HD2  PRO  58           2HD      PRO  58   3.421 -12.233   3.282
  467    HD3  PRO  58           1HD      PRO  58   3.893 -13.470   4.453
  468    H    ILE  59           HN       ILE  59   4.933 -11.953   0.758
  469    HA   ILE  59           HA       ILE  59   5.445 -12.457  -1.984
  470    HB   ILE  59           HB       ILE  59   5.586  -9.807  -0.537
  471   HG12  ILE  59          2HG1      ILE  59   3.255 -11.108  -1.971
  472   HG13  ILE  59          1HG1      ILE  59   3.414 -10.957  -0.222
  473   HG21  ILE  59          1HG2      ILE  59   5.124  -8.841  -2.740
  474   HG22  ILE  59          2HG2      ILE  59   5.180 -10.451  -3.458
  475   HG23  ILE  59          3HG2      ILE  59   6.632  -9.754  -2.738
  476   HD11  ILE  59          3HD1      ILE  59   3.370  -8.519  -0.441
  477   HD12  ILE  59          1HD1      ILE  59   1.918  -9.270  -1.103
  478   HD13  ILE  59          2HD1      ILE  59   3.181  -8.684  -2.187
  479    H    TRP  60           HN       TRP  60   7.514 -11.507   0.715
  480    HA   TRP  60           HA       TRP  60   9.748 -10.637  -0.714
  481    HB2  TRP  60           2HB      TRP  60   9.539 -12.054   1.941
  482    HB3  TRP  60           1HB      TRP  60  11.067 -11.469   1.297
  483    HD1  TRP  60           1HD      TRP  60   8.243 -10.400   3.408
  484    HE1  TRP  60           1HE      TRP  60   8.346  -7.866   3.850
  485    HE3  TRP  60           3HE      TRP  60  11.736  -9.096  -0.099
  486    HZ2  TRP  60           2HZ      TRP  60   9.723  -5.614   2.848
  487    HZ3  TRP  60           3HZ      TRP  60  12.391  -6.732  -0.290
  488    HH2  TRP  60           2HH      TRP  60  11.404  -5.029   1.154
  489    H    GLU  61           HN       GLU  61   8.634 -13.888  -0.034
  490    HA   GLU  61           HA       GLU  61  10.985 -15.257  -0.736
  491    HB2  GLU  61           2HB      GLU  61   8.081 -16.040  -0.605
  492    HB3  GLU  61           1HB      GLU  61   9.353 -17.176  -0.991
  493    HG2  GLU  61           2HG      GLU  61   9.235 -15.567   1.539
  494    HG3  GLU  61           1HG      GLU  61   8.643 -17.221   1.378
  495    H    GLN  62           HN       GLN  62   8.096 -14.352  -2.580
  496    HA   GLN  62           HA       GLN  62   9.153 -15.653  -4.958
  497    HB2  GLN  62           2HB      GLN  62   6.911 -14.859  -5.926
  498    HB3  GLN  62           1HB      GLN  62   6.885 -16.124  -4.716
  499    HG2  GLN  62           2HG      GLN  62   6.298 -14.488  -3.004
  500    HG3  GLN  62           1HG      GLN  62   6.331 -13.211  -4.219
  501   HE21  GLN  62          1HE2      GLN  62   4.150 -14.185  -2.496
  502   HE22  GLN  62          2HE2      GLN  62   2.861 -14.621  -3.568
  503    H    LYS  63           HN       LYS  63   8.020 -12.417  -4.018
  504    HA   LYS  63           HA       LYS  63   9.600 -11.296  -6.232
  505    HB2  LYS  63           2HB      LYS  63   6.763 -10.500  -5.539
  506    HB3  LYS  63           1HB      LYS  63   7.762  -9.770  -6.784
  507    HG2  LYS  63           2HG      LYS  63   6.930 -12.657  -6.810
  508    HG3  LYS  63           1HG      LYS  63   6.016 -11.375  -7.594
  509    HD2  LYS  63           2HD      LYS  63   8.223 -10.813  -8.786
  510    HD3  LYS  63           1HD      LYS  63   8.756 -12.405  -8.244
  511    HE2  LYS  63           2HE      LYS  63   6.377 -11.779  -9.991
  512    HE3  LYS  63           1HE      LYS  63   7.876 -12.558 -10.489
  513    HZ1  LYS  63           3HZ      LYS  63   6.171 -14.198 -10.203
  514    HZ2  LYS  63           1HZ      LYS  63   5.838 -13.666  -8.627
  515    HZ3  LYS  63           2HZ      LYS  63   7.323 -14.410  -8.979
  516    HA   PRO  64           HA       PRO  64  10.405  -9.119  -2.195
  517    HB2  PRO  64           2HB      PRO  64  13.057  -8.671  -2.731
  518    HB3  PRO  64           1HB      PRO  64  12.448 -10.122  -1.928
  519    HG2  PRO  64           2HG      PRO  64  13.211  -9.720  -4.790
  520    HG3  PRO  64           1HG      PRO  64  13.521 -11.109  -3.732
  521    HD2  PRO  64           2HD      PRO  64  11.554 -11.114  -5.577
  522    HD3  PRO  64           1HD      PRO  64  11.400 -11.969  -4.030
  523    H    GLU  65           HN       GLU  65  11.387  -8.369  -5.490
  524    HA   GLU  65           HA       GLU  65  11.819  -5.626  -5.190
  525    HB2  GLU  65           2HB      GLU  65  10.830  -7.113  -7.617
  526    HB3  GLU  65           1HB      GLU  65  11.656  -5.575  -7.594
  527    HG2  GLU  65           2HG      GLU  65  13.672  -6.630  -6.759
  528    HG3  GLU  65           1HG      GLU  65  12.847  -8.188  -6.725
  529    H    THR  66           HN       THR  66   8.958  -7.519  -6.033
  530    HA   THR  66           HA       THR  66   7.257  -5.307  -6.502
  531    HB   THR  66           HB       THR  66   6.423  -8.102  -5.712
  532    HG1  THR  66           1HG      THR  66   7.475  -7.045  -8.103
  533   HG21  THR  66          3HG2      THR  66   4.593  -6.502  -5.719
  534   HG22  THR  66          1HG2      THR  66   4.442  -7.593  -7.096
  535   HG23  THR  66          2HG2      THR  66   5.047  -5.952  -7.333
  536    H    ALA  67           HN       ALA  67   7.946  -7.307  -3.678
  537    HA   ALA  67           HA       ALA  67   5.995  -6.269  -1.954
  538    HB1  ALA  67           1HB      ALA  67   8.753  -7.284  -1.262
  539    HB2  ALA  67           2HB      ALA  67   7.295  -8.263  -1.420
  540    HB3  ALA  67           3HB      ALA  67   7.417  -7.069  -0.129
  541    H    SER  68           HN       SER  68   9.295  -5.197  -2.634
  542    HA   SER  68           HA       SER  68   9.355  -3.061  -0.809
  543    HB2  SER  68           2HB      SER  68  10.828  -3.297  -3.445
  544    HB3  SER  68           1HB      SER  68  11.285  -2.282  -2.077
  545    HG   SER  68           HG       SER  68  11.251  -5.123  -2.201
  546    H    ARG  69           HN       ARG  69   8.460  -3.221  -4.232
  547    HA   ARG  69           HA       ARG  69   7.961  -0.472  -4.575
  548    HB2  ARG  69           2HB      ARG  69   7.139  -2.940  -6.072
  549    HB3  ARG  69           1HB      ARG  69   6.657  -1.340  -6.582
  550    HG2  ARG  69           2HG      ARG  69   9.512  -2.033  -6.134
  551    HG3  ARG  69           1HG      ARG  69   8.710  -2.341  -7.665
  552    HD2  ARG  69           2HD      ARG  69   8.133   0.035  -7.833
  553    HD3  ARG  69           1HD      ARG  69   8.957   0.336  -6.303
  554    HE   ARG  69           HE       ARG  69  10.954   0.331  -7.422
  555   HH11  ARG  69          1HH1      ARG  69   8.559  -1.226  -9.455
  556   HH12  ARG  69          2HH1      ARG  69   9.602  -1.307 -10.842
  557   HH21  ARG  69          1HH2      ARG  69  12.307   0.244  -9.237
  558   HH22  ARG  69          2HH2      ARG  69  11.734  -0.473 -10.712
  559    H    LEU  70           HN       LEU  70   5.870  -3.191  -3.705
  560    HA   LEU  70           HA       LEU  70   3.429  -1.757  -3.864
  561    HB2  LEU  70           2HB      LEU  70   3.561  -4.215  -3.931
  562    HB3  LEU  70           1HB      LEU  70   4.099  -4.230  -2.262
  563    HG   LEU  70           HG       LEU  70   1.923  -3.258  -1.581
  564   HD11  LEU  70          1HD1      LEU  70   0.080  -3.212  -3.183
  565   HD12  LEU  70          2HD1      LEU  70   1.190  -3.665  -4.478
  566   HD13  LEU  70          3HD1      LEU  70   1.373  -2.111  -3.664
  567   HD21  LEU  70          3HD2      LEU  70   1.681  -5.787  -3.203
  568   HD22  LEU  70          1HD2      LEU  70   0.632  -5.282  -1.878
  569   HD23  LEU  70          2HD2      LEU  70   2.319  -5.686  -1.562
  570    H    ARG  71           HN       ARG  71   5.740  -2.341  -1.270
  571    HA   ARG  71           HA       ARG  71   4.225  -1.388   0.885
  572    HB2  ARG  71           2HB      ARG  71   6.552  -2.566   0.818
  573    HB3  ARG  71           1HB      ARG  71   7.192  -0.938   0.675
  574    HG2  ARG  71           2HG      ARG  71   5.381  -1.782   2.920
  575    HG3  ARG  71           1HG      ARG  71   7.136  -1.925   2.993
  576    HD2  ARG  71           2HD      ARG  71   5.616   0.639   2.531
  577    HD3  ARG  71           1HD      ARG  71   6.280   0.122   4.079
  578    HE   ARG  71           HE       ARG  71   8.171   0.312   1.887
  579   HH11  ARG  71          1HH1      ARG  71   6.723   1.861   4.670
  580   HH12  ARG  71          2HH1      ARG  71   8.028   2.985   4.881
  581   HH21  ARG  71          1HH2      ARG  71   9.884   1.813   2.151
  582   HH22  ARG  71          2HH2      ARG  71   9.811   2.966   3.440
  583    H    GLY  72           HN       GLY  72   6.297   0.280  -1.437
  584    HA2  GLY  72           2HA      GLY  72   6.134   2.854  -0.295
  585    HA3  GLY  72           1HA      GLY  72   6.504   2.505  -1.978
  586    H    ARG  73           HN       ARG  73   4.085   1.193  -2.645
  587    HA   ARG  73           HA       ARG  73   2.436   3.404  -3.254
  588    HB2  ARG  73           2HB      ARG  73   2.009   0.429  -3.453
  589    HB3  ARG  73           1HB      ARG  73   0.751   1.576  -3.896
  590    HG2  ARG  73           2HG      ARG  73   2.296   2.580  -5.541
  591    HG3  ARG  73           1HG      ARG  73   3.488   1.341  -5.135
  592    HD2  ARG  73           2HD      ARG  73   2.030  -0.396  -5.913
  593    HD3  ARG  73           1HD      ARG  73   0.707   0.746  -6.137
  594    HE   ARG  73           HE       ARG  73   2.575   1.746  -7.776
  595   HH11  ARG  73          1HH1      ARG  73   1.359  -1.501  -7.357
  596   HH12  ARG  73          2HH1      ARG  73   1.607  -1.959  -9.012
  597   HH21  ARG  73          1HH2      ARG  73   2.905   1.148  -9.983
  598   HH22  ARG  73          2HH2      ARG  73   2.513  -0.468 -10.497
  599    H    ILE  74           HN       ILE  74   2.160   0.823  -0.842
  600    HA   ILE  74           HA       ILE  74  -0.357   1.528   0.180
  601    HB   ILE  74           HB       ILE  74   1.949   0.268   1.679
  602   HG12  ILE  74          2HG1      ILE  74  -0.342  -1.054   0.209
  603   HG13  ILE  74          1HG1      ILE  74   1.302  -0.931  -0.408
  604   HG21  ILE  74          1HG2      ILE  74   0.212  -0.661   3.138
  605   HG22  ILE  74          2HG2      ILE  74  -1.015   0.232   2.242
  606   HG23  ILE  74          3HG2      ILE  74   0.206   1.105   3.166
  607   HD11  ILE  74          3HD1      ILE  74   2.100  -2.266   1.479
  608   HD12  ILE  74          1HD1      ILE  74   0.891  -3.122   0.524
  609   HD13  ILE  74          2HD1      ILE  74   0.444  -2.403   2.072
  610    H    GLU  75           HN       GLU  75   2.899   2.610   1.043
  611    HA   GLU  75           HA       GLU  75   2.271   4.183   3.276
  612    HB2  GLU  75           2HB      GLU  75   4.540   3.602   1.759
  613    HB3  GLU  75           1HB      GLU  75   4.358   5.343   1.617
  614    HG2  GLU  75           2HG      GLU  75   4.549   3.783   4.182
  615    HG3  GLU  75           1HG      GLU  75   5.829   4.747   3.450
  616    H    SER  76           HN       SER  76   2.472   5.048  -0.164
  617    HA   SER  76           HA       SER  76   1.901   7.773   0.126
  618    HB2  SER  76           2HB      SER  76   1.416   5.954  -2.223
  619    HB3  SER  76           1HB      SER  76   1.416   7.713  -2.290
  620    HG   SER  76           HG       SER  76   3.487   7.581  -2.522
  621    H    VAL  77           HN       VAL  77  -0.230   4.998  -0.372
  622    HA   VAL  77           HA       VAL  77  -2.585   6.540  -0.790
  623    HB   VAL  77           HB       VAL  77  -2.298   3.661   0.086
  624   HG11  VAL  77          1HG1      VAL  77  -4.623   3.386  -0.620
  625   HG12  VAL  77          2HG1      VAL  77  -4.729   5.112  -0.972
  626   HG13  VAL  77          3HG1      VAL  77  -4.496   4.561   0.688
  627   HG21  VAL  77          3HG2      VAL  77  -2.845   4.848  -2.632
  628   HG22  VAL  77          1HG2      VAL  77  -2.764   3.132  -2.243
  629   HG23  VAL  77          2HG2      VAL  77  -1.321   4.136  -2.105
  630    H    LEU  78           HN       LEU  78  -1.267   4.854   2.054
  631    HA   LEU  78           HA       LEU  78  -3.438   5.503   3.761
  632    HB2  LEU  78           2HB      LEU  78  -0.602   4.688   4.370
  633    HB3  LEU  78           1HB      LEU  78  -1.841   4.885   5.595
  634    HG   LEU  78           HG       LEU  78  -1.918   2.900   3.324
  635   HD11  LEU  78          1HD1      LEU  78  -1.554   2.463   6.277
  636   HD12  LEU  78          2HD1      LEU  78  -0.270   2.378   5.074
  637   HD13  LEU  78          3HD1      LEU  78  -1.600   1.219   5.027
  638   HD21  LEU  78          3HD2      LEU  78  -3.897   2.010   4.455
  639   HD22  LEU  78          1HD2      LEU  78  -4.150   3.673   3.926
  640   HD23  LEU  78          2HD2      LEU  78  -3.821   3.327   5.625
  641    H    ASP  79           HN       ASP  79  -0.399   7.117   3.017
  642    HA   ASP  79           HA       ASP  79  -0.492   9.105   5.009
  643    HB2  ASP  79           2HB      ASP  79   1.423   8.552   3.380
  644    HB3  ASP  79           1HB      ASP  79   0.561   9.542   2.210
  645    H    TRP  80           HN       TRP  80  -1.731   9.012   1.704
  646    HA   TRP  80           HA       TRP  80  -2.950  11.538   1.635
  647    HB2  TRP  80           2HB      TRP  80  -2.533  10.179  -0.363
  648    HB3  TRP  80           1HB      TRP  80  -3.684   8.973   0.195
  649    HD1  TRP  80           1HD      TRP  80  -3.534  12.500  -1.309
  650    HE1  TRP  80           1HE      TRP  80  -5.840  13.059  -2.315
  651    HE3  TRP  80           3HE      TRP  80  -6.144   8.440   0.373
  652    HZ2  TRP  80           2HZ      TRP  80  -8.425  11.914  -2.377
  653    HZ3  TRP  80           3HZ      TRP  80  -8.527   8.251  -0.198
  654    HH2  TRP  80           2HH      TRP  80  -9.642   9.951  -1.544
  655    H    ALA  81           HN       ALA  81  -4.198   8.351   2.563
  656    HA   ALA  81           HA       ALA  81  -6.862   9.070   3.029
  657    HB1  ALA  81           1HB      ALA  81  -7.000   7.036   4.368
  658    HB2  ALA  81           2HB      ALA  81  -5.240   6.934   4.401
  659    HB3  ALA  81           3HB      ALA  81  -6.104   6.757   2.875
  660    H    THR  82           HN       THR  82  -4.035   9.237   5.123
  661    HA   THR  82           HA       THR  82  -5.404   9.932   7.496
  662    HB   THR  82           HB       THR  82  -2.561  10.577   6.693
  663    HG1  THR  82           1HG      THR  82  -2.598   8.411   6.752
  664   HG21  THR  82          3HG2      THR  82  -3.867  10.482   9.414
  665   HG22  THR  82          1HG2      THR  82  -3.303  11.931   8.585
  666   HG23  THR  82          2HG2      THR  82  -2.143  10.713   9.116
  667    H    VAL  83           HN       VAL  83  -3.933  11.882   4.919
  668    HA   VAL  83           HA       VAL  83  -4.442  14.411   6.085
  669    HB   VAL  83           HB       VAL  83  -4.177  13.708   3.156
  670   HG11  VAL  83          1HG1      VAL  83  -3.531  16.051   2.853
  671   HG12  VAL  83          2HG1      VAL  83  -3.857  16.359   4.560
  672   HG13  VAL  83          3HG1      VAL  83  -5.173  15.902   3.479
  673   HG21  VAL  83          3HG2      VAL  83  -2.083  14.558   5.157
  674   HG22  VAL  83          1HG2      VAL  83  -1.821  14.372   3.422
  675   HG23  VAL  83          2HG2      VAL  83  -2.236  12.970   4.408
  676    H    ARG  84           HN       ARG  84  -6.254  12.400   3.816
  677    HA   ARG  84           HA       ARG  84  -8.366  14.244   3.384
  678    HB2  ARG  84           2HB      ARG  84  -8.080  11.279   2.958
  679    HB3  ARG  84           1HB      ARG  84  -9.563  12.136   2.571
  680    HG2  ARG  84           2HG      ARG  84  -6.866  12.823   1.429
  681    HG3  ARG  84           1HG      ARG  84  -8.052  11.782   0.637
  682    HD2  ARG  84           2HD      ARG  84  -8.410  14.682   1.382
  683    HD3  ARG  84           1HD      ARG  84  -8.203  14.028  -0.243
  684    HE   ARG  84           HE       ARG  84 -10.524  13.313   1.434
  685   HH11  ARG  84          1HH1      ARG  84  -9.207  14.542  -1.571
  686   HH12  ARG  84          2HH1      ARG  84 -10.739  14.513  -2.392
  687   HH21  ARG  84          1HH2      ARG  84 -12.523  13.323   0.379
  688   HH22  ARG  84          2HH2      ARG  84 -12.632  13.856  -1.273
  689    H    GLY  85           HN       GLY  85  -7.716  11.927   5.873
  690    HA2  GLY  85           2HA      GLY  85  -8.762  11.961   7.982
  691    HA3  GLY  85           1HA      GLY  85 -10.113  12.834   7.271
  692    H    TYR  86           HN       TYR  86  -8.520   9.712   6.599
  693    HA   TYR  86           HA       TYR  86 -11.156   8.435   6.943
  694    HB2  TYR  86           2HB      TYR  86  -8.986   7.811   4.940
  695    HB3  TYR  86           1HB      TYR  86 -10.296   6.695   5.303
  696    HD1  TYR  86           2HD      TYR  86 -12.711   7.715   5.098
  697    HD2  TYR  86           1HD      TYR  86  -9.259   9.317   3.200
  698    HE1  TYR  86           2HE      TYR  86 -14.144   8.842   3.452
  699    HE2  TYR  86           1HE      TYR  86 -10.686  10.450   1.550
  700    HH   TYR  86           HH       TYR  86 -14.028  10.797   1.952
  701    H    ARG  87           HN       ARG  87  -8.475   8.826   8.597
  702    HA   ARG  87           HA       ARG  87  -8.671   6.386  10.012
  703    HB2  ARG  87           2HB      ARG  87  -6.387   5.505   9.595
  704    HB3  ARG  87           1HB      ARG  87  -7.461   5.373   8.211
  705    HG2  ARG  87           2HG      ARG  87  -6.369   7.177   7.101
  706    HG3  ARG  87           1HG      ARG  87  -5.439   7.573   8.549
  707    HD2  ARG  87           2HD      ARG  87  -5.240   4.923   7.130
  708    HD3  ARG  87           1HD      ARG  87  -4.191   6.295   6.767
  709    HE   ARG  87           HE       ARG  87  -3.250   6.116   8.940
  710   HH11  ARG  87          1HH1      ARG  87  -5.440   3.490   8.147
  711   HH12  ARG  87          2HH1      ARG  87  -4.837   2.447   9.392
  712   HH21  ARG  87          1HH2      ARG  87  -2.435   4.733  10.561
  713   HH22  ARG  87          2HH2      ARG  87  -3.126   3.149  10.766
  714    H    GLU  88           HN       GLU  88  -6.761   9.195   9.258
  715    HA   GLU  88           HA       GLU  88  -5.488  10.622  10.452
  716    HB2  GLU  88           2HB      GLU  88  -7.309   9.664  12.655
  717    HB3  GLU  88           1HB      GLU  88  -6.153  10.972  12.859
  718    HG2  GLU  88           2HG      GLU  88  -8.248  11.975  12.429
  719    HG3  GLU  88           1HG      GLU  88  -7.297  12.149  10.957
  720    H    GLY  89           HN       GLY  89  -4.136  10.835  12.605
  721    HA2  GLY  89           2HA      GLY  89  -2.511   9.958  14.018
  722    HA3  GLY  89           1HA      GLY  89  -2.993   8.340  13.527
  723    H    ASP  90           HN       ASP  90  -1.300   7.328  12.702
  724    HA   ASP  90           HA       ASP  90   0.106   8.607  10.476
  725    HB2  ASP  90           2HB      ASP  90   1.448   8.669  12.695
  726    HB3  ASP  90           1HB      ASP  90   1.630   6.932  12.471
  727    H    ASN  91           HN       ASN  91   1.705   6.524   9.673
  728    HA   ASN  91           HA       ASN  91  -0.405   4.670   8.883
  729    HB2  ASN  91           2HB      ASN  91   2.213   5.422   7.592
  730    HB3  ASN  91           1HB      ASN  91   1.123   4.199   6.979
  731   HD21  ASN  91          1HD2      ASN  91   1.980   6.528   5.618
  732   HD22  ASN  91          2HD2      ASN  91   0.572   7.501   5.324
  733    HA   PRO  92           HA       PRO  92   1.785   1.325  10.854
  734    HB2  PRO  92           2HB      PRO  92   0.448  -0.728   9.734
  735    HB3  PRO  92           1HB      PRO  92  -0.283   0.308  10.965
  736    HG2  PRO  92           2HG      PRO  92  -0.644   0.337   7.999
  737    HG3  PRO  92           1HG      PRO  92  -1.848   0.568   9.280
  738    HD2  PRO  92           2HD      PRO  92  -0.687   2.619   7.864
  739    HD3  PRO  92           1HD      PRO  92  -1.369   2.792   9.492
  740    H    ALA  93           HN       ALA  93   1.692   1.988   7.516
  741    HA   ALA  93           HA       ALA  93   3.613  -0.118   6.846
  742    HB1  ALA  93           1HB      ALA  93   2.189   1.824   5.024
  743    HB2  ALA  93           2HB      ALA  93   1.664   0.177   5.365
  744    HB3  ALA  93           3HB      ALA  93   3.189   0.460   4.523
  745    H    ARG  94           HN       ARG  94   3.825   2.732   8.228
  746    HA   ARG  94           HA       ARG  94   5.600   4.215   6.599
  747    HB2  ARG  94           2HB      ARG  94   4.257   5.042   8.619
  748    HB3  ARG  94           1HB      ARG  94   5.511   4.314   9.613
  749    HG2  ARG  94           2HG      ARG  94   6.188   6.510   9.480
  750    HG3  ARG  94           1HG      ARG  94   7.136   5.744   8.204
  751    HD2  ARG  94           2HD      ARG  94   6.315   7.681   7.199
  752    HD3  ARG  94           1HD      ARG  94   5.203   6.425   6.650
  753    HE   ARG  94           HE       ARG  94   4.270   7.657   9.046
  754   HH11  ARG  94          1HH1      ARG  94   4.367   8.001   5.555
  755   HH12  ARG  94          2HH1      ARG  94   3.132   9.232   5.520
  756   HH21  ARG  94          1HH2      ARG  94   2.649   9.266   9.001
  757   HH22  ARG  94          2HH2      ARG  94   2.143   9.927   7.470
  758    H    TRP  95           HN       TRP  95   6.157   2.164   9.452
  759    HA   TRP  95           HA       TRP  95   7.902   0.911  10.160
  760    HB2  TRP  95           2HB      TRP  95   8.282   0.948   7.245
  761    HB3  TRP  95           1HB      TRP  95   9.731   0.577   8.180
  762    HD1  TRP  95           1HD      TRP  95   9.322  -1.430  10.098
  763    HE1  TRP  95           1HE      TRP  95   8.069  -3.664   9.806
  764    HE3  TRP  95           3HE      TRP  95   6.467  -0.211   6.043
  765    HZ2  TRP  95           2HZ      TRP  95   6.115  -4.743   8.089
  766    HZ3  TRP  95           3HZ      TRP  95   4.923  -1.903   5.142
  767    HH2  TRP  95           2HH      TRP  95   4.753  -4.122   6.149
  768    H    ARG  96           HN       ARG  96   9.319   1.586  11.553
  769    HA   ARG  96           HA       ARG  96  10.688   4.111  11.120
  770    HB2  ARG  96           2HB      ARG  96  11.255   3.950  13.493
  771    HB3  ARG  96           1HB      ARG  96   9.533   3.729  13.245
  772    HG2  ARG  96           2HG      ARG  96   9.892   1.275  13.416
  773    HG3  ARG  96           1HG      ARG  96  11.579   1.598  13.826
  774    HD2  ARG  96           2HD      ARG  96  10.816   2.945  15.749
  775    HD3  ARG  96           1HD      ARG  96   9.149   2.522  15.357
  776    HE   ARG  96           HE       ARG  96  11.046   0.355  15.881
  777   HH11  ARG  96          1HH1      ARG  96   8.286   2.253  16.891
  778   HH12  ARG  96          2HH1      ARG  96   7.874   1.192  18.207
  779   HH21  ARG  96          1HH2      ARG  96  10.498  -1.065  17.603
  780   HH22  ARG  96          2HH2      ARG  96   9.105  -0.711  18.591
  781    H    GLY  97           HN       GLY  97  11.344   1.195  10.089
  782    HA2  GLY  97           2HA      GLY  97  13.866   1.397   9.300
  783    HA3  GLY  97           1HA      GLY  97  14.104   0.975  10.989
  784    H    TYR  98           HN       TYR  98  12.825  -0.126   7.914
  785    HA   TYR  98           HA       TYR  98  12.426  -2.807   8.972
  786    HB2  TYR  98           2HB      TYR  98  11.550  -3.303   6.689
  787    HB3  TYR  98           1HB      TYR  98  10.673  -2.037   7.528
  788    HD1  TYR  98           2HD      TYR  98  11.017   0.343   6.840
  789    HD2  TYR  98           1HD      TYR  98  12.625  -2.903   4.617
  790    HE1  TYR  98           2HE      TYR  98  11.299   1.821   4.900
  791    HE2  TYR  98           1HE      TYR  98  12.907  -1.434   2.665
  792    HH   TYR  98           HH       TYR  98  12.760   1.903   2.826
  793    H    LEU  99           HN       LEU  99  13.354  -4.669   7.812
  794    HA   LEU  99           HA       LEU  99  15.161  -5.892   7.318
  795    HB2  LEU  99           2HB      LEU  99  15.884  -3.528   5.602
  796    HB3  LEU  99           1HB      LEU  99  16.517  -5.146   5.492
  797    HG   LEU  99           HG       LEU  99  13.648  -4.405   4.983
  798   HD11  LEU  99          1HD1      LEU  99  14.158  -4.818   2.634
  799   HD12  LEU  99          2HD1      LEU  99  15.849  -5.098   3.042
  800   HD13  LEU  99          3HD1      LEU  99  15.139  -3.501   3.276
  801   HD21  LEU  99          3HD2      LEU  99  13.891  -6.682   5.803
  802   HD22  LEU  99          1HD2      LEU  99  15.129  -7.004   4.587
  803   HD23  LEU  99          2HD2      LEU  99  13.467  -6.681   4.090
  804    H    GLU 100           HN       GLU 100  15.270  -3.732   9.422
  805    HA   GLU 100           HA       GLU 100  17.876  -2.670   9.566
  806    HB2  GLU 100           2HB      GLU 100  15.928  -1.740  10.766
  807    HB3  GLU 100           1HB      GLU 100  15.879  -3.169  11.785
  808    HG2  GLU 100           2HG      GLU 100  16.919  -1.156  12.822
  809    HG3  GLU 100           1HG      GLU 100  17.927  -2.603  12.829
  810    H    HIS 101           HN       HIS 101  19.533  -3.187  11.094
  811    HA   HIS 101           HA       HIS 101  20.980  -4.513  12.216
  812    HB2  HIS 101           2HB      HIS 101  19.041  -5.274  13.546
  813    HB3  HIS 101           1HB      HIS 101  18.736  -6.540  12.364
  814    HD1  HIS 101           1HD      HIS 101  19.448  -8.700  13.298
  815    HD2  HIS 101           2HD      HIS 101  22.029  -5.628  14.383
  816    HE1  HIS 101           1HE      HIS 101  21.239  -9.782  14.690
  817    HE2  HIS 101           2HE      HIS 101  22.653  -7.865  15.526
  818    H    HIS 102           HN       HIS 102  19.076  -6.200   9.760
  819    HA   HIS 102           HA       HIS 102  21.320  -7.922   9.113
  820    HB2  HIS 102           2HB      HIS 102  18.968  -8.770   9.114
  821    HB3  HIS 102           1HB      HIS 102  18.628  -7.719   7.745
  822    HD1  HIS 102           1HD      HIS 102  18.875  -8.784   5.528
  823    HD2  HIS 102           2HD      HIS 102  21.141 -10.705   8.443
  824    HE1  HIS 102           1HE      HIS 102  19.917 -10.772   4.382
  825    HE2  HIS 102           2HE      HIS 102  21.400 -11.834   6.127
  826    H    HIS 103           HN       HIS 103  19.477  -5.294   7.560
  827    HA   HIS 103           HA       HIS 103  21.802  -4.749   5.887
  828    HB2  HIS 103           2HB      HIS 103  20.450  -6.325   4.555
  829    HB3  HIS 103           1HB      HIS 103  19.066  -5.247   4.686
  830    HD1  HIS 103           1HD      HIS 103  22.498  -5.429   3.086
  831    HD2  HIS 103           2HD      HIS 103  18.972  -3.236   2.816
  832    HE1  HIS 103           1HE      HIS 103  22.738  -3.999   1.026
  833    HE2  HIS 103           2HE      HIS 103  20.539  -2.786   0.811
  834    H    HIS 104           HN       HIS 104  18.384  -3.738   5.857
  835    HA   HIS 104           HA       HIS 104  17.407  -1.703   5.704
  836    HB2  HIS 104           2HB      HIS 104  18.320  -1.568   8.053
  837    HB3  HIS 104           1HB      HIS 104  19.701  -0.695   7.405
  838    HD1  HIS 104           1HD      HIS 104  17.732   0.503   9.514
  839    HD2  HIS 104           2HD      HIS 104  17.558   1.186   5.409
  840    HE1  HIS 104           1HE      HIS 104  16.511   2.684   9.233
  841    HE2  HIS 104           2HE      HIS 104  16.615   3.172   6.770
  842    H    HIS 105           HN       HIS 105  20.477  -0.085   6.031
  843    HA   HIS 105           HA       HIS 105  21.470   0.117   3.506
  844    HB2  HIS 105           2HB      HIS 105  19.273   0.942   2.744
  845    HB3  HIS 105           1HB      HIS 105  19.342   2.241   3.927
  846    HD1  HIS 105           1HD      HIS 105  19.674   4.337   2.683
  847    HD2  HIS 105           2HD      HIS 105  22.008   1.253   1.145
  848    HE1  HIS 105           1HE      HIS 105  21.048   5.372   0.850
  849    HE2  HIS 105           2HE      HIS 105  22.335   3.463  -0.164
  850    H    HIS 106           HN       HIS 106  20.446   3.112   5.005
  851    HA   HIS 106           HA       HIS 106  22.329   3.434   7.008
  852    HB2  HIS 106           2HB      HIS 106  23.942   3.233   5.031
  853    HB3  HIS 106           1HB      HIS 106  23.288   4.764   4.461
  854    HD1  HIS 106           1HD      HIS 106  24.312   6.844   5.394
  855    HD2  HIS 106           2HD      HIS 106  25.276   3.461   7.614
  856    HE1  HIS 106           1HE      HIS 106  26.033   7.597   7.068
  857    HE2  HIS 106           2HE      HIS 106  26.436   5.585   8.532
  Start of MODEL    2
    1    H1   MET   1           H1       MET   1 -16.149   3.455   5.344
    2    H2   MET   1           H2       MET   1 -14.832   2.954   6.283
    3    H3   MET   1           H3       MET   1 -15.797   1.802   5.497
    4    HA   MET   1           HA       MET   1 -15.109   2.714   3.352
    5    HB2  MET   1           2HB      MET   1 -14.502   4.953   3.954
    6    HB3  MET   1           1HB      MET   1 -13.346   4.385   5.148
    7    HG2  MET   1           2HG      MET   1 -11.914   3.520   3.396
    8    HG3  MET   1           1HG      MET   1 -13.080   4.004   2.169
    9    HE1  MET   1           2HE      MET   1 -12.971   7.934   2.544
   10    HE2  MET   1           3HE      MET   1 -14.048   6.822   3.388
   11    HE3  MET   1           1HE      MET   1 -13.702   6.584   1.675
   12    H    THR   2           HN       THR   2 -14.283   0.916   2.627
   13    HA   THR   2           HA       THR   2 -12.360  -0.608   4.164
   14    HB   THR   2           HB       THR   2 -12.484  -2.206   2.251
   15    HG1  THR   2           1HG      THR   2 -14.596  -0.608   1.229
   16   HG21  THR   2          3HG2      THR   2 -15.149  -1.322   3.371
   17   HG22  THR   2          1HG2      THR   2 -14.018  -2.441   4.135
   18   HG23  THR   2          2HG2      THR   2 -14.815  -2.886   2.627
   19    H    PHE   3           HN       PHE   3 -10.425  -1.526   2.880
   20    HA   PHE   3           HA       PHE   3  -8.796   0.652   2.059
   21    HB2  PHE   3           2HB      PHE   3  -7.923  -1.439   3.103
   22    HB3  PHE   3           1HB      PHE   3  -8.314  -2.303   1.621
   23    HD1  PHE   3           2HD      PHE   3  -6.191   0.352   3.058
   24    HD2  PHE   3           1HD      PHE   3  -6.872  -2.249  -0.239
   25    HE1  PHE   3           2HE      PHE   3  -3.987   0.942   2.142
   26    HE2  PHE   3           1HE      PHE   3  -4.665  -1.667  -1.157
   27    HZ   PHE   3           HZ       PHE   3  -3.219  -0.066   0.036
   28    H    SER   4           HN       SER   4 -10.692  -1.772   0.380
   29    HA   SER   4           HA       SER   4  -9.847  -1.301  -2.243
   30    HB2  SER   4           2HB      SER   4 -11.300  -3.187  -1.611
   31    HB3  SER   4           1HB      SER   4 -12.608  -2.065  -1.242
   32    HG   SER   4           HG       SER   4 -12.982  -2.800  -3.285
   33    H    GLU   5           HN       GLU   5 -12.448   0.209  -0.362
   34    HA   GLU   5           HA       GLU   5 -13.303   2.038  -2.314
   35    HB2  GLU   5           2HB      GLU   5 -13.423   2.089   0.700
   36    HB3  GLU   5           1HB      GLU   5 -14.207   3.287  -0.308
   37    HG2  GLU   5           2HG      GLU   5 -15.646   1.649  -1.263
   38    HG3  GLU   5           1HG      GLU   5 -14.758   0.344  -0.477
   39    H    CYS   6           HN       CYS   6 -11.027   2.375   0.368
   40    HA   CYS   6           HA       CYS   6 -10.523   5.129   0.033
   41    HB2  CYS   6           2HB      CYS   6 -10.061   3.851   2.094
   42    HB3  CYS   6           1HB      CYS   6  -8.761   3.021   1.280
   43    HG   CYS   6           HG       CYS   6  -7.990   6.047   0.784
   44    H    ALA   7           HN       ALA   7  -8.653   2.281  -0.933
   45    HA   ALA   7           HA       ALA   7  -6.566   3.611  -2.228
   46    HB1  ALA   7           1HB      ALA   7  -7.733   0.928  -2.958
   47    HB2  ALA   7           2HB      ALA   7  -6.522   1.216  -1.710
   48    HB3  ALA   7           3HB      ALA   7  -6.136   1.526  -3.403
   49    H    ALA   8           HN       ALA   8  -9.691   2.498  -3.516
   50    HA   ALA   8           HA       ALA   8  -9.245   3.268  -6.181
   51    HB1  ALA   8           1HB      ALA   8 -11.082   1.803  -5.517
   52    HB2  ALA   8           2HB      ALA   8 -11.672   3.191  -6.431
   53    HB3  ALA   8           3HB      ALA   8 -11.855   3.147  -4.678
   54    H    LEU   9           HN       LEU   9 -10.546   5.045  -3.411
   55    HA   LEU   9           HA       LEU   9 -11.214   7.406  -4.791
   56    HB2  LEU   9           2HB      LEU   9 -10.435   6.938  -1.915
   57    HB3  LEU   9           1HB      LEU   9 -10.970   8.491  -2.525
   58    HG   LEU   9           HG       LEU   9 -12.610   5.957  -2.524
   59   HD11  LEU   9          1HD1      LEU   9 -13.950   7.102  -0.822
   60   HD12  LEU   9          2HD1      LEU   9 -12.803   8.441  -0.825
   61   HD13  LEU   9          3HD1      LEU   9 -12.290   6.844  -0.281
   62   HD21  LEU   9          3HD2      LEU   9 -13.335   8.777  -3.310
   63   HD22  LEU   9          1HD2      LEU   9 -14.450   7.411  -3.217
   64   HD23  LEU   9          2HD2      LEU   9 -13.148   7.409  -4.406
   65    H    TYR  10           HN       TYR  10  -8.227   6.386  -3.167
   66    HA   TYR  10           HA       TYR  10  -6.786   8.763  -3.537
   67    HB2  TYR  10           2HB      TYR  10  -5.955   7.012  -2.064
   68    HB3  TYR  10           1HB      TYR  10  -5.770   5.915  -3.426
   69    HD1  TYR  10           1HD      TYR  10  -4.617   9.265  -2.254
   70    HD2  TYR  10           2HD      TYR  10  -3.698   5.752  -4.467
   71    HE1  TYR  10           1HE      TYR  10  -2.342  10.110  -2.636
   72    HE2  TYR  10           2HE      TYR  10  -1.416   6.585  -4.845
   73    HH   TYR  10           HH       TYR  10  -0.103   9.214  -3.152
   74    H    ILE  11           HN       ILE  11  -7.018   5.866  -5.543
   75    HA   ILE  11           HA       ILE  11  -5.250   6.624  -7.562
   76    HB   ILE  11           HB       ILE  11  -7.715   4.883  -7.759
   77   HG12  ILE  11          2HG1      ILE  11  -4.791   4.158  -7.472
   78   HG13  ILE  11          1HG1      ILE  11  -5.956   4.148  -6.154
   79   HG21  ILE  11          1HG2      ILE  11  -5.400   5.153  -9.679
   80   HG22  ILE  11          2HG2      ILE  11  -7.056   5.691  -9.966
   81   HG23  ILE  11          3HG2      ILE  11  -6.704   3.971  -9.798
   82   HD11  ILE  11          3HD1      ILE  11  -6.036   2.416  -8.611
   83   HD12  ILE  11          1HD1      ILE  11  -7.240   2.421  -7.322
   84   HD13  ILE  11          2HD1      ILE  11  -5.585   1.912  -6.983
   85    H    LYS  12           HN       LYS  12  -8.748   7.197  -7.272
   86    HA   LYS  12           HA       LYS  12  -8.974   8.556  -9.778
   87    HB2  LYS  12           2HB      LYS  12 -10.770   8.686  -7.339
   88    HB3  LYS  12           1HB      LYS  12 -11.187   9.262  -8.945
   89    HG2  LYS  12           2HG      LYS  12 -11.295   7.085  -9.817
   90    HG3  LYS  12           1HG      LYS  12 -10.479   6.396  -8.406
   91    HD2  LYS  12           2HD      LYS  12 -12.401   7.037  -7.008
   92    HD3  LYS  12           1HD      LYS  12 -13.217   7.674  -8.436
   93    HE2  LYS  12           2HE      LYS  12 -13.328   5.489  -9.418
   94    HE3  LYS  12           1HE      LYS  12 -12.324   4.814  -8.133
   95    HZ1  LYS  12           3HZ      LYS  12 -14.965   6.066  -7.631
   96    HZ2  LYS  12           1HZ      LYS  12 -14.046   5.121  -6.564
   97    HZ3  LYS  12           2HZ      LYS  12 -14.771   4.405  -7.920
   98    H    ALA  13           HN       ALA  13  -8.399   9.596  -6.458
   99    HA   ALA  13           HA       ALA  13  -8.810  12.367  -7.000
  100    HB1  ALA  13           1HB      ALA  13  -7.940  12.748  -4.757
  101    HB2  ALA  13           2HB      ALA  13  -7.398  11.070  -4.673
  102    HB3  ALA  13           3HB      ALA  13  -9.120  11.437  -4.764
  103    H    HIS  14           HN       HIS  14  -5.966  10.276  -6.856
  104    HA   HIS  14           HA       HIS  14  -4.274  12.634  -7.345
  105    HB2  HIS  14           2HB      HIS  14  -3.919  10.886  -5.408
  106    HB3  HIS  14           1HB      HIS  14  -3.170   9.927  -6.680
  107    HD1  HIS  14           1HD      HIS  14  -0.890  10.178  -5.357
  108    HD2  HIS  14           2HD      HIS  14  -2.498  13.727  -6.811
  109    HE1  HIS  14           1HE      HIS  14   0.961  11.872  -5.212
  110    HE2  HIS  14           2HE      HIS  14  -0.105  14.056  -5.896
  111    H    ARG  15           HN       ARG  15  -5.913  10.789  -9.262
  112    HA   ARG  15           HA       ARG  15  -4.037   9.428 -10.883
  113    HB2  ARG  15           2HB      ARG  15  -5.830   9.165 -12.487
  114    HB3  ARG  15           1HB      ARG  15  -6.454   8.907 -10.871
  115    HG2  ARG  15           2HG      ARG  15  -7.494  11.053 -10.855
  116    HG3  ARG  15           1HG      ARG  15  -6.722  11.491 -12.376
  117    HD2  ARG  15           2HD      ARG  15  -8.679   9.229 -12.028
  118    HD3  ARG  15           1HD      ARG  15  -9.095  10.832 -12.632
  119    HE   ARG  15           HE       ARG  15  -7.067   9.971 -14.266
  120   HH11  ARG  15          1HH1      ARG  15 -10.213   8.777 -13.350
  121   HH12  ARG  15          2HH1      ARG  15 -10.510   7.962 -14.854
  122   HH21  ARG  15          1HH2      ARG  15  -7.426   8.911 -16.277
  123   HH22  ARG  15          2HH2      ARG  15  -8.907   8.024 -16.522
  124    H    SER  16           HN       SER  16  -5.122  12.745 -10.820
  125    HA   SER  16           HA       SER  16  -4.370  13.330 -13.523
  126    HB2  SER  16           2HB      SER  16  -6.124  14.556 -12.151
  127    HB3  SER  16           1HB      SER  16  -4.790  15.331 -11.300
  128    HG   SER  16           HG       SER  16  -4.458  15.458 -13.987
  129    H    SER  17           HN       SER  17  -2.715  13.021 -10.596
  130    HA   SER  17           HA       SER  17  -0.469  14.679 -11.334
  131    HB2  SER  17           2HB      SER  17  -1.205  14.212  -8.948
  132    HB3  SER  17           1HB      SER  17  -0.589  12.574  -9.162
  133    HG   SER  17           HG       SER  17   1.003  14.877  -9.615
  134    H    TRP  18           HN       TRP  18  -1.636  11.635 -12.132
  135    HA   TRP  18           HA       TRP  18   1.029  10.667 -12.934
  136    HB2  TRP  18           2HB      TRP  18  -1.519   9.045 -12.747
  137    HB3  TRP  18           1HB      TRP  18   0.111   8.439 -12.994
  138    HD1  TRP  18           1HD      TRP  18   1.359  10.244 -10.520
  139    HE1  TRP  18           1HE      TRP  18   0.928   9.375  -8.129
  140    HE3  TRP  18           3HE      TRP  18  -2.641   7.215 -11.465
  141    HZ2  TRP  18           2HZ      TRP  18  -0.873   7.623  -6.824
  142    HZ3  TRP  18           3HZ      TRP  18  -3.658   5.970  -9.608
  143    HH2  TRP  18           2HH      TRP  18  -2.791   6.174  -7.331
  144    H    LYS  19           HN       LYS  19  -0.419  12.667 -14.456
  145    HA   LYS  19           HA       LYS  19  -1.008  13.127 -16.529
  146    HB2  LYS  19           2HB      LYS  19  -0.100  10.338 -17.070
  147    HB3  LYS  19           1HB      LYS  19  -0.818  11.350 -18.323
  148    HG2  LYS  19           2HG      LYS  19   0.877  13.102 -17.764
  149    HG3  LYS  19           1HG      LYS  19   1.652  11.926 -16.707
  150    HD2  LYS  19           2HD      LYS  19   2.780  11.985 -18.833
  151    HD3  LYS  19           1HD      LYS  19   1.966  10.435 -18.634
  152    HE2  LYS  19           2HE      LYS  19   1.689  11.303 -20.895
  153    HE3  LYS  19           1HE      LYS  19   0.141  11.199 -20.056
  154    HZ1  LYS  19           3HZ      LYS  19   0.040  13.498 -19.802
  155    HZ2  LYS  19           1HZ      LYS  19   0.630  13.293 -21.376
  156    HZ3  LYS  19           2HZ      LYS  19   1.691  13.719 -20.123
  157    H    ASN  20           HN       ASN  20  -3.906  12.094 -17.725
  158    HA   ASN  20           HA       ASN  20  -3.742   9.425 -17.267
  159    HB2  ASN  20           2HB      ASN  20  -4.210  10.966 -19.772
  160    HB3  ASN  20           1HB      ASN  20  -4.292   9.207 -19.715
  161   HD21  ASN  20          1HD2      ASN  20  -6.353  11.223 -20.226
  162   HD22  ASN  20          2HD2      ASN  20  -7.604  10.927 -19.068
  163    H    THR  21           HN       THR  21  -1.851   8.614 -16.779
  164    HA   THR  21           HA       THR  21  -0.468   7.651 -19.211
  165    HB   THR  21           HB       THR  21   1.032   6.413 -17.572
  166    HG1  THR  21           1HG      THR  21  -0.025   8.290 -15.701
  167   HG21  THR  21          3HG2      THR  21   1.127   9.421 -17.492
  168   HG22  THR  21          1HG2      THR  21   1.830   8.388 -18.738
  169   HG23  THR  21          2HG2      THR  21   2.458   8.336 -17.090
  170    H    LYS  22           HN       LYS  22   0.110   5.119 -18.692
  171    HA   LYS  22           HA       LYS  22  -2.439   3.842 -18.062
  172    HB2  LYS  22           2HB      LYS  22   0.167   2.659 -19.040
  173    HB3  LYS  22           1HB      LYS  22  -1.317   1.762 -18.778
  174    HG2  LYS  22           2HG      LYS  22  -2.339   3.483 -20.437
  175    HG3  LYS  22           1HG      LYS  22  -0.659   3.747 -20.901
  176    HD2  LYS  22           2HD      LYS  22  -2.169   1.137 -20.979
  177    HD3  LYS  22           1HD      LYS  22  -1.665   2.103 -22.364
  178    HE2  LYS  22           2HE      LYS  22   0.688   1.730 -21.729
  179    HE3  LYS  22           1HE      LYS  22   0.150   0.708 -20.396
  180    HZ1  LYS  22           3HZ      LYS  22  -0.131   0.208 -23.305
  181    HZ2  LYS  22           1HZ      LYS  22  -1.011  -0.660 -22.144
  182    HZ3  LYS  22           2HZ      LYS  22   0.679  -0.741 -22.152
  183    H    HIS  23           HN       HIS  23  -0.214   5.094 -16.239
  184    HA   HIS  23           HA       HIS  23   0.702   3.061 -14.518
  185    HB2  HIS  23           2HB      HIS  23   0.235   6.006 -14.033
  186    HB3  HIS  23           1HB      HIS  23   0.916   4.937 -12.814
  187    HD1  HIS  23           1HD      HIS  23   2.510   7.350 -13.961
  188    HD2  HIS  23           2HD      HIS  23   2.805   3.432 -15.334
  189    HE1  HIS  23           1HE      HIS  23   4.756   7.190 -15.074
  190    HE2  HIS  23           2HE      HIS  23   4.878   4.843 -15.984
  191    H    ALA  24           HN       ALA  24  -2.323   4.806 -14.690
  192    HA   ALA  24           HA       ALA  24  -3.380   4.280 -12.162
  193    HB1  ALA  24           1HB      ALA  24  -4.430   5.798 -13.779
  194    HB2  ALA  24           2HB      ALA  24  -5.577   4.600 -13.179
  195    HB3  ALA  24           3HB      ALA  24  -4.874   4.418 -14.785
  196    H    ASP  25           HN       ASP  25  -3.380   2.303 -15.099
  197    HA   ASP  25           HA       ASP  25  -4.892   0.157 -13.993
  198    HB2  ASP  25           2HB      ASP  25  -4.698   0.455 -16.423
  199    HB3  ASP  25           1HB      ASP  25  -2.967   0.157 -16.333
  200    H    GLN  26           HN       GLN  26  -1.450   0.755 -14.465
  201    HA   GLN  26           HA       GLN  26  -0.451  -1.661 -13.521
  202    HB2  GLN  26           2HB      GLN  26   0.713   1.122 -13.472
  203    HB3  GLN  26           1HB      GLN  26   1.627  -0.325 -13.084
  204    HG2  GLN  26           2HG      GLN  26   1.422  -1.162 -15.286
  205    HG3  GLN  26           1HG      GLN  26   0.199   0.038 -15.694
  206   HE21  GLN  26          1HE2      GLN  26   1.382   0.722 -17.464
  207   HE22  GLN  26          2HE2      GLN  26   2.806   1.686 -17.307
  208    H    TRP  27           HN       TRP  27  -1.522   1.192 -11.767
  209    HA   TRP  27           HA       TRP  27  -0.665   0.209  -9.210
  210    HB2  TRP  27           2HB      TRP  27  -2.456   2.451 -10.107
  211    HB3  TRP  27           1HB      TRP  27  -2.368   2.003  -8.409
  212    HD1  TRP  27           1HD      TRP  27   0.294   2.757 -11.152
  213    HE1  TRP  27           1HE      TRP  27   2.076   4.297 -10.114
  214    HE3  TRP  27           3HE      TRP  27  -1.653   3.155  -6.447
  215    HZ2  TRP  27           2HZ      TRP  27   2.580   5.517  -7.617
  216    HZ3  TRP  27           3HZ      TRP  27  -0.466   4.535  -4.791
  217    HH2  TRP  27           2HH      TRP  27   1.609   5.692  -5.365
  218    H    THR  28           HN       THR  28  -3.821   0.434 -10.853
  219    HA   THR  28           HA       THR  28  -5.303  -0.671  -8.719
  220    HB   THR  28           HB       THR  28  -6.064  -0.639 -11.646
  221    HG1  THR  28           1HG      THR  28  -5.598   1.467 -11.060
  222   HG21  THR  28          3HG2      THR  28  -8.364  -0.564 -10.774
  223   HG22  THR  28          1HG2      THR  28  -7.739  -0.700  -9.131
  224   HG23  THR  28          2HG2      THR  28  -7.523  -2.029 -10.270
  225    H    ASN  29           HN       ASN  29  -4.030  -2.107 -11.702
  226    HA   ASN  29           HA       ASN  29  -5.289  -4.580 -11.601
  227    HB2  ASN  29           2HB      ASN  29  -3.970  -3.650 -13.517
  228    HB3  ASN  29           1HB      ASN  29  -2.498  -4.022 -12.630
  229   HD21  ASN  29          1HD2      ASN  29  -5.091  -5.250 -14.517
  230   HD22  ASN  29          2HD2      ASN  29  -4.489  -6.866 -14.669
  231    H    THR  30           HN       THR  30  -2.130  -3.672 -10.270
  232    HA   THR  30           HA       THR  30  -1.589  -6.305  -9.325
  233    HB   THR  30           HB       THR  30   0.278  -5.056  -8.045
  234    HG1  THR  30           1HG      THR  30  -0.132  -2.984  -9.897
  235   HG21  THR  30          3HG2      THR  30   0.152  -4.926 -11.062
  236   HG22  THR  30          1HG2      THR  30   0.637  -6.331 -10.110
  237   HG23  THR  30          2HG2      THR  30   1.619  -4.866 -10.087
  238    H    ILE  31           HN       ILE  31  -2.734  -3.307  -7.802
  239    HA   ILE  31           HA       ILE  31  -2.675  -4.299  -5.155
  240    HB   ILE  31           HB       ILE  31  -4.340  -2.080  -6.362
  241   HG12  ILE  31          2HG1      ILE  31  -1.853  -2.030  -4.632
  242   HG13  ILE  31          1HG1      ILE  31  -1.898  -1.729  -6.365
  243   HG21  ILE  31          1HG2      ILE  31  -5.461  -2.948  -4.375
  244   HG22  ILE  31          2HG2      ILE  31  -4.795  -1.343  -4.072
  245   HG23  ILE  31          3HG2      ILE  31  -3.970  -2.771  -3.444
  246   HD11  ILE  31          3HD1      ILE  31  -3.270  -0.058  -4.273
  247   HD12  ILE  31          1HD1      ILE  31  -3.236   0.256  -6.007
  248   HD13  ILE  31          2HD1      ILE  31  -1.745   0.333  -5.070
  249    H    LYS  32           HN       LYS  32  -5.169  -4.314  -7.657
  250    HA   LYS  32           HA       LYS  32  -7.288  -5.334  -6.140
  251    HB2  LYS  32           2HB      LYS  32  -7.410  -4.464  -8.505
  252    HB3  LYS  32           1HB      LYS  32  -6.705  -5.981  -9.037
  253    HG2  LYS  32           2HG      LYS  32  -8.622  -7.194  -8.099
  254    HG3  LYS  32           1HG      LYS  32  -9.339  -5.658  -7.614
  255    HD2  LYS  32           2HD      LYS  32  -9.323  -4.964 -10.001
  256    HD3  LYS  32           1HD      LYS  32  -8.746  -6.574 -10.427
  257    HE2  LYS  32           2HE      LYS  32 -10.767  -7.553  -9.444
  258    HE3  LYS  32           1HE      LYS  32 -11.346  -5.938  -9.034
  259    HZ1  LYS  32           3HZ      LYS  32 -12.401  -6.581 -11.042
  260    HZ2  LYS  32           1HZ      LYS  32 -10.937  -7.077 -11.746
  261    HZ3  LYS  32           2HZ      LYS  32 -11.228  -5.432 -11.466
  262    H    THR  33           HN       THR  33  -4.569  -6.936  -7.694
  263    HA   THR  33           HA       THR  33  -5.629  -9.575  -7.227
  264    HB   THR  33           HB       THR  33  -2.838  -8.797  -8.084
  265    HG1  THR  33           1HG      THR  33  -3.594  -8.777 -10.123
  266   HG21  THR  33          3HG2      THR  33  -2.759 -11.061  -9.018
  267   HG22  THR  33          1HG2      THR  33  -4.374 -11.384  -8.383
  268   HG23  THR  33          2HG2      THR  33  -3.029 -11.105  -7.276
  269    H    TYR  34           HN       TYR  34  -2.873  -7.707  -5.903
  270    HA   TYR  34           HA       TYR  34  -2.189  -9.856  -4.120
  271    HB2  TYR  34           2HB      TYR  34  -1.120  -7.038  -4.308
  272    HB3  TYR  34           1HB      TYR  34  -0.465  -8.285  -3.255
  273    HD1  TYR  34           1HD      TYR  34   0.004 -10.595  -4.645
  274    HD2  TYR  34           2HD      TYR  34   0.070  -6.648  -6.232
  275    HE1  TYR  34           1HE      TYR  34   1.487 -11.351  -6.454
  276    HE2  TYR  34           2HE      TYR  34   1.549  -7.396  -8.047
  277    HH   TYR  34           HH       TYR  34   2.051 -10.624  -8.802
  278    H    CYS  35           HN       CYS  35  -3.545  -6.589  -3.674
  279    HA   CYS  35           HA       CYS  35  -3.677  -7.064  -0.799
  280    HB2  CYS  35           2HB      CYS  35  -4.358  -4.565  -2.364
  281    HB3  CYS  35           1HB      CYS  35  -4.177  -4.686  -0.617
  282    HG   CYS  35           HG       CYS  35  -1.407  -5.567  -0.998
  283    H    GLY  36           HN       GLY  36  -5.734  -7.000  -3.551
  284    HA2  GLY  36           2HA      GLY  36  -8.180  -6.191  -2.600
  285    HA3  GLY  36           1HA      GLY  36  -7.968  -7.426  -3.826
  286    HA   PRO  37           HA       PRO  37  -9.546 -10.546  -1.180
  287    HB2  PRO  37           2HB      PRO  37  -7.171 -12.269  -1.269
  288    HB3  PRO  37           1HB      PRO  37  -8.778 -12.535  -1.948
  289    HG2  PRO  37           2HG      PRO  37  -6.646 -12.034  -3.506
  290    HG3  PRO  37           1HG      PRO  37  -8.273 -11.466  -3.923
  291    HD2  PRO  37           2HD      PRO  37  -5.991  -9.952  -2.708
  292    HD3  PRO  37           1HD      PRO  37  -7.131  -9.447  -3.975
  293    H    VAL  38           HN       VAL  38  -6.539  -9.187  -0.217
  294    HA   VAL  38           HA       VAL  38  -6.512 -10.632   2.316
  295    HB   VAL  38           HB       VAL  38  -4.557  -8.542   1.341
  296   HG11  VAL  38          1HG1      VAL  38  -4.576  -8.828   3.769
  297   HG12  VAL  38          2HG1      VAL  38  -3.082  -9.450   3.067
  298   HG13  VAL  38          3HG1      VAL  38  -4.350 -10.565   3.573
  299   HG21  VAL  38          3HG2      VAL  38  -3.092 -10.423   0.777
  300   HG22  VAL  38          1HG2      VAL  38  -4.585 -10.468  -0.161
  301   HG23  VAL  38          2HG2      VAL  38  -4.372 -11.556   1.211
  302    H    ILE  39           HN       ILE  39  -6.135  -7.174   1.459
  303    HA   ILE  39           HA       ILE  39  -7.486  -6.552   4.003
  304    HB   ILE  39           HB       ILE  39  -6.242  -4.381   3.941
  305   HG12  ILE  39          2HG1      ILE  39  -4.632  -5.776   1.791
  306   HG13  ILE  39          1HG1      ILE  39  -5.687  -4.395   1.533
  307   HG21  ILE  39          1HG2      ILE  39  -5.545  -6.179   5.395
  308   HG22  ILE  39          2HG2      ILE  39  -4.129  -5.347   4.751
  309   HG23  ILE  39          3HG2      ILE  39  -4.612  -6.909   4.091
  310   HD11  ILE  39          3HD1      ILE  39  -3.365  -3.716   1.620
  311   HD12  ILE  39          1HD1      ILE  39  -3.206  -4.418   3.230
  312   HD13  ILE  39          2HD1      ILE  39  -4.268  -3.034   2.973
  313    H    GLY  40           HN       GLY  40  -8.152  -6.679   0.868
  314    HA2  GLY  40           2HA      GLY  40  -9.049  -4.198   0.021
  315    HA3  GLY  40           1HA      GLY  40  -9.769  -5.726  -0.454
  316    HA   PRO  41           HA       PRO  41 -13.373  -4.783   1.879
  317    HB2  PRO  41           2HB      PRO  41 -13.548  -7.294   3.324
  318    HB3  PRO  41           1HB      PRO  41 -14.480  -6.757   1.925
  319    HG2  PRO  41           2HG      PRO  41 -12.649  -8.772   1.824
  320    HG3  PRO  41           1HG      PRO  41 -13.061  -7.754   0.434
  321    HD2  PRO  41           2HD      PRO  41 -10.699  -7.595   2.268
  322    HD3  PRO  41           1HD      PRO  41 -10.776  -7.381   0.504
  323    H    LEU  42           HN       LEU  42 -10.552  -5.195   3.569
  324    HA   LEU  42           HA       LEU  42 -11.676  -4.826   6.213
  325    HB2  LEU  42           2HB      LEU  42  -8.837  -4.752   5.188
  326    HB3  LEU  42           1HB      LEU  42  -9.266  -4.449   6.860
  327    HG   LEU  42           HG       LEU  42  -9.743  -7.037   5.373
  328   HD11  LEU  42          1HD1      LEU  42  -8.009  -7.928   6.859
  329   HD12  LEU  42          2HD1      LEU  42  -7.743  -6.311   7.513
  330   HD13  LEU  42          3HD1      LEU  42  -7.382  -6.649   5.820
  331   HD21  LEU  42          3HD2      LEU  42 -10.371  -7.918   7.568
  332   HD22  LEU  42          1HD2      LEU  42 -11.444  -6.609   7.076
  333   HD23  LEU  42          2HD2      LEU  42 -10.182  -6.311   8.271
  334    H    SER  43           HN       SER  43 -11.585  -2.899   7.397
  335    HA   SER  43           HA       SER  43 -12.001  -0.545   5.898
  336    HB2  SER  43           2HB      SER  43 -12.950  -1.017   8.174
  337    HB3  SER  43           1HB      SER  43 -11.350  -0.744   8.844
  338    HG   SER  43           HG       SER  43 -12.777   1.163   7.293
  339    H    VAL  44           HN       VAL  44 -10.727   1.262   5.593
  340    HA   VAL  44           HA       VAL  44  -7.926   0.916   5.473
  341    HB   VAL  44           HB       VAL  44  -9.138   2.517   4.036
  342   HG11  VAL  44          1HG1      VAL  44  -9.428   4.164   6.542
  343   HG12  VAL  44          2HG1      VAL  44 -10.731   3.359   5.669
  344   HG13  VAL  44          3HG1      VAL  44  -9.846   4.681   4.907
  345   HG21  VAL  44          3HG2      VAL  44  -6.741   2.778   4.328
  346   HG22  VAL  44          1HG2      VAL  44  -7.007   3.793   5.746
  347   HG23  VAL  44          2HG2      VAL  44  -7.521   4.351   4.153
  348    H    GLN  45           HN       GLN  45 -10.084   1.872   7.953
  349    HA   GLN  45           HA       GLN  45  -8.232   3.190   9.671
  350    HB2  GLN  45           2HB      GLN  45 -11.009   2.587   9.632
  351    HB3  GLN  45           1HB      GLN  45 -10.357   1.929  11.124
  352    HG2  GLN  45           2HG      GLN  45  -9.989   4.772  10.216
  353    HG3  GLN  45           1HG      GLN  45 -11.244   4.228  11.329
  354   HE21  GLN  45          1HE2      GLN  45  -9.092   6.129  11.746
  355   HE22  GLN  45          2HE2      GLN  45  -8.172   5.531  13.093
  356    H    ASP  46           HN       ASP  46  -9.326  -0.140   9.248
  357    HA   ASP  46           HA       ASP  46  -8.157  -1.093  11.669
  358    HB2  ASP  46           2HB      ASP  46  -9.341  -2.468   9.270
  359    HB3  ASP  46           1HB      ASP  46  -8.621  -3.366  10.597
  360    H    VAL  47           HN       VAL  47  -6.852  -0.431   8.592
  361    HA   VAL  47           HA       VAL  47  -4.902  -2.421   8.335
  362    HB   VAL  47           HB       VAL  47  -4.680   0.465   7.463
  363   HG11  VAL  47          1HG1      VAL  47  -3.094  -0.396   5.792
  364   HG12  VAL  47          2HG1      VAL  47  -3.219  -2.002   6.515
  365   HG13  VAL  47          3HG1      VAL  47  -2.528  -0.671   7.443
  366   HG21  VAL  47          3HG2      VAL  47  -6.689  -0.587   6.582
  367   HG22  VAL  47          1HG2      VAL  47  -5.734  -1.944   5.985
  368   HG23  VAL  47          2HG2      VAL  47  -5.505  -0.333   5.299
  369    H    ASP  48           HN       ASP  48  -3.434  -2.958   9.786
  370    HA   ASP  48           HA       ASP  48  -2.119  -0.849  11.376
  371    HB2  ASP  48           2HB      ASP  48  -3.673  -2.145  12.751
  372    HB3  ASP  48           1HB      ASP  48  -2.933  -3.647  12.231
  373    H    THR  49           HN       THR  49  -0.066  -1.564  12.279
  374    HA   THR  49           HA       THR  49   1.821  -2.131  10.328
  375    HB   THR  49           HB       THR  49   2.339  -2.821  13.200
  376    HG1  THR  49           1HG      THR  49   1.641  -0.925  13.822
  377   HG21  THR  49          3HG2      THR  49   4.443  -1.643  12.769
  378   HG22  THR  49          1HG2      THR  49   3.892  -1.242  11.142
  379   HG23  THR  49          2HG2      THR  49   4.179  -2.925  11.587
  380    H    LYS  50           HN       LYS  50   0.294  -4.224  12.716
  381    HA   LYS  50           HA       LYS  50   1.799  -6.561  12.287
  382    HB2  LYS  50           2HB      LYS  50   0.212  -5.976  14.198
  383    HB3  LYS  50           1HB      LYS  50  -1.100  -6.415  13.124
  384    HG2  LYS  50           2HG      LYS  50   1.108  -8.332  13.787
  385    HG3  LYS  50           1HG      LYS  50  -0.314  -8.142  14.812
  386    HD2  LYS  50           2HD      LYS  50  -1.700  -8.613  12.753
  387    HD3  LYS  50           1HD      LYS  50  -0.195  -9.069  11.952
  388    HE2  LYS  50           2HE      LYS  50  -1.251 -11.051  12.789
  389    HE3  LYS  50           1HE      LYS  50   0.199 -10.733  13.740
  390    HZ1  LYS  50           3HZ      LYS  50  -2.568 -10.022  14.564
  391    HZ2  LYS  50           1HZ      LYS  50  -1.165  -9.810  15.490
  392    HZ3  LYS  50           2HZ      LYS  50  -1.707 -11.373  15.115
  393    H    LEU  51           HN       LEU  51  -1.205  -5.382  10.844
  394    HA   LEU  51           HA       LEU  51  -1.763  -7.729   9.369
  395    HB2  LEU  51           2HB      LEU  51  -2.723  -4.901   8.961
  396    HB3  LEU  51           1HB      LEU  51  -3.382  -6.310   8.164
  397    HG   LEU  51           HG       LEU  51  -3.474  -5.727  11.114
  398   HD11  LEU  51          1HD1      LEU  51  -5.885  -5.555  10.754
  399   HD12  LEU  51          2HD1      LEU  51  -5.646  -5.814   9.026
  400   HD13  LEU  51          3HD1      LEU  51  -5.002  -4.365   9.797
  401   HD21  LEU  51          3HD2      LEU  51  -3.234  -8.118  10.736
  402   HD22  LEU  51          1HD2      LEU  51  -4.563  -8.085   9.576
  403   HD23  LEU  51          2HD2      LEU  51  -4.869  -7.738  11.278
  404    H    ILE  52           HN       ILE  52  -0.156  -4.676   8.545
  405    HA   ILE  52           HA       ILE  52   0.108  -5.125   5.789
  406    HB   ILE  52           HB       ILE  52   2.017  -3.605   7.579
  407   HG12  ILE  52          2HG1      ILE  52  -0.378  -2.628   6.002
  408   HG13  ILE  52          1HG1      ILE  52  -0.326  -2.822   7.750
  409   HG21  ILE  52          1HG2      ILE  52   2.613  -2.389   5.533
  410   HG22  ILE  52          2HG2      ILE  52   1.550  -3.447   4.603
  411   HG23  ILE  52          3HG2      ILE  52   2.976  -4.110   5.400
  412   HD11  ILE  52          3HD1      ILE  52   1.410  -1.112   7.888
  413   HD12  ILE  52          1HD1      ILE  52  -0.048  -0.501   7.108
  414   HD13  ILE  52          2HD1      ILE  52   1.359  -0.923   6.135
  415    H    MET  53           HN       MET  53   2.182  -6.057   8.501
  416    HA   MET  53           HA       MET  53   4.303  -7.170   7.043
  417    HB2  MET  53           2HB      MET  53   3.189  -8.045   9.722
  418    HB3  MET  53           1HB      MET  53   4.742  -8.538   9.068
  419    HG2  MET  53           2HG      MET  53   5.482  -6.202   9.106
  420    HG3  MET  53           1HG      MET  53   3.930  -5.736   9.797
  421    HE1  MET  53           3HE      MET  53   5.090  -4.552  11.857
  422    HE2  MET  53           1HE      MET  53   6.666  -4.938  11.161
  423    HE3  MET  53           2HE      MET  53   6.326  -5.315  12.853
  424    H    LYS  54           HN       LYS  54   1.202  -8.526   8.048
  425    HA   LYS  54           HA       LYS  54   1.816 -11.178   7.239
  426    HB2  LYS  54           2HB      LYS  54  -0.834  -9.848   7.811
  427    HB3  LYS  54           1HB      LYS  54  -0.636 -11.568   7.509
  428    HG2  LYS  54           2HG      LYS  54   0.724 -10.084   9.754
  429    HG3  LYS  54           1HG      LYS  54  -0.807 -10.940   9.917
  430    HD2  LYS  54           2HD      LYS  54   0.891 -12.402  10.715
  431    HD3  LYS  54           1HD      LYS  54   0.385 -13.018   9.145
  432    HE2  LYS  54           2HE      LYS  54   2.339 -11.949   8.107
  433    HE3  LYS  54           1HE      LYS  54   2.843 -11.354   9.687
  434    HZ1  LYS  54           3HZ      LYS  54   2.465 -14.242   9.163
  435    HZ2  LYS  54           1HZ      LYS  54   3.335 -13.498  10.417
  436    HZ3  LYS  54           2HZ      LYS  54   3.937 -13.460   8.828
  437    H    VAL  55           HN       VAL  55   0.211  -8.461   5.664
  438    HA   VAL  55           HA       VAL  55  -0.611  -9.795   3.330
  439    HB   VAL  55           HB       VAL  55   0.365  -6.938   3.539
  440   HG11  VAL  55          1HG1      VAL  55  -1.449  -8.271   1.531
  441   HG12  VAL  55          2HG1      VAL  55   0.193  -7.694   1.242
  442   HG13  VAL  55          3HG1      VAL  55  -1.094  -6.545   1.604
  443   HG21  VAL  55          3HG2      VAL  55  -1.977  -6.330   3.872
  444   HG22  VAL  55          1HG2      VAL  55  -1.389  -7.367   5.171
  445   HG23  VAL  55          2HG2      VAL  55  -2.419  -8.036   3.902
  446    H    LEU  56           HN       LEU  56   2.435  -8.227   4.189
  447    HA   LEU  56           HA       LEU  56   3.603  -8.660   1.600
  448    HB2  LEU  56           2HB      LEU  56   4.758  -7.691   4.208
  449    HB3  LEU  56           1HB      LEU  56   5.657  -7.756   2.707
  450    HG   LEU  56           HG       LEU  56   3.208  -6.068   3.226
  451   HD11  LEU  56          1HD1      LEU  56   6.105  -5.309   2.882
  452   HD12  LEU  56          2HD1      LEU  56   5.185  -5.250   4.385
  453   HD13  LEU  56          3HD1      LEU  56   4.756  -4.185   3.048
  454   HD21  LEU  56          3HD2      LEU  56   4.968  -6.262   0.784
  455   HD22  LEU  56          1HD2      LEU  56   3.676  -5.087   1.029
  456   HD23  LEU  56          2HD2      LEU  56   3.295  -6.805   0.909
  457    H    ASP  57           HN       ASP  57   3.427 -10.441   4.533
  458    HA   ASP  57           HA       ASP  57   5.845 -11.709   4.748
  459    HB2  ASP  57           2HB      ASP  57   3.708 -11.865   6.224
  460    HB3  ASP  57           1HB      ASP  57   3.324 -13.261   5.231
  461    HA   PRO  58           HA       PRO  58   4.604 -15.322   1.858
  462    HB2  PRO  58           2HB      PRO  58   2.367 -15.177   0.355
  463    HB3  PRO  58           1HB      PRO  58   2.342 -15.780   2.016
  464    HG2  PRO  58           2HG      PRO  58   1.612 -13.073   0.971
  465    HG3  PRO  58           1HG      PRO  58   0.773 -14.067   2.176
  466    HD2  PRO  58           2HD      PRO  58   2.415 -11.998   2.828
  467    HD3  PRO  58           1HD      PRO  58   2.184 -13.415   3.870
  468    H    ILE  59           HN       ILE  59   4.229 -12.022   0.966
  469    HA   ILE  59           HA       ILE  59   4.745 -12.405  -1.838
  470    HB   ILE  59           HB       ILE  59   4.973  -9.845  -0.253
  471   HG12  ILE  59          2HG1      ILE  59   2.767 -10.928   0.063
  472   HG13  ILE  59          1HG1      ILE  59   2.655  -9.415  -0.817
  473   HG21  ILE  59          1HG2      ILE  59   5.974  -9.741  -2.466
  474   HG22  ILE  59          2HG2      ILE  59   4.492  -8.786  -2.422
  475   HG23  ILE  59          3HG2      ILE  59   4.494 -10.377  -3.185
  476   HD11  ILE  59          3HD1      ILE  59   2.550 -12.171  -2.017
  477   HD12  ILE  59          1HD1      ILE  59   2.457 -10.657  -2.917
  478   HD13  ILE  59          2HD1      ILE  59   1.186 -11.081  -1.771
  479    H    TRP  60           HN       TRP  60   6.607 -11.619   1.052
  480    HA   TRP  60           HA       TRP  60   9.027 -10.900  -0.158
  481    HB2  TRP  60           2HB      TRP  60   8.424 -12.210   2.485
  482    HB3  TRP  60           1HB      TRP  60  10.068 -11.827   1.996
  483    HD1  TRP  60           1HD      TRP  60   7.157 -10.363   3.729
  484    HE1  TRP  60           1HE      TRP  60   7.520  -7.849   4.156
  485    HE3  TRP  60           3HE      TRP  60  11.198  -9.611   0.691
  486    HZ2  TRP  60           2HZ      TRP  60   9.292  -5.814   3.309
  487    HZ3  TRP  60           3HZ      TRP  60  12.170  -7.354   0.560
  488    HH2  TRP  60           2HH      TRP  60  11.236  -5.498   1.840
  489    H    GLU  61           HN       GLU  61   7.539 -14.004   0.196
  490    HA   GLU  61           HA       GLU  61   9.924 -15.528  -0.212
  491    HB2  GLU  61           2HB      GLU  61   7.000 -16.264  -0.237
  492    HB3  GLU  61           1HB      GLU  61   8.323 -17.403  -0.296
  493    HG2  GLU  61           2HG      GLU  61   9.089 -16.629   1.897
  494    HG3  GLU  61           1HG      GLU  61   7.731 -15.507   1.951
  495    H    GLN  62           HN       GLN  62   7.369 -14.214  -2.166
  496    HA   GLN  62           HA       GLN  62   8.177 -15.822  -4.469
  497    HB2  GLN  62           2HB      GLN  62   5.762 -14.066  -4.015
  498    HB3  GLN  62           1HB      GLN  62   6.074 -14.989  -5.473
  499    HG2  GLN  62           2HG      GLN  62   5.898 -17.062  -4.275
  500    HG3  GLN  62           1HG      GLN  62   5.766 -16.206  -2.740
  501   HE21  GLN  62          1HE2      GLN  62   3.855 -15.173  -2.218
  502   HE22  GLN  62          2HE2      GLN  62   2.368 -15.508  -3.047
  503    H    LYS  63           HN       LYS  63   7.494 -12.444  -3.602
  504    HA   LYS  63           HA       LYS  63   9.336 -11.570  -5.712
  505    HB2  LYS  63           2HB      LYS  63   6.602 -10.348  -5.253
  506    HB3  LYS  63           1HB      LYS  63   7.788  -9.834  -6.444
  507    HG2  LYS  63           2HG      LYS  63   7.539 -11.954  -7.620
  508    HG3  LYS  63           1HG      LYS  63   6.360 -12.488  -6.420
  509    HD2  LYS  63           2HD      LYS  63   4.926 -10.569  -7.032
  510    HD3  LYS  63           1HD      LYS  63   6.088 -10.130  -8.284
  511    HE2  LYS  63           2HE      LYS  63   4.562 -12.724  -8.120
  512    HE3  LYS  63           1HE      LYS  63   4.193 -11.382  -9.203
  513    HZ1  LYS  63           3HZ      LYS  63   6.637 -13.072  -9.221
  514    HZ2  LYS  63           1HZ      LYS  63   6.431 -11.687 -10.181
  515    HZ3  LYS  63           2HZ      LYS  63   5.416 -13.031 -10.397
  516    HA   PRO  64           HA       PRO  64  10.195  -9.742  -1.526
  517    HB2  PRO  64           2HB      PRO  64  12.887  -9.531  -2.747
  518    HB3  PRO  64           1HB      PRO  64  12.409 -10.180  -1.175
  519    HG2  PRO  64           2HG      PRO  64  13.145 -11.796  -3.174
  520    HG3  PRO  64           1HG      PRO  64  11.857 -12.247  -2.042
  521    HD2  PRO  64           2HD      PRO  64  11.651 -11.256  -4.853
  522    HD3  PRO  64           1HD      PRO  64  10.675 -12.477  -4.009
  523    H    GLU  65           HN       GLU  65  11.773  -8.563  -4.515
  524    HA   GLU  65           HA       GLU  65  12.009  -5.914  -3.675
  525    HB2  GLU  65           2HB      GLU  65  11.714  -6.887  -6.506
  526    HB3  GLU  65           1HB      GLU  65  12.501  -5.429  -5.963
  527    HG2  GLU  65           2HG      GLU  65  14.360  -6.648  -6.233
  528    HG3  GLU  65           1HG      GLU  65  13.950  -7.225  -4.619
  529    H    THR  66           HN       THR  66   9.455  -7.636  -5.376
  530    HA   THR  66           HA       THR  66   7.923  -5.345  -6.066
  531    HB   THR  66           HB       THR  66   6.996  -8.207  -5.725
  532    HG1  THR  66           1HG      THR  66   8.619  -8.039  -7.303
  533   HG21  THR  66          3HG2      THR  66   5.133  -6.618  -5.737
  534   HG22  THR  66          1HG2      THR  66   5.165  -7.568  -7.222
  535   HG23  THR  66          2HG2      THR  66   5.749  -5.904  -7.226
  536    H    ALA  67           HN       ALA  67   7.953  -7.486  -3.272
  537    HA   ALA  67           HA       ALA  67   5.689  -6.516  -1.937
  538    HB1  ALA  67           1HB      ALA  67   8.279  -7.510  -0.749
  539    HB2  ALA  67           2HB      ALA  67   6.912  -8.515  -1.225
  540    HB3  ALA  67           3HB      ALA  67   6.742  -7.365   0.103
  541    H    SER  68           HN       SER  68   9.020  -5.373  -1.997
  542    HA   SER  68           HA       SER  68   8.671  -3.295  -0.098
  543    HB2  SER  68           2HB      SER  68  10.731  -3.531  -2.304
  544    HB3  SER  68           1HB      SER  68  10.836  -2.476  -0.894
  545    HG   SER  68           HG       SER  68  10.858  -5.315  -0.943
  546    H    ARG  69           HN       ARG  69   8.536  -3.413  -3.637
  547    HA   ARG  69           HA       ARG  69   8.185  -0.646  -4.028
  548    HB2  ARG  69           2HB      ARG  69   7.373  -2.961  -5.786
  549    HB3  ARG  69           1HB      ARG  69   7.493  -1.294  -6.296
  550    HG2  ARG  69           2HG      ARG  69   9.953  -1.514  -5.440
  551    HG3  ARG  69           1HG      ARG  69   9.647  -3.235  -5.675
  552    HD2  ARG  69           2HD      ARG  69  10.595  -2.470  -7.694
  553    HD3  ARG  69           1HD      ARG  69   8.866  -2.638  -8.012
  554    HE   ARG  69           HE       ARG  69   9.346  -0.014  -7.163
  555   HH11  ARG  69          1HH1      ARG  69  10.047  -2.074  -9.916
  556   HH12  ARG  69          2HH1      ARG  69  10.233  -0.734 -11.012
  557   HH21  ARG  69          1HH2      ARG  69   9.586   1.721  -8.594
  558   HH22  ARG  69          2HH2      ARG  69   9.962   1.418 -10.267
  559    H    LEU  70           HN       LEU  70   5.908  -3.327  -3.699
  560    HA   LEU  70           HA       LEU  70   3.550  -1.866  -4.164
  561    HB2  LEU  70           2HB      LEU  70   3.605  -4.302  -4.160
  562    HB3  LEU  70           1HB      LEU  70   4.031  -4.314  -2.460
  563    HG   LEU  70           HG       LEU  70   1.828  -3.323  -1.922
  564   HD11  LEU  70          1HD1      LEU  70   0.092  -3.231  -3.619
  565   HD12  LEU  70          2HD1      LEU  70   1.239  -3.762  -4.847
  566   HD13  LEU  70          3HD1      LEU  70   1.443  -2.192  -4.072
  567   HD21  LEU  70          3HD2      LEU  70   0.514  -5.340  -2.377
  568   HD22  LEU  70          1HD2      LEU  70   2.143  -5.734  -1.822
  569   HD23  LEU  70          2HD2      LEU  70   1.737  -5.868  -3.532
  570    H    ARG  71           HN       ARG  71   5.374  -2.564  -1.229
  571    HA   ARG  71           HA       ARG  71   3.631  -1.457   0.654
  572    HB2  ARG  71           2HB      ARG  71   5.542  -2.871   1.240
  573    HB3  ARG  71           1HB      ARG  71   6.651  -1.609   0.721
  574    HG2  ARG  71           2HG      ARG  71   5.748  -0.137   2.478
  575    HG3  ARG  71           1HG      ARG  71   4.724  -1.465   3.027
  576    HD2  ARG  71           2HD      ARG  71   6.774  -1.259   4.361
  577    HD3  ARG  71           1HD      ARG  71   6.670  -2.806   3.524
  578    HE   ARG  71           HE       ARG  71   8.332  -2.022   1.982
  579   HH11  ARG  71          1HH1      ARG  71   7.803   0.046   4.739
  580   HH12  ARG  71          2HH1      ARG  71   9.369   0.789   4.655
  581   HH21  ARG  71          1HH2      ARG  71  10.393  -1.049   1.844
  582   HH22  ARG  71          2HH2      ARG  71  10.853   0.175   2.982
  583    H    GLY  72           HN       GLY  72   6.162   0.032  -1.293
  584    HA2  GLY  72           2HA      GLY  72   6.190   2.565  -0.076
  585    HA3  GLY  72           1HA      GLY  72   6.646   2.231  -1.741
  586    H    ARG  73           HN       ARG  73   4.170   1.268  -2.673
  587    HA   ARG  73           HA       ARG  73   2.815   3.731  -3.159
  588    HB2  ARG  73           2HB      ARG  73   1.931   0.911  -3.800
  589    HB3  ARG  73           1HB      ARG  73   1.223   2.382  -4.450
  590    HG2  ARG  73           2HG      ARG  73   3.471   2.907  -5.441
  591    HG3  ARG  73           1HG      ARG  73   3.973   1.284  -4.963
  592    HD2  ARG  73           2HD      ARG  73   1.734   2.013  -6.847
  593    HD3  ARG  73           1HD      ARG  73   3.270   1.261  -7.272
  594    HE   ARG  73           HE       ARG  73   1.945  -0.344  -5.387
  595   HH11  ARG  73          1HH1      ARG  73   1.703   0.647  -8.735
  596   HH12  ARG  73          2HH1      ARG  73   0.869  -0.789  -9.235
  597   HH21  ARG  73          1HH2      ARG  73   0.830  -2.232  -6.043
  598   HH22  ARG  73          2HH2      ARG  73   0.370  -2.426  -7.707
  599    H    ILE  74           HN       ILE  74   2.198   0.907  -1.146
  600    HA   ILE  74           HA       ILE  74  -0.366   1.592  -0.225
  601    HB   ILE  74           HB       ILE  74   1.829   0.098   1.231
  602   HG12  ILE  74          2HG1      ILE  74  -0.529  -0.919  -0.379
  603   HG13  ILE  74          1HG1      ILE  74   1.150  -0.921  -0.914
  604   HG21  ILE  74          1HG2      ILE  74  -1.132   0.208   1.805
  605   HG22  ILE  74          2HG2      ILE  74   0.144   0.937   2.782
  606   HG23  ILE  74          3HG2      ILE  74   0.044  -0.818   2.627
  607   HD11  ILE  74          3HD1      ILE  74   1.719  -2.464   0.887
  608   HD12  ILE  74          1HD1      ILE  74   0.452  -3.118  -0.151
  609   HD13  ILE  74          2HD1      ILE  74   0.041  -2.454   1.431
  610    H    GLU  75           HN       GLU  75   2.863   2.472   0.942
  611    HA   GLU  75           HA       GLU  75   2.150   3.938   3.213
  612    HB2  GLU  75           2HB      GLU  75   4.507   3.353   2.323
  613    HB3  GLU  75           1HB      GLU  75   4.355   4.816   1.356
  614    HG2  GLU  75           2HG      GLU  75   3.719   5.883   3.670
  615    HG3  GLU  75           1HG      GLU  75   4.617   4.503   4.297
  616    H    SER  76           HN       SER  76   2.356   4.928  -0.180
  617    HA   SER  76           HA       SER  76   1.786   7.651   0.224
  618    HB2  SER  76           2HB      SER  76   1.271   5.942  -2.201
  619    HB3  SER  76           1HB      SER  76   1.269   7.701  -2.182
  620    HG   SER  76           HG       SER  76   3.510   6.253  -1.271
  621    H    VAL  77           HN       VAL  77  -0.328   4.874  -0.337
  622    HA   VAL  77           HA       VAL  77  -2.722   6.373  -0.627
  623    HB   VAL  77           HB       VAL  77  -2.393   3.502   0.270
  624   HG11  VAL  77          1HG1      VAL  77  -4.596   4.373   0.830
  625   HG12  VAL  77          2HG1      VAL  77  -4.708   3.216  -0.496
  626   HG13  VAL  77          3HG1      VAL  77  -4.808   4.946  -0.826
  627   HG21  VAL  77          3HG2      VAL  77  -2.841   2.931  -2.070
  628   HG22  VAL  77          1HG2      VAL  77  -1.377   3.903  -1.912
  629   HG23  VAL  77          2HG2      VAL  77  -2.871   4.648  -2.483
  630    H    LEU  78           HN       LEU  78  -1.314   4.628   2.137
  631    HA   LEU  78           HA       LEU  78  -3.354   5.365   3.964
  632    HB2  LEU  78           2HB      LEU  78  -0.511   4.491   4.461
  633    HB3  LEU  78           1HB      LEU  78  -1.732   4.659   5.706
  634    HG   LEU  78           HG       LEU  78  -1.818   2.709   3.402
  635   HD11  LEU  78          1HD1      LEU  78  -1.355   2.293   6.352
  636   HD12  LEU  78          2HD1      LEU  78  -0.159   2.106   5.069
  637   HD13  LEU  78          3HD1      LEU  78  -1.540   1.014   5.151
  638   HD21  LEU  78          3HD2      LEU  78  -3.783   1.783   4.539
  639   HD22  LEU  78          1HD2      LEU  78  -4.054   3.445   4.017
  640   HD23  LEU  78          2HD2      LEU  78  -3.718   3.097   5.714
  641    H    ASP  79           HN       ASP  79  -0.339   6.857   2.990
  642    HA   ASP  79           HA       ASP  79  -0.117   8.843   4.957
  643    HB2  ASP  79           2HB      ASP  79   1.591   8.273   3.211
  644    HB3  ASP  79           1HB      ASP  79   0.580   9.080   2.021
  645    H    TRP  80           HN       TRP  80  -1.724   8.858   1.815
  646    HA   TRP  80           HA       TRP  80  -2.892  11.401   1.943
  647    HB2  TRP  80           2HB      TRP  80  -2.749  10.161  -0.130
  648    HB3  TRP  80           1HB      TRP  80  -3.745   8.869   0.523
  649    HD1  TRP  80           1HD      TRP  80  -4.080  12.587  -0.528
  650    HE1  TRP  80           1HE      TRP  80  -6.494  12.954  -1.345
  651    HE3  TRP  80           3HE      TRP  80  -6.004   7.970   0.529
  652    HZ2  TRP  80           2HZ      TRP  80  -8.897  11.471  -1.518
  653    HZ3  TRP  80           3HZ      TRP  80  -8.364   7.524   0.005
  654    HH2  TRP  80           2HH      TRP  80  -9.780   9.242  -0.998
  655    H    ALA  81           HN       ALA  81  -4.092   8.218   2.951
  656    HA   ALA  81           HA       ALA  81  -6.651   8.997   3.779
  657    HB1  ALA  81           1HB      ALA  81  -6.667   6.939   5.106
  658    HB2  ALA  81           2HB      ALA  81  -4.927   6.776   4.875
  659    HB3  ALA  81           3HB      ALA  81  -6.016   6.661   3.491
  660    H    THR  82           HN       THR  82  -3.557   9.085   5.456
  661    HA   THR  82           HA       THR  82  -4.566   9.683   8.032
  662    HB   THR  82           HB       THR  82  -1.866  10.411   6.877
  663    HG1  THR  82           1HG      THR  82  -2.143   8.187   6.737
  664   HG21  THR  82          3HG2      THR  82  -2.322  11.599   8.950
  665   HG22  THR  82          1HG2      THR  82  -1.113  10.345   9.223
  666   HG23  THR  82          2HG2      THR  82  -2.780  10.088   9.738
  667    H    VAL  83           HN       VAL  83  -3.412  11.740   5.378
  668    HA   VAL  83           HA       VAL  83  -3.813  14.204   6.733
  669    HB   VAL  83           HB       VAL  83  -3.780  13.693   3.751
  670   HG11  VAL  83          1HG1      VAL  83  -4.678  15.894   4.299
  671   HG12  VAL  83          2HG1      VAL  83  -3.074  16.044   3.580
  672   HG13  VAL  83          3HG1      VAL  83  -3.278  16.227   5.322
  673   HG21  VAL  83          3HG2      VAL  83  -1.513  14.390   5.618
  674   HG22  VAL  83          1HG2      VAL  83  -1.403  14.273   3.863
  675   HG23  VAL  83          2HG2      VAL  83  -1.761  12.835   4.820
  676    H    ARG  84           HN       ARG  84  -5.827  12.216   4.645
  677    HA   ARG  84           HA       ARG  84  -7.973  14.052   4.394
  678    HB2  ARG  84           2HB      ARG  84  -7.727  11.081   4.014
  679    HB3  ARG  84           1HB      ARG  84  -9.261  11.912   3.807
  680    HG2  ARG  84           2HG      ARG  84  -6.755  12.625   2.306
  681    HG3  ARG  84           1HG      ARG  84  -7.992  11.521   1.703
  682    HD2  ARG  84           2HD      ARG  84  -8.447  14.397   2.483
  683    HD3  ARG  84           1HD      ARG  84  -8.265  13.806   0.831
  684    HE   ARG  84           HE       ARG  84 -10.301  12.337   1.522
  685   HH11  ARG  84          1HH1      ARG  84  -9.723  15.657   2.467
  686   HH12  ARG  84          2HH1      ARG  84 -11.410  16.051   2.600
  687   HH21  ARG  84          1HH2      ARG  84 -12.514  12.844   1.670
  688   HH22  ARG  84          2HH2      ARG  84 -13.001  14.445   2.144
  689    H    GLY  85           HN       GLY  85  -7.048  11.843   6.899
  690    HA2  GLY  85           2HA      GLY  85  -7.892  11.992   9.102
  691    HA3  GLY  85           1HA      GLY  85  -9.336  12.764   8.468
  692    H    TYR  86           HN       TYR  86  -8.118   9.879   6.973
  693    HA   TYR  86           HA       TYR  86 -10.505   8.437   7.808
  694    HB2  TYR  86           2HB      TYR  86  -8.260   7.523   5.996
  695    HB3  TYR  86           1HB      TYR  86  -9.813   6.727   6.211
  696    HD1  TYR  86           1HD      TYR  86 -11.425   9.401   6.196
  697    HD2  TYR  86           2HD      TYR  86  -8.459   7.758   3.618
  698    HE1  TYR  86           1HE      TYR  86 -12.338  10.704   4.323
  699    HE2  TYR  86           2HE      TYR  86  -9.361   9.063   1.740
  700    HH   TYR  86           HH       TYR  86 -11.627  10.109   1.139
  701    H    ARG  87           HN       ARG  87  -7.472   8.961   8.968
  702    HA   ARG  87           HA       ARG  87  -7.718   6.924  10.954
  703    HB2  ARG  87           2HB      ARG  87  -5.498   5.901  10.561
  704    HB3  ARG  87           1HB      ARG  87  -6.644   5.556   9.272
  705    HG2  ARG  87           2HG      ARG  87  -5.588   7.058   7.795
  706    HG3  ARG  87           1HG      ARG  87  -4.635   7.780   9.094
  707    HD2  ARG  87           2HD      ARG  87  -3.422   6.156   7.571
  708    HD3  ARG  87           1HD      ARG  87  -3.280   5.869   9.306
  709    HE   ARG  87           HE       ARG  87  -5.219   4.401   7.645
  710   HH11  ARG  87          1HH1      ARG  87  -2.591   4.451   9.967
  711   HH12  ARG  87          2HH1      ARG  87  -2.739   2.768  10.357
  712   HH21  ARG  87          1HH2      ARG  87  -5.428   2.198   8.166
  713   HH22  ARG  87          2HH2      ARG  87  -4.335   1.476   9.315
  714    H    GLU  88           HN       GLU  88  -5.899   7.069  12.535
  715    HA   GLU  88           HA       GLU  88  -4.569   9.675  12.498
  716    HB2  GLU  88           2HB      GLU  88  -5.099  10.023  14.868
  717    HB3  GLU  88           1HB      GLU  88  -6.556   9.936  13.897
  718    HG2  GLU  88           2HG      GLU  88  -5.465   7.667  15.551
  719    HG3  GLU  88           1HG      GLU  88  -6.728   8.778  16.074
  720    H    GLY  89           HN       GLY  89  -2.863   9.743  14.306
  721    HA2  GLY  89           2HA      GLY  89  -1.258   8.583  15.615
  722    HA3  GLY  89           1HA      GLY  89  -1.728   7.089  14.818
  723    H    ASP  90           HN       ASP  90  -0.178   6.302  13.603
  724    HA   ASP  90           HA       ASP  90   1.535   8.147  12.072
  725    HB2  ASP  90           2HB      ASP  90   2.696   7.172  14.084
  726    HB3  ASP  90           1HB      ASP  90   2.452   5.574  13.393
  727    H    ASN  91           HN       ASN  91   2.718   6.844  10.275
  728    HA   ASN  91           HA       ASN  91   0.682   5.187   8.972
  729    HB2  ASN  91           2HB      ASN  91   1.420   7.245   7.758
  730    HB3  ASN  91           1HB      ASN  91   3.029   6.532   7.623
  731   HD21  ASN  91          1HD2      ASN  91   2.713   6.649   5.305
  732   HD22  ASN  91          2HD2      ASN  91   1.762   5.448   4.507
  733    HA   PRO  92           HA       PRO  92   3.524   2.008  10.493
  734    HB2  PRO  92           2HB      PRO  92   1.814  -0.062   9.969
  735    HB3  PRO  92           1HB      PRO  92   1.699   0.961  11.403
  736    HG2  PRO  92           2HG      PRO  92   0.199   1.147   8.816
  737    HG3  PRO  92           1HG      PRO  92  -0.424   1.246  10.476
  738    HD2  PRO  92           2HD      PRO  92  -0.019   3.447   9.030
  739    HD3  PRO  92           1HD      PRO  92   0.359   3.417  10.765
  740    H    ALA  93           HN       ALA  93   2.889   2.770   7.355
  741    HA   ALA  93           HA       ALA  93   3.635   0.215   6.182
  742    HB1  ALA  93           1HB      ALA  93   2.953   2.828   4.852
  743    HB2  ALA  93           2HB      ALA  93   1.830   1.504   5.165
  744    HB3  ALA  93           3HB      ALA  93   3.177   1.275   4.049
  745    H    ARG  94           HN       ARG  94   5.173   3.208   7.041
  746    HA   ARG  94           HA       ARG  94   7.211   2.940   5.023
  747    HB2  ARG  94           2HB      ARG  94   8.265   4.905   6.265
  748    HB3  ARG  94           1HB      ARG  94   6.745   5.168   5.430
  749    HG2  ARG  94           2HG      ARG  94   5.547   5.027   7.538
  750    HG3  ARG  94           1HG      ARG  94   7.062   4.718   8.390
  751    HD2  ARG  94           2HD      ARG  94   6.178   7.113   8.409
  752    HD3  ARG  94           1HD      ARG  94   7.871   6.882   7.964
  753    HE   ARG  94           HE       ARG  94   6.277   6.845   5.643
  754   HH11  ARG  94          1HH1      ARG  94   7.376   9.094   8.085
  755   HH12  ARG  94          2HH1      ARG  94   7.398  10.451   6.995
  756   HH21  ARG  94          1HH2      ARG  94   6.335   8.588   4.207
  757   HH22  ARG  94          2HH2      ARG  94   6.817  10.168   4.778
  758    H    TRP  95           HN       TRP  95   7.178   2.682   8.581
  759    HA   TRP  95           HA       TRP  95   8.514   1.540  10.026
  760    HB2  TRP  95           2HB      TRP  95   9.115   0.138   7.471
  761    HB3  TRP  95           1HB      TRP  95  10.182  -0.144   8.844
  762    HD1  TRP  95           1HD      TRP  95   8.802  -0.912  11.177
  763    HE1  TRP  95           1HE      TRP  95   6.891  -2.625  11.363
  764    HE3  TRP  95           3HE      TRP  95   7.197  -0.861   6.328
  765    HZ2  TRP  95           2HZ      TRP  95   4.946  -3.786   9.677
  766    HZ3  TRP  95           3HZ      TRP  95   5.299  -2.296   5.700
  767    HH2  TRP  95           2HH      TRP  95   4.199  -3.726   7.340
  768    H    ARG  96           HN       ARG  96  10.416   1.864  11.071
  769    HA   ARG  96           HA       ARG  96  12.325   3.688   9.865
  770    HB2  ARG  96           2HB      ARG  96  11.513   3.852  12.249
  771    HB3  ARG  96           1HB      ARG  96  12.405   2.377  12.585
  772    HG2  ARG  96           2HG      ARG  96  14.486   3.488  11.974
  773    HG3  ARG  96           1HG      ARG  96  13.591   4.971  11.632
  774    HD2  ARG  96           2HD      ARG  96  12.773   4.907  14.000
  775    HD3  ARG  96           1HD      ARG  96  13.895   3.578  14.284
  776    HE   ARG  96           HE       ARG  96  15.467   5.539  13.240
  777   HH11  ARG  96          1HH1      ARG  96  13.264   5.337  15.957
  778   HH12  ARG  96          2HH1      ARG  96  14.054   6.604  16.853
  779   HH21  ARG  96          1HH2      ARG  96  16.532   7.163  14.428
  780   HH22  ARG  96          2HH2      ARG  96  15.937   7.627  15.995
  781    H    GLY  97           HN       GLY  97  12.006   0.357  10.731
  782    HA2  GLY  97           2HA      GLY  97  14.233  -0.399   9.076
  783    HA3  GLY  97           1HA      GLY  97  14.510  -0.686  10.788
  784    H    TYR  98           HN       TYR  98  12.843  -1.705   7.953
  785    HA   TYR  98           HA       TYR  98  10.774  -3.235   9.074
  786    HB2  TYR  98           2HB      TYR  98  11.077  -2.534   6.643
  787    HB3  TYR  98           1HB      TYR  98  12.201  -3.876   6.488
  788    HD1  TYR  98           2HD      TYR  98  11.150  -6.203   7.417
  789    HD2  TYR  98           1HD      TYR  98   8.924  -2.899   5.933
  790    HE1  TYR  98           2HE      TYR  98   9.275  -7.707   6.909
  791    HE2  TYR  98           1HE      TYR  98   7.039  -4.394   5.424
  792    HH   TYR  98           HH       TYR  98   6.852  -7.593   6.579
  793    H    LEU  99           HN       LEU  99  13.833  -4.460   7.667
  794    HA   LEU  99           HA       LEU  99  13.564  -6.815   9.416
  795    HB2  LEU  99           2HB      LEU  99  14.933  -6.484   6.747
  796    HB3  LEU  99           1HB      LEU  99  15.084  -7.911   7.746
  797    HG   LEU  99           HG       LEU  99  12.516  -6.892   6.534
  798   HD11  LEU  99          1HD1      LEU  99  14.010  -7.787   4.848
  799   HD12  LEU  99          2HD1      LEU  99  12.661  -8.889   5.120
  800   HD13  LEU  99          3HD1      LEU  99  14.246  -9.250   5.804
  801   HD21  LEU  99          3HD2      LEU  99  12.116  -8.027   8.646
  802   HD22  LEU  99          1HD2      LEU  99  13.087  -9.399   8.115
  803   HD23  LEU  99          2HD2      LEU  99  11.570  -9.025   7.299
  804    H    GLU 100           HN       GLU 100  15.984  -4.713   7.898
  805    HA   GLU 100           HA       GLU 100  17.668  -4.843  10.253
  806    HB2  GLU 100           2HB      GLU 100  18.250  -6.873   8.982
  807    HB3  GLU 100           1HB      GLU 100  18.583  -5.892   7.565
  808    HG2  GLU 100           2HG      GLU 100  20.480  -4.903   8.603
  809    HG3  GLU 100           1HG      GLU 100  20.070  -5.622  10.162
  810    H    HIS 101           HN       HIS 101  19.347  -3.225  10.211
  811    HA   HIS 101           HA       HIS 101  18.998  -1.213   8.090
  812    HB2  HIS 101           2HB      HIS 101  17.654  -0.694  10.177
  813    HB3  HIS 101           1HB      HIS 101  19.183  -0.532  11.030
  814    HD1  HIS 101           1HD      HIS 101  20.555   1.614  10.618
  815    HD2  HIS 101           2HD      HIS 101  17.049   1.387   8.380
  816    HE1  HIS 101           1HE      HIS 101  20.169   3.929   9.713
  817    HE2  HIS 101           2HE      HIS 101  17.953   3.809   8.518
  818    H    HIS 102           HN       HIS 102  21.035  -2.243   7.378
  819    HA   HIS 102           HA       HIS 102  23.416  -1.634   8.898
  820    HB2  HIS 102           2HB      HIS 102  22.976  -2.606   6.075
  821    HB3  HIS 102           1HB      HIS 102  24.571  -2.193   6.687
  822    HD1  HIS 102           1HD      HIS 102  23.195  -5.065   5.817
  823    HD2  HIS 102           2HD      HIS 102  24.400  -3.737   9.572
  824    HE1  HIS 102           1HE      HIS 102  23.664  -7.147   7.157
  825    HE2  HIS 102           2HE      HIS 102  24.529  -6.317   9.380
  826    H    HIS 103           HN       HIS 103  23.174   0.594   9.263
  827    HA   HIS 103           HA       HIS 103  23.499   2.810   8.857
  828    HB2  HIS 103           2HB      HIS 103  25.386   1.518   7.321
  829    HB3  HIS 103           1HB      HIS 103  24.556   2.503   6.123
  830    HD1  HIS 103           1HD      HIS 103  26.933   2.677   8.954
  831    HD2  HIS 103           2HD      HIS 103  24.806   5.307   6.527
  832    HE1  HIS 103           1HE      HIS 103  27.961   4.940   9.335
  833    HE2  HIS 103           2HE      HIS 103  26.803   6.467   7.690
  834    H    HIS 104           HN       HIS 104  23.203   4.382   6.586
  835    HA   HIS 104           HA       HIS 104  20.830   3.495   5.172
  836    HB2  HIS 104           2HB      HIS 104  19.896   4.570   7.167
  837    HB3  HIS 104           1HB      HIS 104  20.837   6.022   6.844
  838    HD1  HIS 104           1HD      HIS 104  17.879   4.070   5.541
  839    HD2  HIS 104           2HD      HIS 104  19.728   7.761   5.002
  840    HE1  HIS 104           1HE      HIS 104  16.301   5.424   4.128
  841    HE2  HIS 104           2HE      HIS 104  17.346   7.715   3.996
  842    H    HIS 105           HN       HIS 105  20.663   4.354   3.159
  843    HA   HIS 105           HA       HIS 105  22.232   6.687   2.429
  844    HB2  HIS 105           2HB      HIS 105  23.412   5.555   0.602
  845    HB3  HIS 105           1HB      HIS 105  23.839   4.840   2.152
  846    HD1  HIS 105           1HD      HIS 105  23.051   2.401   2.596
  847    HD2  HIS 105           2HD      HIS 105  22.044   3.872  -1.164
  848    HE1  HIS 105           1HE      HIS 105  22.336   0.402   1.255
  849    HE2  HIS 105           2HE      HIS 105  21.588   1.333  -0.967
  850    H    HIS 106           HN       HIS 106  21.767   7.358   0.175
  851    HA   HIS 106           HA       HIS 106  18.982   6.944  -0.451
  852    HB2  HIS 106           2HB      HIS 106  20.000   9.171  -0.709
  853    HB3  HIS 106           1HB      HIS 106  21.105   8.531  -1.922
  854    HD1  HIS 106           1HD      HIS 106  17.580   9.664  -1.431
  855    HD2  HIS 106           2HD      HIS 106  19.946   8.047  -4.449
  856    HE1  HIS 106           1HE      HIS 106  16.257   9.928  -3.554
  857    HE2  HIS 106           2HE      HIS 106  17.613   8.742  -5.319
  Start of MODEL    3
    1    H1   MET   1           H1       MET   1 -14.688   3.556   6.162
    2    H2   MET   1           H2       MET   1 -15.698   2.750   5.056
    3    H3   MET   1           H3       MET   1 -15.688   4.446   5.118
    4    HA   MET   1           HA       MET   1 -14.478   3.591   3.208
    5    HB2  MET   1           2HB      MET   1 -13.871   5.754   4.261
    6    HB3  MET   1           1HB      MET   1 -12.703   4.910   5.271
    7    HG2  MET   1           2HG      MET   1 -11.243   5.427   3.674
    8    HG3  MET   1           1HG      MET   1 -11.966   4.089   2.793
    9    HE1  MET   1           2HE      MET   1 -14.561   6.003   0.504
   10    HE2  MET   1           3HE      MET   1 -14.853   5.313   2.100
   11    HE3  MET   1           1HE      MET   1 -13.897   4.423   0.916
   12    H    THR   2           HN       THR   2 -13.624   1.745   2.527
   13    HA   THR   2           HA       THR   2 -11.871   0.216   4.307
   14    HB   THR   2           HB       THR   2 -12.049  -1.571   2.587
   15    HG1  THR   2           1HG      THR   2 -14.009   0.129   1.391
   16   HG21  THR   2          3HG2      THR   2 -13.599  -1.542   4.483
   17   HG22  THR   2          1HG2      THR   2 -14.403  -2.139   3.031
   18   HG23  THR   2          2HG2      THR   2 -14.694  -0.494   3.586
   19    H    PHE   3           HN       PHE   3  -9.979  -0.873   3.163
   20    HA   PHE   3           HA       PHE   3  -8.190   1.148   2.386
   21    HB2  PHE   3           2HB      PHE   3  -7.530  -0.989   3.464
   22    HB3  PHE   3           1HB      PHE   3  -7.908  -1.835   1.967
   23    HD1  PHE   3           2HD      PHE   3  -5.734   0.819   3.385
   24    HD2  PHE   3           1HD      PHE   3  -6.298  -2.054   0.296
   25    HE1  PHE   3           2HE      PHE   3  -3.445   1.234   2.581
   26    HE2  PHE   3           1HE      PHE   3  -4.012  -1.641  -0.511
   27    HZ   PHE   3           HZ       PHE   3  -2.580   0.003   0.631
   28    H    SER   4           HN       SER   4  -9.933  -1.291   0.497
   29    HA   SER   4           HA       SER   4  -8.775  -0.724  -1.998
   30    HB2  SER   4           2HB      SER   4 -11.593  -1.680  -1.448
   31    HB3  SER   4           1HB      SER   4 -10.718  -1.840  -2.970
   32    HG   SER   4           HG       SER   4 -10.129  -3.067  -0.485
   33    H    GLU   5           HN       GLU   5 -11.698   0.599  -0.473
   34    HA   GLU   5           HA       GLU   5 -12.523   2.241  -2.581
   35    HB2  GLU   5           2HB      GLU   5 -12.908   2.503   0.399
   36    HB3  GLU   5           1HB      GLU   5 -13.743   3.490  -0.784
   37    HG2  GLU   5           2HG      GLU   5 -14.844   1.557  -1.694
   38    HG3  GLU   5           1HG      GLU   5 -13.919   0.497  -0.634
   39    H    CYS   6           HN       CYS   6 -10.486   2.920   0.228
   40    HA   CYS   6           HA       CYS   6 -10.132   5.673  -0.262
   41    HB2  CYS   6           2HB      CYS   6  -9.640   4.375   1.877
   42    HB3  CYS   6           1HB      CYS   6  -8.138   3.880   1.115
   43    HG   CYS   6           HG       CYS   6  -7.678   6.829   0.637
   44    H    ALA   7           HN       ALA   7  -8.114   2.866  -1.021
   45    HA   ALA   7           HA       ALA   7  -6.024   4.157  -2.328
   46    HB1  ALA   7           1HB      ALA   7  -5.604   2.039  -3.458
   47    HB2  ALA   7           2HB      ALA   7  -7.213   1.470  -3.017
   48    HB3  ALA   7           3HB      ALA   7  -6.010   1.766  -1.764
   49    H    ALA   8           HN       ALA   8  -9.085   2.950  -3.638
   50    HA   ALA   8           HA       ALA   8  -8.671   3.669  -6.304
   51    HB1  ALA   8           1HB      ALA   8 -11.282   3.555  -4.800
   52    HB2  ALA   8           2HB      ALA   8 -10.481   2.194  -5.588
   53    HB3  ALA   8           3HB      ALA   8 -11.093   3.540  -6.553
   54    H    LEU   9           HN       LEU   9 -10.029   5.537  -3.608
   55    HA   LEU   9           HA       LEU   9 -10.828   7.792  -5.081
   56    HB2  LEU   9           2HB      LEU   9  -9.923   7.562  -2.211
   57    HB3  LEU   9           1HB      LEU   9 -10.627   9.006  -2.901
   58    HG   LEU   9           HG       LEU   9 -12.028   6.343  -2.678
   59   HD11  LEU   9          1HD1      LEU   9 -11.690   7.375  -0.502
   60   HD12  LEU   9          2HD1      LEU   9 -13.386   7.476  -0.979
   61   HD13  LEU   9          3HD1      LEU   9 -12.346   8.897  -1.105
   62   HD21  LEU   9          3HD2      LEU   9 -12.761   7.664  -4.600
   63   HD22  LEU   9          1HD2      LEU   9 -13.032   9.050  -3.542
   64   HD23  LEU   9          2HD2      LEU   9 -14.009   7.594  -3.352
   65    H    TYR  10           HN       TYR  10  -7.778   7.066  -3.430
   66    HA   TYR  10           HA       TYR  10  -6.404   9.437  -3.983
   67    HB2  TYR  10           2HB      TYR  10  -5.536   7.753  -2.446
   68    HB3  TYR  10           1HB      TYR  10  -5.361   6.601  -3.761
   69    HD1  TYR  10           2HD      TYR  10  -4.054   9.771  -2.381
   70    HD2  TYR  10           1HD      TYR  10  -3.427   6.593  -5.126
   71    HE1  TYR  10           2HE      TYR  10  -1.749  10.547  -2.740
   72    HE2  TYR  10           1HE      TYR  10  -1.120   7.352  -5.493
   73    HH   TYR  10           HH       TYR  10   0.229   9.353  -5.279
   74    H    ILE  11           HN       ILE  11  -6.616   6.430  -5.801
   75    HA   ILE  11           HA       ILE  11  -5.015   7.131  -7.983
   76    HB   ILE  11           HB       ILE  11  -7.362   5.237  -7.828
   77   HG12  ILE  11          2HG1      ILE  11  -4.394   4.677  -7.794
   78   HG13  ILE  11          1HG1      ILE  11  -5.386   4.801  -6.347
   79   HG21  ILE  11          1HG2      ILE  11  -6.994   5.858 -10.144
   80   HG22  ILE  11          2HG2      ILE  11  -6.459   4.201  -9.866
   81   HG23  ILE  11          3HG2      ILE  11  -5.273   5.500  -9.988
   82   HD11  ILE  11          3HD1      ILE  11  -5.008   2.490  -6.962
   83   HD12  ILE  11          1HD1      ILE  11  -5.720   2.782  -8.550
   84   HD13  ILE  11          2HD1      ILE  11  -6.717   2.904  -7.101
   85    H    LYS  12           HN       LYS  12  -8.537   7.399  -7.558
   86    HA   LYS  12           HA       LYS  12  -9.112   8.480 -10.088
   87    HB2  LYS  12           2HB      LYS  12 -10.567   8.794  -7.458
   88    HB3  LYS  12           1HB      LYS  12 -11.220   9.275  -9.016
   89    HG2  LYS  12           2HG      LYS  12 -11.340   7.036  -9.762
   90    HG3  LYS  12           1HG      LYS  12 -10.371   6.458  -8.404
   91    HD2  LYS  12           2HD      LYS  12 -12.161   7.126  -6.859
   92    HD3  LYS  12           1HD      LYS  12 -13.127   7.678  -8.229
   93    HE2  LYS  12           2HE      LYS  12 -13.202   5.418  -9.116
   94    HE3  LYS  12           1HE      LYS  12 -12.173   4.847  -7.803
   95    HZ1  LYS  12           3HZ      LYS  12 -14.829   6.105  -7.378
   96    HZ2  LYS  12           1HZ      LYS  12 -13.880   5.297  -6.226
   97    HZ3  LYS  12           2HZ      LYS  12 -14.596   4.428  -7.498
   98    H    ALA  13           HN       ALA  13  -8.207  10.006  -7.044
   99    HA   ALA  13           HA       ALA  13  -8.844  12.654  -7.818
  100    HB1  ALA  13           1HB      ALA  13  -7.593  13.333  -5.844
  101    HB2  ALA  13           2HB      ALA  13  -6.915  11.712  -5.702
  102    HB3  ALA  13           3HB      ALA  13  -8.646  11.965  -5.480
  103    H    HIS  14           HN       HIS  14  -6.085  10.639  -8.454
  104    HA   HIS  14           HA       HIS  14  -4.670  13.000  -9.529
  105    HB2  HIS  14           2HB      HIS  14  -3.737  11.789  -7.411
  106    HB3  HIS  14           1HB      HIS  14  -3.212  10.557  -8.554
  107    HD1  HIS  14           1HD      HIS  14  -0.980  10.939  -9.594
  108    HD2  HIS  14           2HD      HIS  14  -2.622  14.441  -8.066
  109    HE1  HIS  14           1HE      HIS  14   0.814  12.687  -9.828
  110    HE2  HIS  14           2HE      HIS  14  -0.221  14.816  -8.961
  111    H    ARG  15           HN       ARG  15  -6.515  10.945 -10.767
  112    HA   ARG  15           HA       ARG  15  -4.862   9.185 -12.301
  113    HB2  ARG  15           2HB      ARG  15  -6.875   8.353 -13.247
  114    HB3  ARG  15           1HB      ARG  15  -7.220   8.691 -11.558
  115    HG2  ARG  15           2HG      ARG  15  -8.177  10.897 -12.339
  116    HG3  ARG  15           1HG      ARG  15  -8.062  10.256 -13.975
  117    HD2  ARG  15           2HD      ARG  15  -9.727   9.261 -11.684
  118    HD3  ARG  15           1HD      ARG  15 -10.270   9.829 -13.258
  119    HE   ARG  15           HE       ARG  15  -8.613   7.516 -13.499
  120   HH11  ARG  15          1HH1      ARG  15 -11.879   8.616 -12.863
  121   HH12  ARG  15          2HH1      ARG  15 -12.592   7.047 -13.092
  122   HH21  ARG  15          1HH2      ARG  15  -9.556   5.443 -13.809
  123   HH22  ARG  15          2HH2      ARG  15 -11.275   5.260 -13.635
  124    H    SER  16           HN       SER  16  -6.355  12.311 -12.824
  125    HA   SER  16           HA       SER  16  -5.998  12.399 -15.629
  126    HB2  SER  16           2HB      SER  16  -6.228  14.663 -13.638
  127    HB3  SER  16           1HB      SER  16  -6.502  14.763 -15.370
  128    HG   SER  16           HG       SER  16  -8.493  14.295 -14.879
  129    H    SER  17           HN       SER  17  -3.912  12.897 -12.939
  130    HA   SER  17           HA       SER  17  -1.925  14.385 -14.392
  131    HB2  SER  17           2HB      SER  17  -2.334  14.443 -11.862
  132    HB3  SER  17           1HB      SER  17  -1.505  12.890 -11.804
  133    HG   SER  17           HG       SER  17  -0.466  15.351 -11.920
  134    H    TRP  18           HN       TRP  18  -2.731  11.075 -13.829
  135    HA   TRP  18           HA       TRP  18  -0.204  10.113 -14.941
  136    HB2  TRP  18           2HB      TRP  18  -2.606   8.570 -13.927
  137    HB3  TRP  18           1HB      TRP  18  -1.083   7.861 -14.449
  138    HD1  TRP  18           1HD      TRP  18   0.866   9.887 -12.857
  139    HE1  TRP  18           1HE      TRP  18   1.054   9.662 -10.291
  140    HE3  TRP  18           3HE      TRP  18  -3.503   7.389 -11.945
  141    HZ2  TRP  18           2HZ      TRP  18  -0.460   8.568  -8.176
  142    HZ3  TRP  18           3HZ      TRP  18  -4.056   6.789  -9.626
  143    HH2  TRP  18           2HH      TRP  18  -2.567   7.367  -7.779
  144    H    LYS  19           HN       LYS  19  -1.448  11.614 -16.756
  145    HA   LYS  19           HA       LYS  19  -2.767   9.737 -18.580
  146    HB2  LYS  19           2HB      LYS  19  -4.188  11.672 -17.449
  147    HB3  LYS  19           1HB      LYS  19  -3.385  12.668 -18.654
  148    HG2  LYS  19           2HG      LYS  19  -5.475  12.031 -19.559
  149    HG3  LYS  19           1HG      LYS  19  -4.245  11.079 -20.397
  150    HD2  LYS  19           2HD      LYS  19  -4.708   9.196 -18.878
  151    HD3  LYS  19           1HD      LYS  19  -5.979  10.151 -18.110
  152    HE2  LYS  19           2HE      LYS  19  -7.134  10.299 -20.293
  153    HE3  LYS  19           1HE      LYS  19  -5.895   9.249 -20.985
  154    HZ1  LYS  19           3HZ      LYS  19  -6.535   7.596 -19.240
  155    HZ2  LYS  19           1HZ      LYS  19  -7.716   7.884 -20.424
  156    HZ3  LYS  19           2HZ      LYS  19  -7.869   8.575 -18.883
  157    H    ASN  20           HN       ASN  20  -0.480  10.484 -20.899
  158    HA   ASN  20           HA       ASN  20  -2.875   9.174 -19.861
  159    HB2  ASN  20           2HB      ASN  20  -3.205  10.090 -22.122
  160    HB3  ASN  20           1HB      ASN  20  -1.815   9.177 -22.699
  161   HD21  ASN  20          1HD2      ASN  20  -2.823   7.896 -24.135
  162   HD22  ASN  20          2HD2      ASN  20  -4.025   6.719 -23.716
  163    H    THR  21           HN       THR  21  -1.744   7.852 -18.439
  164    HA   THR  21           HA       THR  21  -0.294   5.668 -19.756
  165    HB   THR  21           HB       THR  21   1.122   5.546 -17.614
  166    HG1  THR  21           1HG      THR  21   0.386   8.296 -17.478
  167   HG21  THR  21          3HG2      THR  21   1.516   7.854 -19.521
  168   HG22  THR  21          1HG2      THR  21   2.037   6.190 -19.787
  169   HG23  THR  21          2HG2      THR  21   2.760   7.145 -18.493
  170    H    LYS  22           HN       LYS  22  -0.228   3.675 -18.437
  171    HA   LYS  22           HA       LYS  22  -2.794   3.336 -17.087
  172    HB2  LYS  22           2HB      LYS  22  -0.819   1.394 -18.249
  173    HB3  LYS  22           1HB      LYS  22  -2.157   0.882 -17.233
  174    HG2  LYS  22           2HG      LYS  22  -3.720   1.960 -18.831
  175    HG3  LYS  22           1HG      LYS  22  -2.342   2.316 -19.875
  176    HD2  LYS  22           2HD      LYS  22  -3.476   0.299 -20.622
  177    HD3  LYS  22           1HD      LYS  22  -1.861  -0.091 -20.028
  178    HE2  LYS  22           2HE      LYS  22  -3.399  -1.739 -19.207
  179    HE3  LYS  22           1HE      LYS  22  -2.876  -0.735 -17.857
  180    HZ1  LYS  22           3HZ      LYS  22  -5.470  -0.606 -19.296
  181    HZ2  LYS  22           1HZ      LYS  22  -4.964   0.559 -18.168
  182    HZ3  LYS  22           2HZ      LYS  22  -5.209  -1.043 -17.675
  183    H    HIS  23           HN       HIS  23  -0.542   4.636 -15.764
  184    HA   HIS  23           HA       HIS  23   0.515   2.930 -13.779
  185    HB2  HIS  23           2HB      HIS  23   0.057   5.914 -13.821
  186    HB3  HIS  23           1HB      HIS  23   0.740   5.095 -12.422
  187    HD1  HIS  23           1HD      HIS  23   3.139   4.036 -12.726
  188    HD2  HIS  23           2HD      HIS  23   1.792   6.333 -15.925
  189    HE1  HIS  23           1HE      HIS  23   5.172   4.506 -14.131
  190    HE2  HIS  23           2HE      HIS  23   4.323   5.818 -16.112
  191    H    ALA  24           HN       ALA  24  -2.462   4.813 -13.969
  192    HA   ALA  24           HA       ALA  24  -3.390   4.368 -11.357
  193    HB1  ALA  24           1HB      ALA  24  -5.597   4.935 -12.230
  194    HB2  ALA  24           2HB      ALA  24  -4.999   4.757 -13.881
  195    HB3  ALA  24           3HB      ALA  24  -4.366   6.040 -12.846
  196    H    ASP  25           HN       ASP  25  -3.664   2.489 -14.315
  197    HA   ASP  25           HA       ASP  25  -5.339   0.429 -13.380
  198    HB2  ASP  25           2HB      ASP  25  -4.750   0.759 -15.768
  199    HB3  ASP  25           1HB      ASP  25  -3.098   0.266 -15.417
  200    H    GLN  26           HN       GLN  26  -1.801   0.682 -13.532
  201    HA   GLN  26           HA       GLN  26  -1.216  -1.800 -12.409
  202    HB2  GLN  26           2HB      GLN  26   0.345   0.769 -12.568
  203    HB3  GLN  26           1HB      GLN  26   1.020  -0.704 -11.898
  204    HG2  GLN  26           2HG      GLN  26  -0.077  -0.448 -14.684
  205    HG3  GLN  26           1HG      GLN  26   1.626  -0.307 -14.259
  206   HE21  GLN  26          1HE2      GLN  26   2.215  -2.057 -15.519
  207   HE22  GLN  26          2HE2      GLN  26   1.831  -3.683 -15.084
  208    H    TRP  27           HN       TRP  27  -1.712   1.351 -10.859
  209    HA   TRP  27           HA       TRP  27  -0.988   0.639  -8.252
  210    HB2  TRP  27           2HB      TRP  27  -2.820   2.686  -9.424
  211    HB3  TRP  27           1HB      TRP  27  -2.900   2.393  -7.691
  212    HD1  TRP  27           1HD      TRP  27  -0.203   3.308 -10.332
  213    HE1  TRP  27           1HE      TRP  27   1.509   4.875  -9.211
  214    HE3  TRP  27           3HE      TRP  27  -2.121   3.311  -5.600
  215    HZ2  TRP  27           2HZ      TRP  27   1.971   5.968  -6.636
  216    HZ3  TRP  27           3HZ      TRP  27  -0.994   4.638  -3.865
  217    HH2  TRP  27           2HH      TRP  27   1.009   5.939  -4.372
  218    H    THR  28           HN       THR  28  -4.160   0.496  -9.831
  219    HA   THR  28           HA       THR  28  -5.509  -0.671  -7.622
  220    HB   THR  28           HB       THR  28  -6.348  -0.912 -10.514
  221    HG1  THR  28           1HG      THR  28  -5.965   1.269 -10.242
  222   HG21  THR  28          3HG2      THR  28  -7.678  -2.153  -8.866
  223   HG22  THR  28          1HG2      THR  28  -8.603  -0.830  -9.579
  224   HG23  THR  28          2HG2      THR  28  -7.933  -0.664  -7.955
  225    H    ASN  29           HN       ASN  29  -4.084  -1.955 -10.575
  226    HA   ASN  29           HA       ASN  29  -5.117  -4.534 -10.516
  227    HB2  ASN  29           2HB      ASN  29  -3.744  -3.173 -12.301
  228    HB3  ASN  29           1HB      ASN  29  -2.368  -3.992 -11.577
  229   HD21  ASN  29          1HD2      ASN  29  -3.599  -4.135 -14.246
  230   HD22  ASN  29          2HD2      ASN  29  -3.926  -5.824 -14.513
  231    H    THR  30           HN       THR  30  -2.069  -3.306  -9.128
  232    HA   THR  30           HA       THR  30  -1.164  -5.872  -8.282
  233    HB   THR  30           HB       THR  30  -0.333  -3.239  -7.061
  234    HG1  THR  30           1HG      THR  30  -0.059  -4.059  -9.620
  235   HG21  THR  30          3HG2      THR  30   0.466  -5.235  -5.914
  236   HG22  THR  30          1HG2      THR  30   1.799  -4.415  -6.726
  237   HG23  THR  30          2HG2      THR  30   1.098  -5.870  -7.432
  238    H    ILE  31           HN       ILE  31  -2.702  -3.155  -6.579
  239    HA   ILE  31           HA       ILE  31  -2.644  -4.348  -4.026
  240    HB   ILE  31           HB       ILE  31  -4.430  -2.158  -5.100
  241   HG12  ILE  31          2HG1      ILE  31  -1.911  -2.051  -3.423
  242   HG13  ILE  31          1HG1      ILE  31  -2.011  -1.664  -5.138
  243   HG21  ILE  31          1HG2      ILE  31  -4.851  -1.577  -2.755
  244   HG22  ILE  31          2HG2      ILE  31  -3.941  -2.997  -2.246
  245   HG23  ILE  31          3HG2      ILE  31  -5.446  -3.193  -3.140
  246   HD11  ILE  31          3HD1      ILE  31  -3.515   0.197  -4.614
  247   HD12  ILE  31          1HD1      ILE  31  -1.958   0.349  -3.797
  248   HD13  ILE  31          2HD1      ILE  31  -3.377  -0.190  -2.899
  249    H    LYS  32           HN       LYS  32  -5.096  -4.279  -6.561
  250    HA   LYS  32           HA       LYS  32  -7.201  -5.485  -5.176
  251    HB2  LYS  32           2HB      LYS  32  -7.308  -4.435  -7.460
  252    HB3  LYS  32           1HB      LYS  32  -6.505  -5.861  -8.095
  253    HG2  LYS  32           2HG      LYS  32  -8.380  -7.247  -7.389
  254    HG3  LYS  32           1HG      LYS  32  -9.195  -5.821  -6.739
  255    HD2  LYS  32           2HD      LYS  32  -9.209  -4.829  -8.988
  256    HD3  LYS  32           1HD      LYS  32  -8.423  -6.277  -9.620
  257    HE2  LYS  32           2HE      LYS  32 -10.356  -7.614  -8.886
  258    HE3  LYS  32           1HE      LYS  32 -11.142  -6.140  -8.323
  259    HZ1  LYS  32           3HZ      LYS  32 -10.386  -6.770 -11.126
  260    HZ2  LYS  32           1HZ      LYS  32 -11.056  -5.297 -10.611
  261    HZ3  LYS  32           2HZ      LYS  32 -11.958  -6.731 -10.494
  262    H    THR  33           HN       THR  33  -4.386  -6.850  -6.762
  263    HA   THR  33           HA       THR  33  -5.375  -9.554  -6.613
  264    HB   THR  33           HB       THR  33  -2.657  -8.476  -7.385
  265    HG1  THR  33           1HG      THR  33  -4.008  -7.839  -8.965
  266   HG21  THR  33          3HG2      THR  33  -2.281 -10.670  -8.405
  267   HG22  THR  33          1HG2      THR  33  -3.825 -11.236  -7.776
  268   HG23  THR  33          2HG2      THR  33  -2.522 -10.814  -6.666
  269    H    TYR  34           HN       TYR  34  -2.635  -7.795  -5.108
  270    HA   TYR  34           HA       TYR  34  -2.039 -10.084  -3.457
  271    HB2  TYR  34           2HB      TYR  34  -0.801  -7.344  -3.640
  272    HB3  TYR  34           1HB      TYR  34  -0.251  -8.574  -2.507
  273    HD1  TYR  34           1HD      TYR  34   0.649 -10.749  -3.413
  274    HD2  TYR  34           2HD      TYR  34  -0.134  -7.394  -5.911
  275    HE1  TYR  34           1HE      TYR  34   2.079 -11.724  -5.159
  276    HE2  TYR  34           2HE      TYR  34   1.293  -8.364  -7.664
  277    HH   TYR  34           HH       TYR  34   2.332 -11.567  -7.639
  278    H    CYS  35           HN       CYS  35  -3.222  -6.785  -2.829
  279    HA   CYS  35           HA       CYS  35  -3.338  -7.350   0.011
  280    HB2  CYS  35           2HB      CYS  35  -4.126  -4.859  -1.512
  281    HB3  CYS  35           1HB      CYS  35  -3.974  -4.994   0.239
  282    HG   CYS  35           HG       CYS  35  -1.132  -5.896  -0.366
  283    H    GLY  36           HN       GLY  36  -5.483  -7.152  -2.688
  284    HA2  GLY  36           2HA      GLY  36  -7.933  -6.561  -1.681
  285    HA3  GLY  36           1HA      GLY  36  -7.678  -7.750  -2.942
  286    HA   PRO  37           HA       PRO  37  -9.039 -11.196  -0.638
  287    HB2  PRO  37           2HB      PRO  37  -6.297 -12.278  -0.235
  288    HB3  PRO  37           1HB      PRO  37  -7.727 -13.056  -0.919
  289    HG2  PRO  37           2HG      PRO  37  -5.772 -12.232  -2.508
  290    HG3  PRO  37           1HG      PRO  37  -7.467 -12.018  -2.984
  291    HD2  PRO  37           2HD      PRO  37  -5.530 -10.007  -1.916
  292    HD3  PRO  37           1HD      PRO  37  -6.768  -9.825  -3.175
  293    H    VAL  38           HN       VAL  38  -6.559  -9.310   0.908
  294    HA   VAL  38           HA       VAL  38  -7.357 -10.480   3.493
  295    HB   VAL  38           HB       VAL  38  -4.706  -9.155   2.922
  296   HG11  VAL  38          1HG1      VAL  38  -4.041 -10.133   5.076
  297   HG12  VAL  38          2HG1      VAL  38  -5.682 -10.744   5.296
  298   HG13  VAL  38          3HG1      VAL  38  -5.386  -9.006   5.252
  299   HG21  VAL  38          3HG2      VAL  38  -4.883 -11.237   1.665
  300   HG22  VAL  38          1HG2      VAL  38  -5.345 -12.096   3.134
  301   HG23  VAL  38          2HG2      VAL  38  -3.733 -11.398   2.992
  302    H    ILE  39           HN       ILE  39  -5.636  -7.481   2.574
  303    HA   ILE  39           HA       ILE  39  -7.131  -6.136   4.691
  304    HB   ILE  39           HB       ILE  39  -5.484  -4.309   4.448
  305   HG12  ILE  39          2HG1      ILE  39  -4.166  -6.150   2.436
  306   HG13  ILE  39          1HG1      ILE  39  -4.974  -4.636   2.051
  307   HG21  ILE  39          1HG2      ILE  39  -3.574  -5.544   5.368
  308   HG22  ILE  39          2HG2      ILE  39  -4.296  -7.056   4.815
  309   HG23  ILE  39          3HG2      ILE  39  -5.104  -6.093   6.053
  310   HD11  ILE  39          3HD1      ILE  39  -2.544  -4.406   2.093
  311   HD12  ILE  39          1HD1      ILE  39  -2.527  -4.908   3.784
  312   HD13  ILE  39          2HD1      ILE  39  -3.320  -3.403   3.320
  313    H    GLY  40           HN       GLY  40  -7.502  -6.544   1.459
  314    HA2  GLY  40           2HA      GLY  40  -8.020  -4.018   0.414
  315    HA3  GLY  40           1HA      GLY  40  -8.795  -5.496  -0.119
  316    HA   PRO  41           HA       PRO  41 -12.586  -4.187   1.695
  317    HB2  PRO  41           2HB      PRO  41 -13.181  -6.621   3.137
  318    HB3  PRO  41           1HB      PRO  41 -13.834  -6.066   1.595
  319    HG2  PRO  41           2HG      PRO  41 -12.184  -8.226   1.848
  320    HG3  PRO  41           1HG      PRO  41 -12.300  -7.242   0.378
  321    HD2  PRO  41           2HD      PRO  41 -10.236  -7.167   2.552
  322    HD3  PRO  41           1HD      PRO  41 -10.027  -7.045   0.789
  323    H    LEU  42           HN       LEU  42 -10.037  -4.627   3.716
  324    HA   LEU  42           HA       LEU  42 -11.471  -4.315   6.212
  325    HB2  LEU  42           2HB      LEU  42  -8.517  -4.169   5.595
  326    HB3  LEU  42           1HB      LEU  42  -9.205  -4.036   7.201
  327    HG   LEU  42           HG       LEU  42  -9.286  -6.461   5.410
  328   HD11  LEU  42          1HD1      LEU  42  -7.904  -7.477   7.129
  329   HD12  LEU  42          2HD1      LEU  42  -7.924  -5.974   8.053
  330   HD13  LEU  42          3HD1      LEU  42  -7.126  -6.030   6.483
  331   HD21  LEU  42          3HD2      LEU  42 -11.367  -6.238   6.686
  332   HD22  LEU  42          1HD2      LEU  42 -10.431  -6.089   8.177
  333   HD23  LEU  42          2HD2      LEU  42 -10.392  -7.595   7.257
  334    H    SER  43           HN       SER  43 -11.568  -2.434   7.431
  335    HA   SER  43           HA       SER  43 -11.869  -0.026   6.104
  336    HB2  SER  43           2HB      SER  43 -11.291  -0.427   9.039
  337    HB3  SER  43           1HB      SER  43 -12.222   0.854   8.289
  338    HG   SER  43           HG       SER  43 -13.862  -0.386   8.661
  339    H    VAL  44           HN       VAL  44 -10.554   1.754   5.829
  340    HA   VAL  44           HA       VAL  44  -7.744   1.328   5.772
  341    HB   VAL  44           HB       VAL  44  -8.995   2.837   4.220
  342   HG11  VAL  44          1HG1      VAL  44  -9.019   4.738   6.560
  343   HG12  VAL  44          2HG1      VAL  44 -10.428   3.936   5.870
  344   HG13  VAL  44          3HG1      VAL  44  -9.526   5.108   4.912
  345   HG21  VAL  44          3HG2      VAL  44  -6.692   4.112   5.689
  346   HG22  VAL  44          1HG2      VAL  44  -7.254   4.545   4.075
  347   HG23  VAL  44          2HG2      VAL  44  -6.571   2.947   4.370
  348    H    GLN  45           HN       GLN  45  -9.870   2.319   8.204
  349    HA   GLN  45           HA       GLN  45  -7.897   3.721   9.798
  350    HB2  GLN  45           2HB      GLN  45 -10.418   4.223   9.678
  351    HB3  GLN  45           1HB      GLN  45 -10.641   2.788  10.663
  352    HG2  GLN  45           2HG      GLN  45  -8.864   5.039  11.537
  353    HG3  GLN  45           1HG      GLN  45 -10.602   5.064  11.817
  354   HE21  GLN  45          1HE2      GLN  45  -8.441   5.033  13.750
  355   HE22  GLN  45          2HE2      GLN  45  -8.658   3.611  14.706
  356    H    ASP  46           HN       ASP  46  -8.980   0.536   9.243
  357    HA   ASP  46           HA       ASP  46  -8.240  -0.439  11.896
  358    HB2  ASP  46           2HB      ASP  46 -10.377  -1.138  10.735
  359    HB3  ASP  46           1HB      ASP  46  -9.377  -2.017   9.584
  360    H    VAL  47           HN       VAL  47  -7.187  -0.515   8.571
  361    HA   VAL  47           HA       VAL  47  -5.512  -2.716   8.527
  362    HB   VAL  47           HB       VAL  47  -5.086  -0.076   7.118
  363   HG11  VAL  47          1HG1      VAL  47  -3.906  -2.793   6.544
  364   HG12  VAL  47          2HG1      VAL  47  -3.033  -1.372   7.119
  365   HG13  VAL  47          3HG1      VAL  47  -3.753  -1.373   5.510
  366   HG21  VAL  47          3HG2      VAL  47  -6.160  -1.176   5.213
  367   HG22  VAL  47          1HG2      VAL  47  -7.240  -1.081   6.604
  368   HG23  VAL  47          2HG2      VAL  47  -6.448  -2.606   6.206
  369    H    ASP  48           HN       ASP  48  -4.034  -3.219   9.963
  370    HA   ASP  48           HA       ASP  48  -2.261  -1.161  11.065
  371    HB2  ASP  48           2HB      ASP  48  -2.908  -3.975  11.914
  372    HB3  ASP  48           1HB      ASP  48  -1.482  -3.147  12.518
  373    H    THR  49           HN       THR  49   0.026  -1.988  11.478
  374    HA   THR  49           HA       THR  49   1.303  -2.756   9.074
  375    HB   THR  49           HB       THR  49   2.506  -3.064  11.826
  376    HG1  THR  49           1HG      THR  49   2.672  -0.921  11.985
  377   HG21  THR  49          3HG2      THR  49   4.555  -2.350  10.634
  378   HG22  THR  49          1HG2      THR  49   3.636  -2.298   9.130
  379   HG23  THR  49          2HG2      THR  49   3.873  -3.832   9.968
  380    H    LYS  50           HN       LYS  50   0.265  -4.452  11.965
  381    HA   LYS  50           HA       LYS  50   1.378  -6.966  11.644
  382    HB2  LYS  50           2HB      LYS  50   0.085  -6.276  13.604
  383    HB3  LYS  50           1HB      LYS  50  -1.378  -6.207  12.638
  384    HG2  LYS  50           2HG      LYS  50  -1.001  -8.687  12.196
  385    HG3  LYS  50           1HG      LYS  50   0.176  -8.620  13.509
  386    HD2  LYS  50           2HD      LYS  50  -2.731  -7.838  13.721
  387    HD3  LYS  50           1HD      LYS  50  -2.039  -9.356  14.291
  388    HE2  LYS  50           2HE      LYS  50  -1.165  -6.636  15.259
  389    HE3  LYS  50           1HE      LYS  50  -2.388  -7.617  16.062
  390    HZ1  LYS  50           3HZ      LYS  50  -0.796  -9.291  16.522
  391    HZ2  LYS  50           1HZ      LYS  50  -0.106  -7.818  16.995
  392    HZ3  LYS  50           2HZ      LYS  50   0.380  -8.555  15.550
  393    H    LEU  51           HN       LEU  51  -1.633  -5.692  10.330
  394    HA   LEU  51           HA       LEU  51  -2.501  -8.065   9.089
  395    HB2  LEU  51           2HB      LEU  51  -3.149  -5.193   8.429
  396    HB3  LEU  51           1HB      LEU  51  -4.049  -6.586   7.880
  397    HG   LEU  51           HG       LEU  51  -3.788  -5.632  10.722
  398   HD11  LEU  51          1HD1      LEU  51  -6.161  -5.196  10.573
  399   HD12  LEU  51          2HD1      LEU  51  -6.189  -5.790   8.913
  400   HD13  LEU  51          3HD1      LEU  51  -5.306  -4.317   9.305
  401   HD21  LEU  51          3HD2      LEU  51  -5.344  -7.437  11.284
  402   HD22  LEU  51          1HD2      LEU  51  -3.815  -8.060  10.663
  403   HD23  LEU  51          2HD2      LEU  51  -5.245  -8.033   9.626
  404    H    ILE  52           HN       ILE  52  -0.611  -5.327   7.953
  405    HA   ILE  52           HA       ILE  52  -0.503  -6.141   5.237
  406    HB   ILE  52           HB       ILE  52   1.242  -4.246   6.809
  407   HG12  ILE  52          2HG1      ILE  52  -1.006  -3.763   4.842
  408   HG13  ILE  52          1HG1      ILE  52  -1.146  -3.637   6.592
  409   HG21  ILE  52          1HG2      ILE  52   1.153  -4.759   3.839
  410   HG22  ILE  52          2HG2      ILE  52   2.520  -5.018   4.926
  411   HG23  ILE  52          3HG2      ILE  52   1.952  -3.381   4.597
  412   HD11  ILE  52          3HD1      ILE  52   0.575  -1.922   4.819
  413   HD12  ILE  52          1HD1      ILE  52   0.465  -1.798   6.574
  414   HD13  ILE  52          2HD1      ILE  52  -0.946  -1.455   5.577
  415    H    MET  53           HN       MET  53   1.513  -6.780   8.053
  416    HA   MET  53           HA       MET  53   3.772  -7.870   6.852
  417    HB2  MET  53           2HB      MET  53   2.387  -8.706   9.407
  418    HB3  MET  53           1HB      MET  53   3.978  -9.267   8.925
  419    HG2  MET  53           2HG      MET  53   4.843  -7.012   9.040
  420    HG3  MET  53           1HG      MET  53   3.238  -6.397   9.433
  421    HE1  MET  53           3HE      MET  53   5.831  -5.756  11.184
  422    HE2  MET  53           1HE      MET  53   5.176  -5.956  12.811
  423    HE3  MET  53           2HE      MET  53   4.217  -5.152  11.565
  424    H    LYS  54           HN       LYS  54   0.679  -9.397   7.626
  425    HA   LYS  54           HA       LYS  54   1.423 -12.021   6.915
  426    HB2  LYS  54           2HB      LYS  54  -1.328 -10.768   6.909
  427    HB3  LYS  54           1HB      LYS  54  -0.983 -12.492   6.899
  428    HG2  LYS  54           2HG      LYS  54   0.121 -12.251   9.094
  429    HG3  LYS  54           1HG      LYS  54  -0.337 -10.547   9.105
  430    HD2  LYS  54           2HD      LYS  54  -1.920 -11.832  10.413
  431    HD3  LYS  54           1HD      LYS  54  -2.709 -11.206   8.963
  432    HE2  LYS  54           2HE      LYS  54  -3.347 -13.525   9.399
  433    HE3  LYS  54           1HE      LYS  54  -2.463 -13.379   7.882
  434    HZ1  LYS  54           3HZ      LYS  54  -0.458 -14.131   9.044
  435    HZ2  LYS  54           1HZ      LYS  54  -1.697 -15.284   9.128
  436    HZ3  LYS  54           2HZ      LYS  54  -1.348 -14.320  10.472
  437    H    VAL  55           HN       VAL  55   0.059  -9.360   5.077
  438    HA   VAL  55           HA       VAL  55  -0.514 -10.838   2.715
  439    HB   VAL  55           HB       VAL  55   0.017  -7.873   2.979
  440   HG11  VAL  55          1HG1      VAL  55  -1.489  -9.426   0.877
  441   HG12  VAL  55          2HG1      VAL  55   0.087  -8.659   0.676
  442   HG13  VAL  55          3HG1      VAL  55  -1.347  -7.669   0.959
  443   HG21  VAL  55          3HG2      VAL  55  -2.420  -7.629   3.175
  444   HG22  VAL  55          1HG2      VAL  55  -1.739  -8.556   4.514
  445   HG23  VAL  55          2HG2      VAL  55  -2.583  -9.385   3.205
  446    H    LEU  56           HN       LEU  56   2.266  -9.026   3.873
  447    HA   LEU  56           HA       LEU  56   3.628  -9.072   1.351
  448    HB2  LEU  56           2HB      LEU  56   4.535  -8.290   4.112
  449    HB3  LEU  56           1HB      LEU  56   5.547  -8.165   2.688
  450    HG   LEU  56           HG       LEU  56   2.966  -6.681   3.176
  451   HD11  LEU  56          1HD1      LEU  56   5.829  -5.752   3.051
  452   HD12  LEU  56          2HD1      LEU  56   4.826  -5.858   4.496
  453   HD13  LEU  56          3HD1      LEU  56   4.415  -4.713   3.222
  454   HD21  LEU  56          3HD2      LEU  56   4.853  -6.585   0.820
  455   HD22  LEU  56          1HD2      LEU  56   3.490  -5.497   1.086
  456   HD23  LEU  56          2HD2      LEU  56   3.207  -7.216   0.814
  457    H    ASP  57           HN       ASP  57   3.432 -11.199   4.037
  458    HA   ASP  57           HA       ASP  57   5.882 -12.360   4.270
  459    HB2  ASP  57           2HB      ASP  57   3.780 -12.958   5.540
  460    HB3  ASP  57           1HB      ASP  57   3.362 -14.006   4.209
  461    HA   PRO  58           HA       PRO  58   5.187 -15.497   0.694
  462    HB2  PRO  58           2HB      PRO  58   3.154 -15.082  -1.049
  463    HB3  PRO  58           1HB      PRO  58   2.970 -16.036   0.427
  464    HG2  PRO  58           2HG      PRO  58   2.199 -13.193  -0.102
  465    HG3  PRO  58           1HG      PRO  58   1.301 -14.454   0.764
  466    HD2  PRO  58           2HD      PRO  58   2.716 -12.517   2.033
  467    HD3  PRO  58           1HD      PRO  58   2.495 -14.140   2.707
  468    H    ILE  59           HN       ILE  59   4.963 -12.109   0.403
  469    HA   ILE  59           HA       ILE  59   5.812 -12.035  -2.377
  470    HB   ILE  59           HB       ILE  59   5.509  -9.736  -0.435
  471   HG12  ILE  59          2HG1      ILE  59   3.557 -10.814  -2.480
  472   HG13  ILE  59          1HG1      ILE  59   3.393 -10.961  -0.735
  473   HG21  ILE  59          1HG2      ILE  59   5.383  -8.364  -2.466
  474   HG22  ILE  59          2HG2      ILE  59   5.677  -9.799  -3.446
  475   HG23  ILE  59          3HG2      ILE  59   6.926  -9.213  -2.347
  476   HD11  ILE  59          3HD1      ILE  59   3.381  -8.386  -2.294
  477   HD12  ILE  59          1HD1      ILE  59   3.206  -8.537  -0.546
  478   HD13  ILE  59          2HD1      ILE  59   1.972  -9.200  -1.617
  479    H    TRP  60           HN       TRP  60   7.141 -11.543   0.849
  480    HA   TRP  60           HA       TRP  60   9.630 -10.453   0.165
  481    HB2  TRP  60           2HB      TRP  60   8.901 -12.292   2.452
  482    HB3  TRP  60           1HB      TRP  60  10.449 -11.477   2.307
  483    HD1  TRP  60           1HD      TRP  60   7.268 -11.103   3.991
  484    HE1  TRP  60           1HE      TRP  60   6.899  -8.691   4.793
  485    HE3  TRP  60           3HE      TRP  60  10.902  -8.773   1.252
  486    HZ2  TRP  60           2HZ      TRP  60   7.996  -6.132   4.324
  487    HZ3  TRP  60           3HZ      TRP  60  11.176  -6.337   1.486
  488    HH2  TRP  60           2HH      TRP  60   9.751  -5.046   2.990
  489    H    GLU  61           HN       GLU  61   8.450 -13.723  -0.012
  490    HA   GLU  61           HA       GLU  61  10.957 -15.012  -0.196
  491    HB2  GLU  61           2HB      GLU  61   8.174 -15.830  -1.012
  492    HB3  GLU  61           1HB      GLU  61   9.559 -16.893  -1.053
  493    HG2  GLU  61           2HG      GLU  61   9.842 -16.581   1.375
  494    HG3  GLU  61           1HG      GLU  61   8.377 -15.598   1.380
  495    H    GLN  62           HN       GLN  62   8.807 -13.484  -2.466
  496    HA   GLN  62           HA       GLN  62  10.197 -14.638  -4.748
  497    HB2  GLN  62           2HB      GLN  62   7.801 -12.795  -4.620
  498    HB3  GLN  62           1HB      GLN  62   8.433 -13.545  -6.074
  499    HG2  GLN  62           2HG      GLN  62   7.305 -15.026  -3.713
  500    HG3  GLN  62           1HG      GLN  62   6.430 -14.663  -5.199
  501   HE21  GLN  62          1HE2      GLN  62   6.081 -16.765  -5.748
  502   HE22  GLN  62          2HE2      GLN  62   7.346 -17.849  -6.234
  503    H    LYS  63           HN       LYS  63   9.224 -11.394  -3.637
  504    HA   LYS  63           HA       LYS  63  11.555 -10.230  -4.945
  505    HB2  LYS  63           2HB      LYS  63   8.717  -9.517  -5.711
  506    HB3  LYS  63           1HB      LYS  63  10.147  -8.635  -6.221
  507    HG2  LYS  63           2HG      LYS  63  10.929 -10.518  -7.487
  508    HG3  LYS  63           1HG      LYS  63   9.630 -11.532  -6.856
  509    HD2  LYS  63           2HD      LYS  63   7.988 -10.046  -7.956
  510    HD3  LYS  63           1HD      LYS  63   9.324  -9.117  -8.642
  511    HE2  LYS  63           2HE      LYS  63  10.104 -11.088  -9.833
  512    HE3  LYS  63           1HE      LYS  63   8.822 -12.057  -9.109
  513    HZ1  LYS  63           3HZ      LYS  63   8.322 -11.338 -11.387
  514    HZ2  LYS  63           1HZ      LYS  63   8.378  -9.721 -10.892
  515    HZ3  LYS  63           2HZ      LYS  63   7.186 -10.760 -10.276
  516    HA   PRO  64           HA       PRO  64  10.620  -8.230  -0.883
  517    HB2  PRO  64           2HB      PRO  64  13.483  -7.538  -1.266
  518    HB3  PRO  64           1HB      PRO  64  12.663  -8.190   0.158
  519    HG2  PRO  64           2HG      PRO  64  14.233  -9.741  -1.331
  520    HG3  PRO  64           1HG      PRO  64  12.727 -10.371  -0.639
  521    HD2  PRO  64           2HD      PRO  64  13.311  -9.514  -3.444
  522    HD3  PRO  64           1HD      PRO  64  12.334 -10.879  -2.858
  523    H    GLU  65           HN       GLU  65  12.409  -6.994  -3.681
  524    HA   GLU  65           HA       GLU  65  12.196  -4.269  -3.053
  525    HB2  GLU  65           2HB      GLU  65  12.602  -5.761  -5.631
  526    HB3  GLU  65           1HB      GLU  65  12.600  -4.020  -5.541
  527    HG2  GLU  65           2HG      GLU  65  14.859  -4.814  -5.551
  528    HG3  GLU  65           1HG      GLU  65  14.494  -4.108  -3.978
  529    H    THR  66           HN       THR  66  10.142  -6.481  -4.874
  530    HA   THR  66           HA       THR  66   8.298  -4.543  -5.799
  531    HB   THR  66           HB       THR  66   7.834  -7.491  -5.291
  532    HG1  THR  66           1HG      THR  66   9.576  -6.691  -6.850
  533   HG21  THR  66          3HG2      THR  66   5.747  -6.222  -5.551
  534   HG22  THR  66          1HG2      THR  66   6.031  -7.278  -6.936
  535   HG23  THR  66          2HG2      THR  66   6.344  -5.548  -7.068
  536    H    ALA  67           HN       ALA  67   8.497  -6.507  -2.882
  537    HA   ALA  67           HA       ALA  67   6.030  -5.798  -1.742
  538    HB1  ALA  67           1HB      ALA  67   7.032  -6.452   0.395
  539    HB2  ALA  67           2HB      ALA  67   8.630  -6.449  -0.352
  540    HB3  ALA  67           3HB      ALA  67   7.415  -7.618  -0.873
  541    H    SER  68           HN       SER  68   9.230  -4.273  -1.566
  542    HA   SER  68           HA       SER  68   8.525  -2.135   0.112
  543    HB2  SER  68           2HB      SER  68  10.629  -2.206  -2.068
  544    HB3  SER  68           1HB      SER  68  10.550  -1.042  -0.745
  545    HG   SER  68           HG       SER  68  11.901  -2.543   0.031
  546    H    ARG  69           HN       ARG  69   8.393  -2.486  -3.416
  547    HA   ARG  69           HA       ARG  69   7.594   0.164  -3.958
  548    HB2  ARG  69           2HB      ARG  69   7.360  -2.394  -5.527
  549    HB3  ARG  69           1HB      ARG  69   6.815  -0.851  -6.145
  550    HG2  ARG  69           2HG      ARG  69   9.469  -0.595  -5.149
  551    HG3  ARG  69           1HG      ARG  69   9.378  -1.952  -6.272
  552    HD2  ARG  69           2HD      ARG  69   9.904   0.036  -7.492
  553    HD3  ARG  69           1HD      ARG  69   8.272  -0.465  -7.906
  554    HE   ARG  69           HE       ARG  69   8.006   1.352  -5.847
  555   HH11  ARG  69          1HH1      ARG  69   9.314   1.373  -9.101
  556   HH12  ARG  69          2HH1      ARG  69   9.011   3.064  -9.338
  557   HH21  ARG  69          1HH2      ARG  69   7.585   3.568  -6.172
  558   HH22  ARG  69          2HH2      ARG  69   8.022   4.313  -7.686
  559    H    LEU  70           HN       LEU  70   5.823  -2.767  -3.173
  560    HA   LEU  70           HA       LEU  70   3.238  -1.683  -3.640
  561    HB2  LEU  70           2HB      LEU  70   3.707  -4.107  -3.429
  562    HB3  LEU  70           1HB      LEU  70   4.072  -3.873  -1.731
  563    HG   LEU  70           HG       LEU  70   1.741  -3.158  -1.337
  564   HD11  LEU  70          1HD1      LEU  70   0.064  -3.451  -3.064
  565   HD12  LEU  70          2HD1      LEU  70   1.307  -3.932  -4.219
  566   HD13  LEU  70          3HD1      LEU  70   1.280  -2.285  -3.586
  567   HD21  LEU  70          3HD2      LEU  70   0.719  -5.362  -1.601
  568   HD22  LEU  70          1HD2      LEU  70   2.378  -5.495  -1.017
  569   HD23  LEU  70          2HD2      LEU  70   2.008  -5.831  -2.708
  570    H    ARG  71           HN       ARG  71   5.321  -1.908  -0.790
  571    HA   ARG  71           HA       ARG  71   3.541  -0.739   1.050
  572    HB2  ARG  71           2HB      ARG  71   6.514  -1.118   0.964
  573    HB3  ARG  71           1HB      ARG  71   5.763  -0.217   2.274
  574    HG2  ARG  71           2HG      ARG  71   4.876  -2.984   1.538
  575    HG3  ARG  71           1HG      ARG  71   6.205  -2.686   2.660
  576    HD2  ARG  71           2HD      ARG  71   3.520  -1.398   3.030
  577    HD3  ARG  71           1HD      ARG  71   3.851  -3.021   3.634
  578    HE   ARG  71           HE       ARG  71   5.868  -1.228   4.476
  579   HH11  ARG  71          1HH1      ARG  71   2.503  -1.954   5.092
  580   HH12  ARG  71          2HH1      ARG  71   2.607  -1.574   6.783
  581   HH21  ARG  71          1HH2      ARG  71   6.014  -0.790   6.705
  582   HH22  ARG  71          2HH2      ARG  71   4.593  -0.910   7.698
  583    H    GLY  72           HN       GLY  72   5.939   0.666  -1.125
  584    HA2  GLY  72           2HA      GLY  72   5.837   3.305  -0.175
  585    HA3  GLY  72           1HA      GLY  72   6.232   2.837  -1.823
  586    H    ARG  73           HN       ARG  73   3.791   1.613  -2.503
  587    HA   ARG  73           HA       ARG  73   2.227   3.902  -3.133
  588    HB2  ARG  73           2HB      ARG  73   1.828   0.948  -3.568
  589    HB3  ARG  73           1HB      ARG  73   0.614   2.132  -4.037
  590    HG2  ARG  73           2HG      ARG  73   2.268   3.252  -5.459
  591    HG3  ARG  73           1HG      ARG  73   3.459   2.030  -5.017
  592    HD2  ARG  73           2HD      ARG  73   0.823   1.302  -6.256
  593    HD3  ARG  73           1HD      ARG  73   2.211   1.755  -7.241
  594    HE   ARG  73           HE       ARG  73   3.059  -0.233  -5.496
  595   HH11  ARG  73          1HH1      ARG  73   0.739   0.101  -8.106
  596   HH12  ARG  73          2HH1      ARG  73   0.894  -1.545  -8.634
  597   HH21  ARG  73          1HH2      ARG  73   3.289  -2.400  -6.216
  598   HH22  ARG  73          2HH2      ARG  73   2.352  -2.962  -7.564
  599    H    ILE  74           HN       ILE  74   1.899   1.251  -0.828
  600    HA   ILE  74           HA       ILE  74  -0.633   1.929   0.191
  601    HB   ILE  74           HB       ILE  74   1.692   0.585   1.589
  602   HG12  ILE  74          2HG1      ILE  74  -0.749  -0.592   0.239
  603   HG13  ILE  74          1HG1      ILE  74   0.874  -0.583  -0.438
  604   HG21  ILE  74          1HG2      ILE  74  -1.219   0.703   2.364
  605   HG22  ILE  74          2HG2      ILE  74   0.125   1.458   3.219
  606   HG23  ILE  74          3HG2      ILE  74   0.007  -0.298   3.141
  607   HD11  ILE  74          3HD1      ILE  74   0.005  -1.997   2.072
  608   HD12  ILE  74          1HD1      ILE  74   1.642  -1.985   1.417
  609   HD13  ILE  74          2HD1      ILE  74   0.333  -2.745   0.509
  610    H    GLU  75           HN       GLU  75   2.620   3.010   1.017
  611    HA   GLU  75           HA       GLU  75   2.131   4.587   3.246
  612    HB2  GLU  75           2HB      GLU  75   4.358   4.115   2.298
  613    HB3  GLU  75           1HB      GLU  75   3.992   5.150   0.927
  614    HG2  GLU  75           2HG      GLU  75   3.702   7.031   2.577
  615    HG3  GLU  75           1HG      GLU  75   4.380   5.948   3.795
  616    H    SER  76           HN       SER  76   1.918   5.467  -0.184
  617    HA   SER  76           HA       SER  76   1.156   8.136   0.197
  618    HB2  SER  76           2HB      SER  76   0.574   6.299  -2.117
  619    HB3  SER  76           1HB      SER  76   0.413   8.052  -2.152
  620    HG   SER  76           HG       SER  76   2.453   8.130  -2.577
  621    H    VAL  77           HN       VAL  77  -0.806   5.213  -0.247
  622    HA   VAL  77           HA       VAL  77  -3.308   6.507  -0.331
  623    HB   VAL  77           HB       VAL  77  -2.661   3.690   0.561
  624   HG11  VAL  77          1HG1      VAL  77  -4.996   3.183   0.106
  625   HG12  VAL  77          2HG1      VAL  77  -5.302   4.876  -0.275
  626   HG13  VAL  77          3HG1      VAL  77  -4.854   4.409   1.365
  627   HG21  VAL  77          3HG2      VAL  77  -3.546   4.776  -2.108
  628   HG22  VAL  77          1HG2      VAL  77  -3.331   3.069  -1.718
  629   HG23  VAL  77          2HG2      VAL  77  -1.942   4.157  -1.718
  630    H    LEU  78           HN       LEU  78  -1.567   4.984   2.374
  631    HA   LEU  78           HA       LEU  78  -3.613   5.446   4.268
  632    HB2  LEU  78           2HB      LEU  78  -0.669   4.901   4.631
  633    HB3  LEU  78           1HB      LEU  78  -1.820   4.970   5.952
  634    HG   LEU  78           HG       LEU  78  -1.856   2.984   3.675
  635   HD11  LEU  78          1HD1      LEU  78  -0.064   2.589   5.290
  636   HD12  LEU  78          2HD1      LEU  78  -1.310   1.345   5.385
  637   HD13  LEU  78          3HD1      LEU  78  -1.242   2.617   6.602
  638   HD21  LEU  78          3HD2      LEU  78  -3.656   3.213   6.088
  639   HD22  LEU  78          1HD2      LEU  78  -3.675   1.908   4.903
  640   HD23  LEU  78          2HD2      LEU  78  -4.116   3.544   4.418
  641    H    ASP  79           HN       ASP  79  -0.785   7.318   3.300
  642    HA   ASP  79           HA       ASP  79  -1.040   9.226   5.419
  643    HB2  ASP  79           2HB      ASP  79   1.101   8.831   4.246
  644    HB3  ASP  79           1HB      ASP  79   0.404   9.507   2.777
  645    H    TRP  80           HN       TRP  80  -2.016   9.126   2.026
  646    HA   TRP  80           HA       TRP  80  -3.139  11.679   1.816
  647    HB2  TRP  80           2HB      TRP  80  -2.742  10.193  -0.100
  648    HB3  TRP  80           1HB      TRP  80  -3.983   9.093   0.483
  649    HD1  TRP  80           1HD      TRP  80  -3.590  12.578  -1.102
  650    HE1  TRP  80           1HE      TRP  80  -5.807  13.197  -2.260
  651    HE3  TRP  80           3HE      TRP  80  -6.443   8.644   0.490
  652    HZ2  TRP  80           2HZ      TRP  80  -8.423  12.140  -2.462
  653    HZ3  TRP  80           3HZ      TRP  80  -8.793   8.529  -0.230
  654    HH2  TRP  80           2HH      TRP  80  -9.758  10.244  -1.674
  655    H    ALA  81           HN       ALA  81  -4.602   8.593   2.796
  656    HA   ALA  81           HA       ALA  81  -7.194   9.524   3.300
  657    HB1  ALA  81           1HB      ALA  81  -7.448   7.541   4.712
  658    HB2  ALA  81           2HB      ALA  81  -5.703   7.296   4.681
  659    HB3  ALA  81           3HB      ALA  81  -6.639   7.153   3.194
  660    H    THR  82           HN       THR  82  -4.298   9.553   5.290
  661    HA   THR  82           HA       THR  82  -5.514  10.346   7.716
  662    HB   THR  82           HB       THR  82  -2.692  10.898   6.765
  663    HG1  THR  82           1HG      THR  82  -2.966   8.702   6.737
  664   HG21  THR  82          3HG2      THR  82  -2.152  10.978   9.164
  665   HG22  THR  82          1HG2      THR  82  -3.862  10.784   9.548
  666   HG23  THR  82          2HG2      THR  82  -3.303  12.235   8.715
  667    H    VAL  83           HN       VAL  83  -3.970  12.165   5.095
  668    HA   VAL  83           HA       VAL  83  -4.375  14.736   6.193
  669    HB   VAL  83           HB       VAL  83  -4.039  13.925   3.298
  670   HG11  VAL  83          1HG1      VAL  83  -4.969  16.168   3.484
  671   HG12  VAL  83          2HG1      VAL  83  -3.294  16.231   2.936
  672   HG13  VAL  83          3HG1      VAL  83  -3.690  16.618   4.609
  673   HG21  VAL  83          3HG2      VAL  83  -1.688  14.529   3.639
  674   HG22  VAL  83          1HG2      VAL  83  -2.183  13.200   4.687
  675   HG23  VAL  83          2HG2      VAL  83  -2.018  14.827   5.344
  676    H    ARG  84           HN       ARG  84  -6.310  12.736   4.015
  677    HA   ARG  84           HA       ARG  84  -8.280  14.740   3.524
  678    HB2  ARG  84           2HB      ARG  84  -8.282  11.754   3.138
  679    HB3  ARG  84           1HB      ARG  84  -9.624  12.785   2.662
  680    HG2  ARG  84           2HG      ARG  84  -6.806  13.034   1.634
  681    HG3  ARG  84           1HG      ARG  84  -8.126  12.218   0.796
  682    HD2  ARG  84           2HD      ARG  84  -8.023  15.137   1.551
  683    HD3  ARG  84           1HD      ARG  84  -7.810  14.473  -0.068
  684    HE   ARG  84           HE       ARG  84 -10.327  13.973   1.354
  685   HH11  ARG  84          1HH1      ARG  84  -8.590  15.574  -1.239
  686   HH12  ARG  84          2HH1      ARG  84 -10.036  16.015  -2.096
  687   HH21  ARG  84          1HH2      ARG  84 -12.216  14.534   0.235
  688   HH22  ARG  84          2HH2      ARG  84 -12.111  15.430  -1.255
  689    H    GLY  85           HN       GLY  85  -7.805  12.380   6.028
  690    HA2  GLY  85           2HA      GLY  85  -8.841  12.506   8.136
  691    HA3  GLY  85           1HA      GLY  85 -10.118  13.486   7.427
  692    H    TYR  86           HN       TYR  86  -9.021  10.463   6.035
  693    HA   TYR  86           HA       TYR  86 -11.661   9.306   6.536
  694    HB2  TYR  86           2HB      TYR  86  -9.366   8.444   4.769
  695    HB3  TYR  86           1HB      TYR  86 -10.803   7.460   5.019
  696    HD1  TYR  86           2HD      TYR  86 -13.064   8.994   4.709
  697    HD2  TYR  86           1HD      TYR  86  -9.322   9.586   2.782
  698    HE1  TYR  86           2HE      TYR  86 -14.205  10.174   2.879
  699    HE2  TYR  86           1HE      TYR  86 -10.448  10.772   0.947
  700    HH   TYR  86           HH       TYR  86 -12.692  10.907  -0.079
  701    H    ARG  87           HN       ARG  87  -8.939   9.553   8.191
  702    HA   ARG  87           HA       ARG  87  -9.445   7.347   9.898
  703    HB2  ARG  87           2HB      ARG  87  -7.333   6.149   9.589
  704    HB3  ARG  87           1HB      ARG  87  -8.265   6.137   8.100
  705    HG2  ARG  87           2HG      ARG  87  -6.867   8.062   7.315
  706    HG3  ARG  87           1HG      ARG  87  -5.857   7.822   8.741
  707    HD2  ARG  87           2HD      ARG  87  -6.373   5.816   6.548
  708    HD3  ARG  87           1HD      ARG  87  -4.887   6.725   6.804
  709    HE   ARG  87           HE       ARG  87  -5.822   4.418   8.306
  710   HH11  ARG  87          1HH1      ARG  87  -3.569   7.085   8.109
  711   HH12  ARG  87          2HH1      ARG  87  -2.361   6.320   9.093
  712   HH21  ARG  87          1HH2      ARG  87  -4.243   3.395   9.621
  713   HH22  ARG  87          2HH2      ARG  87  -2.759   4.219   9.972
  714    H    GLU  88           HN       GLU  88  -7.219   7.192  11.367
  715    HA   GLU  88           HA       GLU  88  -6.809   9.947  12.235
  716    HB2  GLU  88           2HB      GLU  88  -6.283   7.297  13.583
  717    HB3  GLU  88           1HB      GLU  88  -5.841   8.849  14.285
  718    HG2  GLU  88           2HG      GLU  88  -8.117   9.537  14.407
  719    HG3  GLU  88           1HG      GLU  88  -8.645   8.151  13.457
  720    H    GLY  89           HN       GLY  89  -4.487  10.214  13.302
  721    HA2  GLY  89           2HA      GLY  89  -2.805  10.182  10.953
  722    HA3  GLY  89           1HA      GLY  89  -2.495  11.042  12.447
  723    H    ASP  90           HN       ASP  90  -1.674   8.456  10.526
  724    HA   ASP  90           HA       ASP  90   0.619   7.845  12.010
  725    HB2  ASP  90           2HB      ASP  90  -1.004   6.666  13.487
  726    HB3  ASP  90           1HB      ASP  90  -1.469   5.653  12.123
  727    H    ASN  91           HN       ASN  91   2.030   6.456  10.854
  728    HA   ASN  91           HA       ASN  91   1.010   5.610   8.227
  729    HB2  ASN  91           2HB      ASN  91   2.460   7.567   7.948
  730    HB3  ASN  91           1HB      ASN  91   3.757   6.737   8.802
  731   HD21  ASN  91          1HD2      ASN  91   1.865   6.821   5.849
  732   HD22  ASN  91          2HD2      ASN  91   2.958   5.875   4.907
  733    HA   PRO  92           HA       PRO  92   2.502   1.820  10.312
  734    HB2  PRO  92           2HB      PRO  92   0.508   0.573   8.551
  735    HB3  PRO  92           1HB      PRO  92   0.647   0.506  10.310
  736    HG2  PRO  92           2HG      PRO  92  -1.315   1.884   9.095
  737    HG3  PRO  92           1HG      PRO  92  -0.581   2.434  10.614
  738    HD2  PRO  92           2HD      PRO  92  -0.067   3.371   7.813
  739    HD3  PRO  92           1HD      PRO  92  -0.254   4.323   9.302
  740    H    ALA  93           HN       ALA  93   3.000   3.109   7.365
  741    HA   ALA  93           HA       ALA  93   3.858   0.660   5.999
  742    HB1  ALA  93           1HB      ALA  93   2.614   2.353   4.722
  743    HB2  ALA  93           2HB      ALA  93   4.231   2.094   4.069
  744    HB3  ALA  93           3HB      ALA  93   3.892   3.527   5.037
  745    H    ARG  94           HN       ARG  94   5.176   2.659   8.247
  746    HA   ARG  94           HA       ARG  94   7.856   2.759   7.191
  747    HB2  ARG  94           2HB      ARG  94   8.455   3.668   9.374
  748    HB3  ARG  94           1HB      ARG  94   7.037   4.490   8.739
  749    HG2  ARG  94           2HG      ARG  94   5.607   3.111  10.186
  750    HG3  ARG  94           1HG      ARG  94   7.046   2.329  10.843
  751    HD2  ARG  94           2HD      ARG  94   6.278   4.067  12.347
  752    HD3  ARG  94           1HD      ARG  94   7.837   4.514  11.656
  753    HE   ARG  94           HE       ARG  94   6.471   5.914  10.062
  754   HH11  ARG  94          1HH1      ARG  94   5.378   5.163  13.305
  755   HH12  ARG  94          2HH1      ARG  94   4.356   6.562  13.415
  756   HH21  ARG  94          1HH2      ARG  94   5.164   7.774  10.218
  757   HH22  ARG  94          2HH2      ARG  94   4.236   8.052  11.667
  758    H    TRP  95           HN       TRP  95   9.680   1.689   8.285
  759    HA   TRP  95           HA       TRP  95   9.157  -0.524  10.043
  760    HB2  TRP  95           2HB      TRP  95   9.316  -1.016   7.202
  761    HB3  TRP  95           1HB      TRP  95  10.651  -1.805   8.036
  762    HD1  TRP  95           1HD      TRP  95   9.324  -2.842  10.632
  763    HE1  TRP  95           1HE      TRP  95   7.480  -4.633  10.567
  764    HE3  TRP  95           3HE      TRP  95   7.793  -2.227   5.810
  765    HZ2  TRP  95           2HZ      TRP  95   5.614  -5.655   8.690
  766    HZ3  TRP  95           3HZ      TRP  95   5.962  -3.619   4.962
  767    HH2  TRP  95           2HH      TRP  95   4.909  -5.319   6.365
  768    H    ARG  96           HN       ARG  96  10.745  -0.338  11.477
  769    HA   ARG  96           HA       ARG  96  13.437   0.292  10.495
  770    HB2  ARG  96           2HB      ARG  96  12.164   0.638  13.203
  771    HB3  ARG  96           1HB      ARG  96  13.875   0.873  12.899
  772    HG2  ARG  96           2HG      ARG  96  13.355   2.655  11.319
  773    HG3  ARG  96           1HG      ARG  96  11.633   2.411  11.616
  774    HD2  ARG  96           2HD      ARG  96  11.955   2.988  13.965
  775    HD3  ARG  96           1HD      ARG  96  13.679   3.219  13.674
  776    HE   ARG  96           HE       ARG  96  12.489   4.894  11.892
  777   HH11  ARG  96          1HH1      ARG  96  12.279   4.447  15.360
  778   HH12  ARG  96          2HH1      ARG  96  11.884   6.115  15.679
  779   HH21  ARG  96          1HH2      ARG  96  11.976   7.090  12.301
  780   HH22  ARG  96          2HH2      ARG  96  11.696   7.612  13.939
  781    H    GLY  97           HN       GLY  97  11.508  -2.207  11.752
  782    HA2  GLY  97           2HA      GLY  97  13.809  -3.936  12.029
  783    HA3  GLY  97           1HA      GLY  97  12.943  -3.632  13.525
  784    H    TYR  98           HN       TYR  98  12.950  -5.287  10.516
  785    HA   TYR  98           HA       TYR  98  10.870  -7.048  11.551
  786    HB2  TYR  98           2HB      TYR  98   9.674  -5.428  10.093
  787    HB3  TYR  98           1HB      TYR  98  10.714  -5.892   8.751
  788    HD1  TYR  98           2HD      TYR  98   8.157  -7.191  11.112
  789    HD2  TYR  98           1HD      TYR  98  10.183  -7.763   7.417
  790    HE1  TYR  98           2HE      TYR  98   6.590  -8.996  10.538
  791    HE2  TYR  98           1HE      TYR  98   8.621  -9.570   6.829
  792    HH   TYR  98           HH       TYR  98   7.129 -11.158   7.956
  793    H    LEU  99           HN       LEU  99  13.253  -6.374   9.033
  794    HA   LEU  99           HA       LEU  99  13.490  -9.225   8.464
  795    HB2  LEU  99           2HB      LEU  99  14.776  -6.829   7.155
  796    HB3  LEU  99           1HB      LEU  99  14.973  -8.487   6.630
  797    HG   LEU  99           HG       LEU  99  12.354  -6.982   6.647
  798   HD11  LEU  99          1HD1      LEU  99  13.905  -6.091   4.988
  799   HD12  LEU  99          2HD1      LEU  99  12.582  -6.964   4.216
  800   HD13  LEU  99          3HD1      LEU  99  14.171  -7.716   4.353
  801   HD21  LEU  99          3HD2      LEU  99  11.521  -8.881   5.357
  802   HD22  LEU  99          1HD2      LEU  99  12.078  -9.389   6.950
  803   HD23  LEU  99          2HD2      LEU  99  13.078  -9.690   5.530
  804    H    GLU 100           HN       GLU 100  15.530  -6.474   9.362
  805    HA   GLU 100           HA       GLU 100  17.576  -6.282  10.305
  806    HB2  GLU 100           2HB      GLU 100  16.260  -7.552  12.116
  807    HB3  GLU 100           1HB      GLU 100  17.128  -8.982  11.576
  808    HG2  GLU 100           2HG      GLU 100  19.234  -8.002  12.167
  809    HG3  GLU 100           1HG      GLU 100  18.463  -6.461  12.533
  810    H    HIS 101           HN       HIS 101  19.552  -8.221  10.913
  811    HA   HIS 101           HA       HIS 101  21.283  -9.354   9.973
  812    HB2  HIS 101           2HB      HIS 101  19.272 -10.200   7.872
  813    HB3  HIS 101           1HB      HIS 101  20.868 -10.901   8.102
  814    HD1  HIS 101           1HD      HIS 101  21.066 -12.777   9.776
  815    HD2  HIS 101           2HD      HIS 101  17.423 -10.775   9.995
  816    HE1  HIS 101           1HE      HIS 101  19.642 -14.119  11.357
  817    HE2  HIS 101           2HE      HIS 101  17.520 -12.782  11.622
  818    H    HIS 102           HN       HIS 102  22.545  -9.551   7.784
  819    HA   HIS 102           HA       HIS 102  23.610  -8.522   6.047
  820    HB2  HIS 102           2HB      HIS 102  20.911  -8.455   5.454
  821    HB3  HIS 102           1HB      HIS 102  21.381  -6.776   5.262
  822    HD1  HIS 102           1HD      HIS 102  21.026  -9.723   3.357
  823    HD2  HIS 102           2HD      HIS 102  23.854  -6.673   3.473
  824    HE1  HIS 102           1HE      HIS 102  22.214  -9.815   1.148
  825    HE2  HIS 102           2HE      HIS 102  23.827  -7.881   1.183
  826    H    HIS 103           HN       HIS 103  23.457  -5.962   4.997
  827    HA   HIS 103           HA       HIS 103  23.924  -3.777   5.271
  828    HB2  HIS 103           2HB      HIS 103  21.655  -3.906   6.384
  829    HB3  HIS 103           1HB      HIS 103  22.497  -3.974   7.926
  830    HD1  HIS 103           1HD      HIS 103  20.938  -1.643   5.720
  831    HD2  HIS 103           2HD      HIS 103  24.275  -1.545   8.208
  832    HE1  HIS 103           1HE      HIS 103  21.439   0.795   6.096
  833    HE2  HIS 103           2HE      HIS 103  23.594   0.813   7.401
  834    H    HIS 104           HN       HIS 104  26.198  -4.349   5.463
  835    HA   HIS 104           HA       HIS 104  27.206  -3.038   7.826
  836    HB2  HIS 104           2HB      HIS 104  28.729  -4.691   8.567
  837    HB3  HIS 104           1HB      HIS 104  27.186  -5.504   8.402
  838    HD1  HIS 104           1HD      HIS 104  29.691  -7.174   8.517
  839    HD2  HIS 104           2HD      HIS 104  28.089  -5.775   4.943
  840    HE1  HIS 104           1HE      HIS 104  30.588  -8.693   6.727
  841    HE2  HIS 104           2HE      HIS 104  29.822  -7.653   4.561
  842    H    HIS 105           HN       HIS 105  29.306  -2.186   7.565
  843    HA   HIS 105           HA       HIS 105  30.486  -2.492   4.884
  844    HB2  HIS 105           2HB      HIS 105  29.150  -0.258   5.420
  845    HB3  HIS 105           1HB      HIS 105  30.648   0.167   6.243
  846    HD1  HIS 105           1HD      HIS 105  32.202   1.436   4.781
  847    HD2  HIS 105           2HD      HIS 105  29.812  -1.191   2.613
  848    HE1  HIS 105           1HE      HIS 105  32.830   1.774   2.369
  849    HE2  HIS 105           2HE      HIS 105  31.205   0.343   1.073
  850    H    HIS 106           HN       HIS 106  30.795  -1.738   8.263
  851    HA   HIS 106           HA       HIS 106  33.212  -3.220   8.470
  852    HB2  HIS 106           2HB      HIS 106  34.084  -0.986   7.698
  853    HB3  HIS 106           1HB      HIS 106  33.390  -0.269   9.147
  854    HD1  HIS 106           1HD      HIS 106  34.694  -0.507  11.318
  855    HD2  HIS 106           2HD      HIS 106  36.332  -2.691   8.176
  856    HE1  HIS 106           1HE      HIS 106  36.960  -1.254  12.116
  857    HE2  HIS 106           2HE      HIS 106  37.885  -2.678  10.256
  Start of MODEL    4
    1    H1   MET   1           H1       MET   1 -14.518   3.393   6.053
    2    H2   MET   1           H2       MET   1 -15.705   2.424   5.330
    3    H3   MET   1           H3       MET   1 -15.783   4.113   5.190
    4    HA   MET   1           HA       MET   1 -15.003   3.071   3.150
    5    HB2  MET   1           2HB      MET   1 -14.265   5.357   3.813
    6    HB3  MET   1           1HB      MET   1 -12.849   4.650   4.580
    7    HG2  MET   1           2HG      MET   1 -12.222   5.502   2.435
    8    HG3  MET   1           1HG      MET   1 -12.173   3.742   2.380
    9    HE1  MET   1           2HE      MET   1 -14.210   6.953   1.386
   10    HE2  MET   1           3HE      MET   1 -15.391   6.012   2.297
   11    HE3  MET   1           1HE      MET   1 -15.599   6.244   0.561
   12    H    THR   2           HN       THR   2 -13.943   1.386   2.267
   13    HA   THR   2           HA       THR   2 -12.275  -0.226   4.035
   14    HB   THR   2           HB       THR   2 -12.335  -1.906   2.217
   15    HG1  THR   2           1HG      THR   2 -14.247  -0.283   0.897
   16   HG21  THR   2          3HG2      THR   2 -14.718  -2.452   2.387
   17   HG22  THR   2          1HG2      THR   2 -15.047  -0.828   2.992
   18   HG23  THR   2          2HG2      THR   2 -14.065  -1.940   3.944
   19    H    PHE   3           HN       PHE   3 -10.299  -1.254   3.009
   20    HA   PHE   3           HA       PHE   3  -8.475   0.798   2.348
   21    HB2  PHE   3           2HB      PHE   3  -7.855  -1.309   3.514
   22    HB3  PHE   3           1HB      PHE   3  -8.126  -2.191   2.016
   23    HD1  PHE   3           2HD      PHE   3  -6.063   0.489   3.532
   24    HD2  PHE   3           1HD      PHE   3  -6.427  -2.403   0.432
   25    HE1  PHE   3           2HE      PHE   3  -3.729   0.909   2.872
   26    HE2  PHE   3           1HE      PHE   3  -4.098  -1.984  -0.239
   27    HZ   PHE   3           HZ       PHE   3  -2.745  -0.329   0.982
   28    H    SER   4           HN       SER   4 -10.081  -1.696   0.417
   29    HA   SER   4           HA       SER   4  -8.766  -1.171  -2.012
   30    HB2  SER   4           2HB      SER   4 -11.554  -2.263  -1.557
   31    HB3  SER   4           1HB      SER   4 -10.643  -2.371  -3.064
   32    HG   SER   4           HG       SER   4  -8.985  -3.396  -1.560
   33    H    GLU   5           HN       GLU   5 -11.820   0.086  -0.699
   34    HA   GLU   5           HA       GLU   5 -12.527   1.670  -2.907
   35    HB2  GLU   5           2HB      GLU   5 -13.192   1.843   0.020
   36    HB3  GLU   5           1HB      GLU   5 -13.873   2.940  -1.164
   37    HG2  GLU   5           2HG      GLU   5 -14.886   1.084  -2.338
   38    HG3  GLU   5           1HG      GLU   5 -14.158  -0.048  -1.200
   39    H    CYS   6           HN       CYS   6 -10.766   2.465   0.062
   40    HA   CYS   6           HA       CYS   6 -10.459   5.212  -0.457
   41    HB2  CYS   6           2HB      CYS   6 -10.053   3.930   1.720
   42    HB3  CYS   6           1HB      CYS   6  -8.473   3.543   1.068
   43    HG   CYS   6           HG       CYS   6  -8.134   6.493   0.627
   44    H    ALA   7           HN       ALA   7  -8.353   2.453  -1.117
   45    HA   ALA   7           HA       ALA   7  -6.231   3.822  -2.314
   46    HB1  ALA   7           1HB      ALA   7  -5.635   1.716  -3.359
   47    HB2  ALA   7           2HB      ALA   7  -7.242   1.072  -3.028
   48    HB3  ALA   7           3HB      ALA   7  -6.151   1.443  -1.695
   49    H    ALA   8           HN       ALA   8  -9.177   2.478  -3.773
   50    HA   ALA   8           HA       ALA   8  -8.624   3.177  -6.429
   51    HB1  ALA   8           1HB      ALA   8 -10.413   1.623  -5.758
   52    HB2  ALA   8           2HB      ALA   8 -10.993   2.883  -6.846
   53    HB3  ALA   8           3HB      ALA   8 -11.336   2.984  -5.119
   54    H    LEU   9           HN       LEU   9 -10.164   5.001  -3.822
   55    HA   LEU   9           HA       LEU   9 -10.946   7.239  -5.333
   56    HB2  LEU   9           2HB      LEU   9 -10.124   7.086  -2.430
   57    HB3  LEU   9           1HB      LEU   9 -10.931   8.451  -3.173
   58    HG   LEU   9           HG       LEU   9 -12.086   5.682  -2.842
   59   HD11  LEU   9          1HD1      LEU   9 -12.760   8.290  -1.487
   60   HD12  LEU   9          2HD1      LEU   9 -11.925   6.925  -0.746
   61   HD13  LEU   9          3HD1      LEU   9 -13.603   6.757  -1.262
   62   HD21  LEU   9          3HD2      LEU   9 -13.350   8.190  -3.942
   63   HD22  LEU   9          1HD2      LEU   9 -14.151   6.638  -3.695
   64   HD23  LEU   9          2HD2      LEU   9 -12.863   6.787  -4.891
   65    H    TYR  10           HN       TYR  10  -7.943   6.511  -3.599
   66    HA   TYR  10           HA       TYR  10  -6.606   8.928  -4.056
   67    HB2  TYR  10           2HB      TYR  10  -5.803   7.176  -2.510
   68    HB3  TYR  10           1HB      TYR  10  -5.422   6.145  -3.883
   69    HD1  TYR  10           1HD      TYR  10  -4.611   9.445  -2.388
   70    HD2  TYR  10           2HD      TYR  10  -3.294   6.255  -4.864
   71    HE1  TYR  10           1HE      TYR  10  -2.377  10.455  -2.483
   72    HE2  TYR  10           2HE      TYR  10  -1.048   7.254  -4.963
   73    HH   TYR  10           HH       TYR  10  -0.088   9.822  -2.894
   74    H    ILE  11           HN       ILE  11  -6.765   5.981  -5.962
   75    HA   ILE  11           HA       ILE  11  -5.004   6.744  -8.017
   76    HB   ILE  11           HB       ILE  11  -7.308   4.785  -8.053
   77   HG12  ILE  11          2HG1      ILE  11  -4.338   4.290  -7.762
   78   HG13  ILE  11          1HG1      ILE  11  -5.447   4.405  -6.401
   79   HG21  ILE  11          1HG2      ILE  11  -6.727   5.447 -10.324
   80   HG22  ILE  11          2HG2      ILE  11  -6.215   3.789 -10.010
   81   HG23  ILE  11          3HG2      ILE  11  -5.029   5.092 -10.007
   82   HD11  ILE  11          3HD1      ILE  11  -4.981   2.098  -6.952
   83   HD12  ILE  11          1HD1      ILE  11  -5.546   2.359  -8.602
   84   HD13  ILE  11          2HD1      ILE  11  -6.677   2.475  -7.254
   85    H    LYS  12           HN       LYS  12  -8.549   6.981  -7.774
   86    HA   LYS  12           HA       LYS  12  -8.862   8.157 -10.355
   87    HB2  LYS  12           2HB      LYS  12 -10.720   8.074  -7.973
   88    HB3  LYS  12           1HB      LYS  12 -11.174   8.679  -9.563
   89    HG2  LYS  12           2HG      LYS  12 -10.680   6.467 -10.520
   90    HG3  LYS  12           1HG      LYS  12 -10.293   5.874  -8.904
   91    HD2  LYS  12           2HD      LYS  12 -12.567   6.305  -8.174
   92    HD3  LYS  12           1HD      LYS  12 -12.964   6.998  -9.749
   93    HE2  LYS  12           2HE      LYS  12 -12.448   4.826 -10.796
   94    HE3  LYS  12           1HE      LYS  12 -12.148   4.147  -9.198
   95    HZ1  LYS  12           3HZ      LYS  12 -14.434   4.551  -8.605
   96    HZ2  LYS  12           1HZ      LYS  12 -14.378   3.649 -10.037
   97    HZ3  LYS  12           2HZ      LYS  12 -14.734   5.306 -10.095
   98    H    ALA  13           HN       ALA  13  -8.448   9.480  -7.111
   99    HA   ALA  13           HA       ALA  13  -8.941  12.174  -7.794
  100    HB1  ALA  13           1HB      ALA  13  -7.106  11.080  -5.664
  101    HB2  ALA  13           2HB      ALA  13  -8.829  11.416  -5.474
  102    HB3  ALA  13           3HB      ALA  13  -7.698  12.738  -5.771
  103    H    HIS  14           HN       HIS  14  -6.170  10.092  -8.193
  104    HA   HIS  14           HA       HIS  14  -4.565  12.360  -9.147
  105    HB2  HIS  14           2HB      HIS  14  -3.838   9.694  -7.990
  106    HB3  HIS  14           1HB      HIS  14  -2.689  10.548  -9.012
  107    HD1  HIS  14           1HD      HIS  14  -4.508  10.893  -5.725
  108    HD2  HIS  14           2HD      HIS  14  -1.373  12.634  -7.824
  109    HE1  HIS  14           1HE      HIS  14  -3.387  12.454  -4.095
  110    HE2  HIS  14           2HE      HIS  14  -1.422  13.414  -5.360
  111    H    ARG  15           HN       ARG  15  -6.671  10.548 -10.573
  112    HA   ARG  15           HA       ARG  15  -5.263   9.126 -12.566
  113    HB2  ARG  15           2HB      ARG  15  -7.361   9.060 -13.800
  114    HB3  ARG  15           1HB      ARG  15  -7.661   8.744 -12.096
  115    HG2  ARG  15           2HG      ARG  15  -8.471  10.992 -11.780
  116    HG3  ARG  15           1HG      ARG  15  -8.067  11.399 -13.443
  117    HD2  ARG  15           2HD      ARG  15  -9.700   9.801 -14.260
  118    HD3  ARG  15           1HD      ARG  15 -10.066   9.308 -12.607
  119    HE   ARG  15           HE       ARG  15 -10.702  11.803 -12.356
  120   HH11  ARG  15          1HH1      ARG  15 -11.183   9.873 -15.254
  121   HH12  ARG  15          2HH1      ARG  15 -12.579  10.781 -15.755
  122   HH21  ARG  15          1HH2      ARG  15 -12.505  12.990 -13.041
  123   HH22  ARG  15          2HH2      ARG  15 -13.326  12.552 -14.514
  124    H    SER  16           HN       SER  16  -6.289  12.460 -12.279
  125    HA   SER  16           HA       SER  16  -5.759  13.278 -14.919
  126    HB2  SER  16           2HB      SER  16  -5.481  15.041 -12.499
  127    HB3  SER  16           1HB      SER  16  -6.133  15.434 -14.088
  128    HG   SER  16           HG       SER  16  -8.022  14.643 -13.540
  129    H    SER  17           HN       SER  17  -3.817  12.958 -12.020
  130    HA   SER  17           HA       SER  17  -1.503  14.284 -13.010
  131    HB2  SER  17           2HB      SER  17  -1.527  12.201 -10.829
  132    HB3  SER  17           1HB      SER  17  -0.495  13.622 -10.983
  133    HG   SER  17           HG       SER  17  -2.335  14.928 -10.588
  134    H    TRP  18           HN       TRP  18  -2.698  10.994 -12.979
  135    HA   TRP  18           HA       TRP  18  -0.235   9.987 -14.194
  136    HB2  TRP  18           2HB      TRP  18  -2.675   8.509 -13.190
  137    HB3  TRP  18           1HB      TRP  18  -1.207   7.758 -13.802
  138    HD1  TRP  18           1HD      TRP  18   0.696   9.930 -12.083
  139    HE1  TRP  18           1HE      TRP  18   1.022   9.404  -9.580
  140    HE3  TRP  18           3HE      TRP  18  -3.295   6.825 -11.379
  141    HZ2  TRP  18           2HZ      TRP  18  -0.240   7.867  -7.579
  142    HZ3  TRP  18           3HZ      TRP  18  -3.656   5.855  -9.149
  143    HH2  TRP  18           2HH      TRP  18  -2.165   6.371  -7.290
  144    H    LYS  19           HN       LYS  19  -1.965  11.698 -15.750
  145    HA   LYS  19           HA       LYS  19  -3.011   9.787 -17.706
  146    HB2  LYS  19           2HB      LYS  19  -4.799  11.174 -16.644
  147    HB3  LYS  19           1HB      LYS  19  -3.984  12.615 -17.236
  148    HG2  LYS  19           2HG      LYS  19  -4.450  12.073 -19.489
  149    HG3  LYS  19           1HG      LYS  19  -4.957  10.437 -19.061
  150    HD2  LYS  19           2HD      LYS  19  -6.888  11.321 -17.881
  151    HD3  LYS  19           1HD      LYS  19  -6.362  12.970 -18.217
  152    HE2  LYS  19           2HE      LYS  19  -8.158  12.220 -19.732
  153    HE3  LYS  19           1HE      LYS  19  -6.675  12.631 -20.589
  154    HZ1  LYS  19           3HZ      LYS  19  -7.396   9.846 -19.851
  155    HZ2  LYS  19           1HZ      LYS  19  -6.177  10.356 -20.914
  156    HZ3  LYS  19           2HZ      LYS  19  -7.810  10.546 -21.335
  157    H    ASN  20           HN       ASN  20  -0.735  10.788 -19.902
  158    HA   ASN  20           HA       ASN  20  -2.706   9.059 -18.636
  159    HB2  ASN  20           2HB      ASN  20  -3.518   9.778 -20.862
  160    HB3  ASN  20           1HB      ASN  20  -2.066   9.096 -21.593
  161   HD21  ASN  20          1HD2      ASN  20  -3.237   7.641 -22.838
  162   HD22  ASN  20          2HD2      ASN  20  -4.004   6.251 -22.141
  163    H    THR  21           HN       THR  21  -1.478   7.832 -17.463
  164    HA   THR  21           HA       THR  21   0.618   6.247 -18.806
  165    HB   THR  21           HB       THR  21   1.690   5.977 -16.590
  166    HG1  THR  21           1HG      THR  21  -0.502   7.577 -15.802
  167   HG21  THR  21          3HG2      THR  21   1.274   8.857 -17.385
  168   HG22  THR  21          1HG2      THR  21   2.506   7.766 -18.019
  169   HG23  THR  21          2HG2      THR  21   2.554   8.264 -16.327
  170    H    LYS  22           HN       LYS  22   0.708   3.992 -18.226
  171    HA   LYS  22           HA       LYS  22  -1.818   2.908 -17.287
  172    HB2  LYS  22           2HB      LYS  22   0.742   1.540 -18.154
  173    HB3  LYS  22           1HB      LYS  22  -0.730   0.696 -17.692
  174    HG2  LYS  22           2HG      LYS  22  -1.895   1.987 -19.530
  175    HG3  LYS  22           1HG      LYS  22  -0.291   2.483 -20.065
  176    HD2  LYS  22           2HD      LYS  22  -1.238  -0.366 -19.799
  177    HD3  LYS  22           1HD      LYS  22  -1.137   0.539 -21.308
  178    HE2  LYS  22           2HE      LYS  22   1.289   0.794 -20.958
  179    HE3  LYS  22           1HE      LYS  22   1.161  -0.181 -19.494
  180    HZ1  LYS  22           3HZ      LYS  22   1.862  -1.577 -21.277
  181    HZ2  LYS  22           1HZ      LYS  22   0.594  -1.055 -22.274
  182    HZ3  LYS  22           2HZ      LYS  22   0.264  -1.992 -20.900
  183    H    HIS  23           HN       HIS  23   0.695   4.252 -15.899
  184    HA   HIS  23           HA       HIS  23   1.523   2.760 -13.723
  185    HB2  HIS  23           2HB      HIS  23   2.472   4.909 -14.403
  186    HB3  HIS  23           1HB      HIS  23   0.976   5.728 -14.004
  187    HD1  HIS  23           1HD      HIS  23   4.084   4.337 -12.497
  188    HD2  HIS  23           2HD      HIS  23   0.640   6.337 -11.302
  189    HE1  HIS  23           1HE      HIS  23   4.553   5.164 -10.172
  190    HE2  HIS  23           2HE      HIS  23   2.557   6.586  -9.581
  191    H    ALA  24           HN       ALA  24  -1.479   4.541 -14.228
  192    HA   ALA  24           HA       ALA  24  -2.458   4.353 -11.562
  193    HB1  ALA  24           1HB      ALA  24  -4.608   4.982 -12.524
  194    HB2  ALA  24           2HB      ALA  24  -3.992   4.663 -14.146
  195    HB3  ALA  24           3HB      ALA  24  -3.315   5.980 -13.186
  196    H    ASP  25           HN       ASP  25  -3.003   2.406 -14.478
  197    HA   ASP  25           HA       ASP  25  -4.871   0.621 -13.337
  198    HB2  ASP  25           2HB      ASP  25  -4.607   0.951 -15.772
  199    HB3  ASP  25           1HB      ASP  25  -3.026   0.186 -15.698
  200    H    GLN  26           HN       GLN  26  -1.391   0.374 -13.905
  201    HA   GLN  26           HA       GLN  26  -0.951  -2.164 -12.844
  202    HB2  GLN  26           2HB      GLN  26   0.755   0.304 -13.105
  203    HB3  GLN  26           1HB      GLN  26   1.395  -1.178 -12.421
  204    HG2  GLN  26           2HG      GLN  26   0.990  -2.368 -14.456
  205    HG3  GLN  26           1HG      GLN  26   0.129  -0.991 -15.138
  206   HE21  GLN  26          1HE2      GLN  26   1.506  -0.997 -16.911
  207   HE22  GLN  26          2HE2      GLN  26   3.120  -0.367 -16.806
  208    H    TRP  27           HN       TRP  27  -1.044   1.000 -11.235
  209    HA   TRP  27           HA       TRP  27  -0.338   0.140  -8.662
  210    HB2  TRP  27           2HB      TRP  27  -1.690   2.485  -9.830
  211    HB3  TRP  27           1HB      TRP  27  -2.093   2.155  -8.148
  212    HD1  TRP  27           1HD      TRP  27   1.300   2.131 -10.074
  213    HE1  TRP  27           1HE      TRP  27   2.998   3.482  -8.678
  214    HE3  TRP  27           3HE      TRP  27  -1.752   3.508  -6.217
  215    HZ2  TRP  27           2HZ      TRP  27   3.019   4.956  -6.270
  216    HZ3  TRP  27           3HZ      TRP  27  -0.819   4.889  -4.412
  217    HH2  TRP  27           2HH      TRP  27   1.517   5.599  -4.438
  218    H    THR  28           HN       THR  28  -3.511   0.445 -10.190
  219    HA   THR  28           HA       THR  28  -5.080  -0.345  -8.017
  220    HB   THR  28           HB       THR  28  -5.739  -0.864 -10.920
  221    HG1  THR  28           1HG      THR  28  -5.064   1.322 -10.624
  222   HG21  THR  28          3HG2      THR  28  -8.050  -0.449 -10.170
  223   HG22  THR  28          1HG2      THR  28  -7.469  -0.270  -8.514
  224   HG23  THR  28          2HG2      THR  28  -7.323  -1.824  -9.338
  225    H    ASN  29           HN       ASN  29  -3.761  -2.250 -10.701
  226    HA   ASN  29           HA       ASN  29  -5.071  -4.647 -10.160
  227    HB2  ASN  29           2HB      ASN  29  -2.717  -3.801 -11.758
  228    HB3  ASN  29           1HB      ASN  29  -2.891  -5.515 -11.448
  229   HD21  ASN  29          1HD2      ASN  29  -4.184  -2.744 -13.036
  230   HD22  ASN  29          2HD2      ASN  29  -5.317  -3.583 -14.038
  231    H    THR  30           HN       THR  30  -1.800  -3.611  -9.199
  232    HA   THR  30           HA       THR  30  -1.062  -6.048  -8.015
  233    HB   THR  30           HB       THR  30  -0.045  -3.318  -7.227
  234    HG1  THR  30           1HG      THR  30   0.372  -4.898  -9.529
  235   HG21  THR  30          3HG2      THR  30   0.721  -5.154  -5.800
  236   HG22  THR  30          1HG2      THR  30   2.045  -4.509  -6.772
  237   HG23  THR  30          2HG2      THR  30   1.280  -6.033  -7.222
  238    H    ILE  31           HN       ILE  31  -2.524  -3.127  -6.634
  239    HA   ILE  31           HA       ILE  31  -2.398  -3.978  -3.941
  240    HB   ILE  31           HB       ILE  31  -4.265  -1.977  -5.231
  241   HG12  ILE  31          2HG1      ILE  31  -1.693  -1.570  -3.685
  242   HG13  ILE  31          1HG1      ILE  31  -1.855  -1.438  -5.432
  243   HG21  ILE  31          1HG2      ILE  31  -4.590  -1.101  -2.954
  244   HG22  ILE  31          2HG2      ILE  31  -3.644  -2.448  -2.319
  245   HG23  ILE  31          3HG2      ILE  31  -5.181  -2.757  -3.124
  246   HD11  ILE  31          3HD1      ILE  31  -3.392   0.442  -5.142
  247   HD12  ILE  31          1HD1      ILE  31  -1.825   0.751  -4.392
  248   HD13  ILE  31          2HD1      ILE  31  -3.209   0.315  -3.392
  249    H    LYS  32           HN       LYS  32  -4.916  -4.214  -6.419
  250    HA   LYS  32           HA       LYS  32  -6.940  -5.238  -4.736
  251    HB2  LYS  32           2HB      LYS  32  -7.206  -4.278  -7.078
  252    HB3  LYS  32           1HB      LYS  32  -6.646  -5.831  -7.680
  253    HG2  LYS  32           2HG      LYS  32  -8.521  -6.935  -6.523
  254    HG3  LYS  32           1HG      LYS  32  -9.103  -5.352  -6.006
  255    HD2  LYS  32           2HD      LYS  32  -9.412  -4.686  -8.324
  256    HD3  LYS  32           1HD      LYS  32  -8.772  -6.239  -8.871
  257    HE2  LYS  32           2HE      LYS  32 -10.627  -7.366  -7.662
  258    HE3  LYS  32           1HE      LYS  32 -11.294  -5.780  -7.278
  259    HZ1  LYS  32           3HZ      LYS  32 -12.319  -6.858  -9.236
  260    HZ2  LYS  32           1HZ      LYS  32 -10.827  -6.770 -10.039
  261    HZ3  LYS  32           2HZ      LYS  32 -11.640  -5.346  -9.589
  262    H    THR  33           HN       THR  33  -4.251  -6.726  -6.370
  263    HA   THR  33           HA       THR  33  -5.315  -9.395  -6.182
  264    HB   THR  33           HB       THR  33  -2.529  -8.460  -6.894
  265    HG1  THR  33           1HG      THR  33  -4.161  -7.740  -8.362
  266   HG21  THR  33          3HG2      THR  33  -2.554 -10.803  -6.179
  267   HG22  THR  33          1HG2      THR  33  -2.264 -10.676  -7.914
  268   HG23  THR  33          2HG2      THR  33  -3.857 -11.143  -7.318
  269    H    TYR  34           HN       TYR  34  -2.575  -7.687  -4.631
  270    HA   TYR  34           HA       TYR  34  -2.085  -9.953  -2.919
  271    HB2  TYR  34           2HB      TYR  34  -0.802  -7.226  -3.052
  272    HB3  TYR  34           1HB      TYR  34  -0.315  -8.480  -1.917
  273    HD1  TYR  34           2HD      TYR  34   0.266 -10.804  -3.010
  274    HD2  TYR  34           1HD      TYR  34   0.282  -7.095  -5.093
  275    HE1  TYR  34           2HE      TYR  34   1.758 -11.773  -4.708
  276    HE2  TYR  34           1HE      TYR  34   1.775  -8.051  -6.795
  277    HH   TYR  34           HH       TYR  34   3.427  -9.908  -6.960
  278    H    CYS  35           HN       CYS  35  -3.229  -6.624  -2.412
  279    HA   CYS  35           HA       CYS  35  -3.442  -7.069   0.432
  280    HB2  CYS  35           2HB      CYS  35  -4.313  -4.685  -1.208
  281    HB3  CYS  35           1HB      CYS  35  -4.115  -4.734   0.541
  282    HG   CYS  35           HG       CYS  35  -1.333  -5.131   0.417
  283    H    GLY  36           HN       GLY  36  -5.505  -7.220  -2.314
  284    HA2  GLY  36           2HA      GLY  36  -7.994  -6.519  -1.422
  285    HA3  GLY  36           1HA      GLY  36  -7.706  -7.810  -2.574
  286    HA   PRO  37           HA       PRO  37  -9.199 -10.926   0.059
  287    HB2  PRO  37           2HB      PRO  37  -7.171 -12.721   0.480
  288    HB3  PRO  37           1HB      PRO  37  -8.097 -12.600  -1.020
  289    HG2  PRO  37           2HG      PRO  37  -5.412 -11.448  -0.353
  290    HG3  PRO  37           1HG      PRO  37  -5.940 -12.264  -1.836
  291    HD2  PRO  37           2HD      PRO  37  -5.756  -9.602  -1.703
  292    HD3  PRO  37           1HD      PRO  37  -7.059 -10.390  -2.617
  293    H    VAL  38           HN       VAL  38  -6.287  -9.427   1.288
  294    HA   VAL  38           HA       VAL  38  -6.660 -10.683   3.902
  295    HB   VAL  38           HB       VAL  38  -4.411  -8.877   3.022
  296   HG11  VAL  38          1HG1      VAL  38  -4.701  -8.994   5.442
  297   HG12  VAL  38          2HG1      VAL  38  -3.224  -9.821   4.947
  298   HG13  VAL  38          3HG1      VAL  38  -4.658 -10.756   5.371
  299   HG21  VAL  38          3HG2      VAL  38  -4.458 -10.873   1.636
  300   HG22  VAL  38          1HG2      VAL  38  -4.536 -11.889   3.077
  301   HG23  VAL  38          2HG2      VAL  38  -3.095 -10.927   2.753
  302    H    ILE  39           HN       ILE  39  -6.306  -7.398   2.532
  303    HA   ILE  39           HA       ILE  39  -7.625  -6.376   4.965
  304    HB   ILE  39           HB       ILE  39  -6.185  -4.355   4.826
  305   HG12  ILE  39          2HG1      ILE  39  -4.580  -6.043   2.884
  306   HG13  ILE  39          1HG1      ILE  39  -5.504  -4.601   2.466
  307   HG21  ILE  39          1HG2      ILE  39  -4.206  -5.410   5.844
  308   HG22  ILE  39          2HG2      ILE  39  -4.774  -6.983   5.280
  309   HG23  ILE  39          3HG2      ILE  39  -5.717  -6.073   6.463
  310   HD11  ILE  39          3HD1      ILE  39  -3.097  -4.719   4.269
  311   HD12  ILE  39          1HD1      ILE  39  -4.030  -3.271   3.900
  312   HD13  ILE  39          2HD1      ILE  39  -3.149  -4.100   2.619
  313    H    GLY  40           HN       GLY  40  -8.070  -6.772   1.834
  314    HA2  GLY  40           2HA      GLY  40  -8.557  -4.259   0.709
  315    HA3  GLY  40           1HA      GLY  40  -9.297  -5.764   0.195
  316    HA   PRO  41           HA       PRO  41 -13.164  -4.445   1.814
  317    HB2  PRO  41           2HB      PRO  41 -13.761  -6.888   3.271
  318    HB3  PRO  41           1HB      PRO  41 -14.414  -6.330   1.730
  319    HG2  PRO  41           2HG      PRO  41 -12.760  -8.474   1.948
  320    HG3  PRO  41           1HG      PRO  41 -12.826  -7.445   0.505
  321    HD2  PRO  41           2HD      PRO  41 -10.849  -7.423   2.762
  322    HD3  PRO  41           1HD      PRO  41 -10.564  -7.281   1.012
  323    H    LEU  42           HN       LEU  42 -10.686  -4.869   3.930
  324    HA   LEU  42           HA       LEU  42 -12.213  -4.407   6.354
  325    HB2  LEU  42           2HB      LEU  42  -9.225  -4.383   5.887
  326    HB3  LEU  42           1HB      LEU  42 -10.008  -4.245   7.448
  327    HG   LEU  42           HG       LEU  42 -10.020  -6.654   5.632
  328   HD11  LEU  42          1HD1      LEU  42  -8.835  -7.704   7.515
  329   HD12  LEU  42          2HD1      LEU  42  -8.815  -6.148   8.348
  330   HD13  LEU  42          3HD1      LEU  42  -7.941  -6.347   6.829
  331   HD21  LEU  42          3HD2      LEU  42 -11.364  -6.293   8.311
  332   HD22  LEU  42          1HD2      LEU  42 -11.294  -7.781   7.369
  333   HD23  LEU  42          2HD2      LEU  42 -12.191  -6.391   6.758
  334    H    SER  43           HN       SER  43 -11.807  -2.486   7.678
  335    HA   SER  43           HA       SER  43 -12.156  -0.110   6.207
  336    HB2  SER  43           2HB      SER  43 -12.975  -0.523   8.557
  337    HB3  SER  43           1HB      SER  43 -11.319  -0.309   9.102
  338    HG   SER  43           HG       SER  43 -13.104   1.571   8.018
  339    H    VAL  44           HN       VAL  44 -10.790   1.551   5.724
  340    HA   VAL  44           HA       VAL  44  -8.043   0.997   5.409
  341    HB   VAL  44           HB       VAL  44  -9.301   2.581   3.985
  342   HG11  VAL  44          1HG1      VAL  44  -9.713   4.872   4.768
  343   HG12  VAL  44          2HG1      VAL  44  -9.191   4.403   6.388
  344   HG13  VAL  44          3HG1      VAL  44 -10.638   3.682   5.685
  345   HG21  VAL  44          3HG2      VAL  44  -6.875   2.653   4.002
  346   HG22  VAL  44          1HG2      VAL  44  -6.902   3.787   5.351
  347   HG23  VAL  44          2HG2      VAL  44  -7.545   4.268   3.779
  348    H    GLN  45           HN       GLN  45  -9.858   2.327   8.037
  349    HA   GLN  45           HA       GLN  45  -7.524   3.374   9.373
  350    HB2  GLN  45           2HB      GLN  45  -9.070   4.033  11.101
  351    HB3  GLN  45           1HB      GLN  45  -9.716   4.502   9.543
  352    HG2  GLN  45           2HG      GLN  45 -11.164   2.519   9.589
  353    HG3  GLN  45           1HG      GLN  45 -10.549   2.131  11.192
  354   HE21  GLN  45          1HE2      GLN  45 -11.197   5.392  10.074
  355   HE22  GLN  45          2HE2      GLN  45 -12.539   5.675  11.130
  356    H    ASP  46           HN       ASP  46  -9.183   0.389   9.103
  357    HA   ASP  46           HA       ASP  46  -8.353  -0.561  11.728
  358    HB2  ASP  46           2HB      ASP  46 -10.575  -1.138  10.710
  359    HB3  ASP  46           1HB      ASP  46  -9.712  -2.116   9.526
  360    H    VAL  47           HN       VAL  47  -7.145  -0.531   8.538
  361    HA   VAL  47           HA       VAL  47  -5.581  -2.907   8.617
  362    HB   VAL  47           HB       VAL  47  -5.162  -0.398   6.980
  363   HG11  VAL  47          1HG1      VAL  47  -3.813  -1.826   5.508
  364   HG12  VAL  47          2HG1      VAL  47  -3.996  -3.162   6.645
  365   HG13  VAL  47          3HG1      VAL  47  -3.118  -1.710   7.124
  366   HG21  VAL  47          3HG2      VAL  47  -7.323  -1.440   6.553
  367   HG22  VAL  47          1HG2      VAL  47  -6.534  -2.996   6.289
  368   HG23  VAL  47          2HG2      VAL  47  -6.244  -1.660   5.175
  369    H    ASP  48           HN       ASP  48  -3.958  -3.276   9.974
  370    HA   ASP  48           HA       ASP  48  -2.328  -0.986  10.867
  371    HB2  ASP  48           2HB      ASP  48  -2.939  -3.576  12.308
  372    HB3  ASP  48           1HB      ASP  48  -1.759  -2.394  12.863
  373    H    THR  49           HN       THR  49  -0.079  -1.781  11.659
  374    HA   THR  49           HA       THR  49   1.374  -2.639   9.426
  375    HB   THR  49           HB       THR  49   2.289  -2.752  12.305
  376    HG1  THR  49           1HG      THR  49   2.618  -0.547  10.548
  377   HG21  THR  49          3HG2      THR  49   4.503  -2.290  11.330
  378   HG22  THR  49          1HG2      THR  49   3.798  -2.368   9.715
  379   HG23  THR  49          2HG2      THR  49   3.828  -3.807  10.734
  380    H    LYS  50           HN       LYS  50   0.215  -4.358  12.259
  381    HA   LYS  50           HA       LYS  50   1.457  -6.815  11.984
  382    HB2  LYS  50           2HB      LYS  50  -0.011  -6.089  13.852
  383    HB3  LYS  50           1HB      LYS  50  -1.402  -6.290  12.805
  384    HG2  LYS  50           2HG      LYS  50  -0.881  -8.684  12.609
  385    HG3  LYS  50           1HG      LYS  50   0.459  -8.464  13.737
  386    HD2  LYS  50           2HD      LYS  50  -2.462  -7.951  14.296
  387    HD3  LYS  50           1HD      LYS  50  -1.494  -9.287  14.924
  388    HE2  LYS  50           2HE      LYS  50  -0.200  -7.856  16.268
  389    HE3  LYS  50           1HE      LYS  50  -0.750  -6.419  15.406
  390    HZ1  LYS  50           3HZ      LYS  50  -2.400  -8.132  17.190
  391    HZ2  LYS  50           1HZ      LYS  50  -2.969  -6.789  16.322
  392    HZ3  LYS  50           2HZ      LYS  50  -1.814  -6.577  17.543
  393    H    LEU  51           HN       LEU  51  -1.520  -5.648  10.484
  394    HA   LEU  51           HA       LEU  51  -2.125  -8.030   9.089
  395    HB2  LEU  51           2HB      LEU  51  -2.944  -5.171   8.571
  396    HB3  LEU  51           1HB      LEU  51  -3.657  -6.564   7.793
  397    HG   LEU  51           HG       LEU  51  -3.779  -5.911  10.726
  398   HD11  LEU  51          1HD1      LEU  51  -5.203  -4.497   9.348
  399   HD12  LEU  51          2HD1      LEU  51  -6.168  -5.617  10.308
  400   HD13  LEU  51          3HD1      LEU  51  -5.906  -5.925   8.592
  401   HD21  LEU  51          3HD2      LEU  51  -3.661  -8.327  10.353
  402   HD22  LEU  51          1HD2      LEU  51  -5.002  -8.216   9.213
  403   HD23  LEU  51          2HD2      LEU  51  -5.258  -7.838  10.918
  404    H    ILE  52           HN       ILE  52  -0.364  -5.097   8.252
  405    HA   ILE  52           HA       ILE  52  -0.058  -5.621   5.503
  406    HB   ILE  52           HB       ILE  52   1.664  -3.969   7.351
  407   HG12  ILE  52          2HG1      ILE  52  -0.545  -3.170   5.443
  408   HG13  ILE  52          1HG1      ILE  52  -0.698  -3.260   7.195
  409   HG21  ILE  52          1HG2      ILE  52   2.448  -2.847   5.298
  410   HG22  ILE  52          2HG2      ILE  52   1.598  -4.058   4.337
  411   HG23  ILE  52          3HG2      ILE  52   2.936  -4.539   5.382
  412   HD11  ILE  52          3HD1      ILE  52  -0.404  -0.972   6.413
  413   HD12  ILE  52          1HD1      ILE  52   1.146  -1.413   5.699
  414   HD13  ILE  52          2HD1      ILE  52   0.930  -1.483   7.448
  415    H    MET  53           HN       MET  53   1.985  -6.422   8.290
  416    HA   MET  53           HA       MET  53   4.182  -7.416   6.836
  417    HB2  MET  53           2HB      MET  53   3.201  -8.096   9.612
  418    HB3  MET  53           1HB      MET  53   4.725  -8.671   8.948
  419    HG2  MET  53           2HG      MET  53   5.449  -6.334   8.665
  420    HG3  MET  53           1HG      MET  53   3.945  -5.802   9.416
  421    HE1  MET  53           3HE      MET  53   3.514  -7.963  11.694
  422    HE2  MET  53           1HE      MET  53   3.314  -6.229  11.934
  423    HE3  MET  53           2HE      MET  53   4.305  -7.164  13.054
  424    H    LYS  54           HN       LYS  54   1.183  -8.917   7.865
  425    HA   LYS  54           HA       LYS  54   1.868 -11.579   7.219
  426    HB2  LYS  54           2HB      LYS  54  -0.843 -10.238   7.255
  427    HB3  LYS  54           1HB      LYS  54  -0.578 -11.974   7.167
  428    HG2  LYS  54           2HG      LYS  54   0.554 -11.880   9.358
  429    HG3  LYS  54           1HG      LYS  54   0.181 -10.158   9.446
  430    HD2  LYS  54           2HD      LYS  54  -1.460 -11.390  10.716
  431    HD3  LYS  54           1HD      LYS  54  -2.227 -10.714   9.277
  432    HE2  LYS  54           2HE      LYS  54  -2.046 -12.876   8.156
  433    HE3  LYS  54           1HE      LYS  54  -1.249 -13.552   9.576
  434    HZ1  LYS  54           3HZ      LYS  54  -3.581 -14.130   9.541
  435    HZ2  LYS  54           1HZ      LYS  54  -4.023 -12.496   9.482
  436    HZ3  LYS  54           2HZ      LYS  54  -3.258 -13.117  10.860
  437    H    VAL  55           HN       VAL  55   0.522  -8.928   5.342
  438    HA   VAL  55           HA       VAL  55  -0.066 -10.447   3.016
  439    HB   VAL  55           HB       VAL  55   0.500  -7.482   3.203
  440   HG11  VAL  55          1HG1      VAL  55  -1.036  -9.069   1.149
  441   HG12  VAL  55          2HG1      VAL  55   0.547  -8.331   0.919
  442   HG13  VAL  55          3HG1      VAL  55  -0.869  -7.315   1.182
  443   HG21  VAL  55          3HG2      VAL  55  -1.258  -8.087   4.756
  444   HG22  VAL  55          1HG2      VAL  55  -2.113  -8.959   3.482
  445   HG23  VAL  55          2HG2      VAL  55  -1.930  -7.207   3.384
  446    H    LEU  56           HN       LEU  56   2.704  -8.465   3.990
  447    HA   LEU  56           HA       LEU  56   3.960  -8.578   1.440
  448    HB2  LEU  56           2HB      LEU  56   5.025  -7.776   4.141
  449    HB3  LEU  56           1HB      LEU  56   5.911  -7.592   2.640
  450    HG   LEU  56           HG       LEU  56   3.316  -6.217   3.351
  451   HD11  LEU  56          1HD1      LEU  56   4.680  -4.186   3.343
  452   HD12  LEU  56          2HD1      LEU  56   6.123  -5.159   3.051
  453   HD13  LEU  56          3HD1      LEU  56   5.232  -5.335   4.563
  454   HD21  LEU  56          3HD2      LEU  56   3.617  -4.990   1.263
  455   HD22  LEU  56          1HD2      LEU  56   3.451  -6.720   0.961
  456   HD23  LEU  56          2HD2      LEU  56   5.041  -5.960   0.889
  457    H    ASP  57           HN       ASP  57   4.167 -10.572   4.305
  458    HA   ASP  57           HA       ASP  57   6.707 -11.619   4.126
  459    HB2  ASP  57           2HB      ASP  57   4.970 -12.053   5.925
  460    HB3  ASP  57           1HB      ASP  57   4.316 -13.288   4.877
  461    HA   PRO  58           HA       PRO  58   5.278 -15.227   1.273
  462    HB2  PRO  58           2HB      PRO  58   2.888 -15.024  -0.002
  463    HB3  PRO  58           1HB      PRO  58   3.083 -15.793   1.576
  464    HG2  PRO  58           2HG      PRO  58   2.113 -13.043   0.916
  465    HG3  PRO  58           1HG      PRO  58   1.496 -14.190   2.119
  466    HD2  PRO  58           2HD      PRO  58   3.098 -12.098   2.764
  467    HD3  PRO  58           1HD      PRO  58   3.108 -13.624   3.664
  468    H    ILE  59           HN       ILE  59   4.822 -11.897   0.519
  469    HA   ILE  59           HA       ILE  59   4.901 -12.236  -2.338
  470    HB   ILE  59           HB       ILE  59   5.450  -9.691  -0.794
  471   HG12  ILE  59          2HG1      ILE  59   2.831 -10.730  -1.913
  472   HG13  ILE  59          1HG1      ILE  59   3.243 -10.633  -0.203
  473   HG21  ILE  59          1HG2      ILE  59   4.778  -8.597  -2.887
  474   HG22  ILE  59          2HG2      ILE  59   4.580 -10.176  -3.647
  475   HG23  ILE  59          3HG2      ILE  59   6.178  -9.644  -3.123
  476   HD11  ILE  59          3HD1      ILE  59   1.790  -8.806  -0.886
  477   HD12  ILE  59          1HD1      ILE  59   2.979  -8.298  -2.088
  478   HD13  ILE  59          2HD1      ILE  59   3.365  -8.207  -0.368
  479    H    TRP  60           HN       TRP  60   7.223 -11.571   0.230
  480    HA   TRP  60           HA       TRP  60   9.453 -10.936  -1.364
  481    HB2  TRP  60           2HB      TRP  60   9.337 -12.294   1.343
  482    HB3  TRP  60           1HB      TRP  60  10.816 -11.705   0.595
  483    HD1  TRP  60           1HD      TRP  60   8.063 -10.635   2.825
  484    HE1  TRP  60           1HE      TRP  60   8.211  -8.108   3.279
  485    HE3  TRP  60           3HE      TRP  60  11.471  -9.363  -0.764
  486    HZ2  TRP  60           2HZ      TRP  60   9.590  -5.871   2.257
  487    HZ3  TRP  60           3HZ      TRP  60  12.154  -7.006  -0.959
  488    HH2  TRP  60           2HH      TRP  60  11.231  -5.299   0.521
  489    H    GLU  61           HN       GLU  61   7.930 -13.951  -0.613
  490    HA   GLU  61           HA       GLU  61   9.990 -15.728  -1.301
  491    HB2  GLU  61           2HB      GLU  61   6.996 -15.872  -1.143
  492    HB3  GLU  61           1HB      GLU  61   7.929 -17.234  -1.716
  493    HG2  GLU  61           2HG      GLU  61   8.697 -16.010   0.870
  494    HG3  GLU  61           1HG      GLU  61   7.232 -16.988   0.805
  495    H    GLN  62           HN       GLN  62   7.505 -14.073  -3.172
  496    HA   GLN  62           HA       GLN  62   8.243 -15.607  -5.550
  497    HB2  GLN  62           2HB      GLN  62   5.848 -13.879  -4.949
  498    HB3  GLN  62           1HB      GLN  62   6.129 -14.692  -6.479
  499    HG2  GLN  62           2HG      GLN  62   6.070 -16.852  -5.341
  500    HG3  GLN  62           1HG      GLN  62   5.778 -16.029  -3.809
  501   HE21  GLN  62          1HE2      GLN  62   4.152 -17.982  -5.290
  502   HE22  GLN  62          2HE2      GLN  62   2.618 -17.221  -5.534
  503    H    LYS  63           HN       LYS  63   7.578 -12.243  -4.579
  504    HA   LYS  63           HA       LYS  63   9.294 -11.320  -6.762
  505    HB2  LYS  63           2HB      LYS  63   6.434 -10.423  -6.351
  506    HB3  LYS  63           1HB      LYS  63   7.578  -9.646  -7.432
  507    HG2  LYS  63           2HG      LYS  63   7.732 -11.716  -8.743
  508    HG3  LYS  63           1HG      LYS  63   6.553 -12.470  -7.666
  509    HD2  LYS  63           2HD      LYS  63   4.898 -10.784  -8.294
  510    HD3  LYS  63           1HD      LYS  63   6.078 -10.014  -9.354
  511    HE2  LYS  63           2HE      LYS  63   4.615 -11.370 -10.687
  512    HE3  LYS  63           1HE      LYS  63   6.210 -12.118 -10.659
  513    HZ1  LYS  63           3HZ      LYS  63   3.966 -12.942  -8.895
  514    HZ2  LYS  63           1HZ      LYS  63   5.452 -13.731  -9.095
  515    HZ3  LYS  63           2HZ      LYS  63   4.335 -13.692 -10.367
  516    HA   PRO  64           HA       PRO  64  10.188  -9.138  -2.794
  517    HB2  PRO  64           2HB      PRO  64  12.772  -8.808  -4.201
  518    HB3  PRO  64           1HB      PRO  64  12.450  -9.376  -2.560
  519    HG2  PRO  64           2HG      PRO  64  13.197 -11.070  -4.481
  520    HG3  PRO  64           1HG      PRO  64  12.007 -11.540  -3.254
  521    HD2  PRO  64           2HD      PRO  64  11.575 -10.736  -6.104
  522    HD3  PRO  64           1HD      PRO  64  10.763 -11.992  -5.149
  523    H    GLU  65           HN       GLU  65  11.050  -8.134  -6.093
  524    HA   GLU  65           HA       GLU  65  11.411  -5.393  -5.449
  525    HB2  GLU  65           2HB      GLU  65  12.368  -6.425  -7.468
  526    HB3  GLU  65           1HB      GLU  65  10.749  -6.668  -8.100
  527    HG2  GLU  65           2HG      GLU  65  10.396  -4.279  -8.214
  528    HG3  GLU  65           1HG      GLU  65  11.982  -3.995  -7.500
  529    H    THR  66           HN       THR  66   8.694  -7.315  -6.560
  530    HA   THR  66           HA       THR  66   6.913  -5.156  -7.018
  531    HB   THR  66           HB       THR  66   6.093  -7.957  -6.246
  532    HG1  THR  66           1HG      THR  66   6.732  -7.050  -8.879
  533   HG21  THR  66          3HG2      THR  66   4.850  -5.916  -8.098
  534   HG22  THR  66          1HG2      THR  66   4.294  -6.288  -6.465
  535   HG23  THR  66          2HG2      THR  66   4.200  -7.513  -7.730
  536    H    ALA  67           HN       ALA  67   7.666  -7.156  -4.230
  537    HA   ALA  67           HA       ALA  67   5.660  -6.237  -2.487
  538    HB1  ALA  67           1HB      ALA  67   7.091  -7.048  -0.684
  539    HB2  ALA  67           2HB      ALA  67   8.447  -7.174  -1.803
  540    HB3  ALA  67           3HB      ALA  67   7.036  -8.212  -2.008
  541    H    SER  68           HN       SER  68   8.921  -5.058  -3.151
  542    HA   SER  68           HA       SER  68   8.938  -2.984  -1.237
  543    HB2  SER  68           2HB      SER  68  10.454  -3.142  -3.858
  544    HB3  SER  68           1HB      SER  68  10.866  -2.130  -2.474
  545    HG   SER  68           HG       SER  68  10.845  -4.972  -2.560
  546    H    ARG  69           HN       ARG  69   8.027  -3.071  -4.660
  547    HA   ARG  69           HA       ARG  69   7.467  -0.327  -4.939
  548    HB2  ARG  69           2HB      ARG  69   6.647  -2.799  -6.435
  549    HB3  ARG  69           1HB      ARG  69   6.018  -1.227  -6.877
  550    HG2  ARG  69           2HG      ARG  69   8.311  -0.412  -7.199
  551    HG3  ARG  69           1HG      ARG  69   8.906  -2.027  -6.816
  552    HD2  ARG  69           2HD      ARG  69   7.835  -2.954  -8.740
  553    HD3  ARG  69           1HD      ARG  69   6.985  -1.441  -9.056
  554    HE   ARG  69           HE       ARG  69   9.721  -0.898  -9.094
  555   HH11  ARG  69          1HH1      ARG  69   7.375  -2.749 -10.922
  556   HH12  ARG  69          2HH1      ARG  69   8.238  -2.590 -12.426
  557   HH21  ARG  69          1HH2      ARG  69  10.834  -0.656 -11.067
  558   HH22  ARG  69          2HH2      ARG  69  10.193  -1.377 -12.508
  559    H    LEU  70           HN       LEU  70   5.387  -3.107  -4.180
  560    HA   LEU  70           HA       LEU  70   2.968  -1.675  -3.995
  561    HB2  LEU  70           2HB      LEU  70   3.073  -4.118  -4.177
  562    HB3  LEU  70           1HB      LEU  70   3.817  -4.215  -2.593
  563    HG   LEU  70           HG       LEU  70   1.742  -3.260  -1.606
  564   HD11  LEU  70          1HD1      LEU  70   0.921  -2.085  -3.577
  565   HD12  LEU  70          2HD1      LEU  70  -0.290  -3.206  -2.955
  566   HD13  LEU  70          3HD1      LEU  70   0.645  -3.626  -4.391
  567   HD21  LEU  70          3HD2      LEU  70   2.111  -5.653  -1.600
  568   HD22  LEU  70          1HD2      LEU  70   1.423  -5.787  -3.219
  569   HD23  LEU  70          2HD2      LEU  70   0.402  -5.303  -1.863
  570    H    ARG  71           HN       ARG  71   5.554  -2.283  -1.727
  571    HA   ARG  71           HA       ARG  71   4.339  -1.572   0.669
  572    HB2  ARG  71           2HB      ARG  71   6.778  -2.445   0.054
  573    HB3  ARG  71           1HB      ARG  71   7.163  -0.734   0.174
  574    HG2  ARG  71           2HG      ARG  71   5.917  -2.424   2.334
  575    HG3  ARG  71           1HG      ARG  71   7.599  -1.897   2.265
  576    HD2  ARG  71           2HD      ARG  71   7.083   0.270   2.808
  577    HD3  ARG  71           1HD      ARG  71   5.454   0.164   2.138
  578    HE   ARG  71           HE       ARG  71   6.308  -0.589   4.803
  579   HH11  ARG  71          1HH1      ARG  71   3.796  -0.640   2.372
  580   HH12  ARG  71          2HH1      ARG  71   2.545  -1.095   3.480
  581   HH21  ARG  71          1HH2      ARG  71   4.664  -1.184   6.281
  582   HH22  ARG  71          2HH2      ARG  71   3.038  -1.386   5.718
  583    H    GLY  72           HN       GLY  72   6.069   0.483  -1.665
  584    HA2  GLY  72           2HA      GLY  72   5.832   2.880  -0.191
  585    HA3  GLY  72           1HA      GLY  72   6.153   2.763  -1.915
  586    H    ARG  73           HN       ARG  73   3.726   1.343  -2.538
  587    HA   ARG  73           HA       ARG  73   2.035   3.516  -3.077
  588    HB2  ARG  73           2HB      ARG  73   1.307   0.580  -3.053
  589    HB3  ARG  73           1HB      ARG  73   0.435   1.861  -3.884
  590    HG2  ARG  73           2HG      ARG  73   2.409   2.255  -5.297
  591    HG3  ARG  73           1HG      ARG  73   3.227   0.916  -4.490
  592    HD2  ARG  73           2HD      ARG  73   1.408  -0.588  -5.236
  593    HD3  ARG  73           1HD      ARG  73   0.696   0.764  -6.120
  594    HE   ARG  73           HE       ARG  73   3.374   0.481  -6.920
  595   HH11  ARG  73          1HH1      ARG  73   0.319  -1.210  -7.198
  596   HH12  ARG  73          2HH1      ARG  73   0.730  -1.967  -8.706
  597   HH21  ARG  73          1HH2      ARG  73   3.909  -0.488  -8.893
  598   HH22  ARG  73          2HH2      ARG  73   2.782  -1.549  -9.674
  599    H    ILE  74           HN       ILE  74   1.796   0.935  -0.664
  600    HA   ILE  74           HA       ILE  74  -0.678   1.649   0.432
  601    HB   ILE  74           HB       ILE  74   1.661   0.378   1.872
  602   HG12  ILE  74          2HG1      ILE  74  -0.610  -0.919   0.349
  603   HG13  ILE  74          1HG1      ILE  74   1.055  -0.808  -0.215
  604   HG21  ILE  74          1HG2      ILE  74  -0.061   1.147   3.402
  605   HG22  ILE  74          2HG2      ILE  74  -0.064  -0.615   3.310
  606   HG23  ILE  74          3HG2      ILE  74  -1.297   0.316   2.456
  607   HD11  ILE  74          3HD1      ILE  74   0.132  -2.286   2.242
  608   HD12  ILE  74          1HD1      ILE  74   1.784  -2.205   1.634
  609   HD13  ILE  74          2HD1      ILE  74   0.535  -3.015   0.688
  610    H    GLU  75           HN       GLU  75   2.592   2.712   1.205
  611    HA   GLU  75           HA       GLU  75   2.037   4.296   3.471
  612    HB2  GLU  75           2HB      GLU  75   4.293   3.584   2.651
  613    HB3  GLU  75           1HB      GLU  75   4.142   4.755   1.350
  614    HG2  GLU  75           2HG      GLU  75   3.901   6.526   3.116
  615    HG3  GLU  75           1HG      GLU  75   4.349   5.291   4.297
  616    H    SER  76           HN       SER  76   2.180   5.132   0.012
  617    HA   SER  76           HA       SER  76   1.650   7.870   0.314
  618    HB2  SER  76           2HB      SER  76   0.974   6.106  -2.033
  619    HB3  SER  76           1HB      SER  76   1.131   7.860  -2.065
  620    HG   SER  76           HG       SER  76   3.362   6.914  -1.010
  621    H    VAL  77           HN       VAL  77  -0.529   5.111  -0.146
  622    HA   VAL  77           HA       VAL  77  -2.893   6.670  -0.414
  623    HB   VAL  77           HB       VAL  77  -2.605   3.767   0.394
  624   HG11  VAL  77          1HG1      VAL  77  -4.760   4.647   1.075
  625   HG12  VAL  77          2HG1      VAL  77  -4.944   3.541  -0.285
  626   HG13  VAL  77          3HG1      VAL  77  -5.034   5.283  -0.548
  627   HG21  VAL  77          3HG2      VAL  77  -3.160   5.029  -2.288
  628   HG22  VAL  77          1HG2      VAL  77  -3.162   3.298  -1.948
  629   HG23  VAL  77          2HG2      VAL  77  -1.668   4.224  -1.800
  630    H    LEU  78           HN       LEU  78  -1.460   4.923   2.347
  631    HA   LEU  78           HA       LEU  78  -3.589   5.464   4.114
  632    HB2  LEU  78           2HB      LEU  78  -0.710   4.774   4.656
  633    HB3  LEU  78           1HB      LEU  78  -1.916   4.926   5.919
  634    HG   LEU  78           HG       LEU  78  -1.945   2.919   3.664
  635   HD11  LEU  78          1HD1      LEU  78  -1.620   1.277   5.431
  636   HD12  LEU  78          2HD1      LEU  78  -1.533   2.569   6.627
  637   HD13  LEU  78          3HD1      LEU  78  -0.289   2.433   5.385
  638   HD21  LEU  78          3HD2      LEU  78  -3.906   1.976   4.763
  639   HD22  LEU  78          1HD2      LEU  78  -4.206   3.639   4.258
  640   HD23  LEU  78          2HD2      LEU  78  -3.876   3.279   5.953
  641    H    ASP  79           HN       ASP  79  -0.575   7.209   3.484
  642    HA   ASP  79           HA       ASP  79  -0.847   9.157   5.502
  643    HB2  ASP  79           2HB      ASP  79   1.212   8.795   4.123
  644    HB3  ASP  79           1HB      ASP  79   0.382   9.537   2.760
  645    H    TRP  80           HN       TRP  80  -1.904   9.083   2.146
  646    HA   TRP  80           HA       TRP  80  -3.169  11.569   1.987
  647    HB2  TRP  80           2HB      TRP  80  -2.656  10.178   0.044
  648    HB3  TRP  80           1HB      TRP  80  -3.791   8.955   0.591
  649    HD1  TRP  80           1HD      TRP  80  -3.750  12.529  -0.851
  650    HE1  TRP  80           1HE      TRP  80  -5.988  12.933  -2.063
  651    HE3  TRP  80           3HE      TRP  80  -6.156   8.209   0.459
  652    HZ2  TRP  80           2HZ      TRP  80  -8.454  11.584  -2.402
  653    HZ3  TRP  80           3HZ      TRP  80  -8.451   7.847  -0.350
  654    HH2  TRP  80           2HH      TRP  80  -9.573   9.500  -1.749
  655    H    ALA  81           HN       ALA  81  -4.531   8.377   2.771
  656    HA   ALA  81           HA       ALA  81  -7.182   9.175   3.132
  657    HB1  ALA  81           1HB      ALA  81  -5.734   6.922   4.516
  658    HB2  ALA  81           2HB      ALA  81  -6.469   6.845   2.915
  659    HB3  ALA  81           3HB      ALA  81  -7.482   7.088   4.339
  660    H    THR  82           HN       THR  82  -4.476   9.216   5.378
  661    HA   THR  82           HA       THR  82  -6.007   9.685   7.716
  662    HB   THR  82           HB       THR  82  -3.123  10.448   7.225
  663    HG1  THR  82           1HG      THR  82  -3.232   8.279   6.834
  664   HG21  THR  82          3HG2      THR  82  -4.619   9.823   9.774
  665   HG22  THR  82          1HG2      THR  82  -4.079  11.421   9.258
  666   HG23  THR  82          2HG2      THR  82  -2.895  10.174   9.650
  667    H    VAL  83           HN       VAL  83  -4.483  11.826   5.351
  668    HA   VAL  83           HA       VAL  83  -5.113  14.213   6.828
  669    HB   VAL  83           HB       VAL  83  -4.299  13.958   3.929
  670   HG11  VAL  83          1HG1      VAL  83  -5.303  16.121   4.473
  671   HG12  VAL  83          2HG1      VAL  83  -3.577  16.283   4.148
  672   HG13  VAL  83          3HG1      VAL  83  -4.168  16.315   5.810
  673   HG21  VAL  83          3HG2      VAL  83  -2.640  12.926   5.388
  674   HG22  VAL  83          1HG2      VAL  83  -2.587  14.384   6.378
  675   HG23  VAL  83          2HG2      VAL  83  -2.022  14.431   4.707
  676    H    ARG  84           HN       ARG  84  -6.572  12.361   4.229
  677    HA   ARG  84           HA       ARG  84  -8.506  14.316   3.487
  678    HB2  ARG  84           2HB      ARG  84  -8.404  11.332   3.034
  679    HB3  ARG  84           1HB      ARG  84  -9.640  12.380   2.352
  680    HG2  ARG  84           2HG      ARG  84  -6.681  12.557   1.828
  681    HG3  ARG  84           1HG      ARG  84  -7.899  11.905   0.729
  682    HD2  ARG  84           2HD      ARG  84  -7.728  14.749   1.722
  683    HD3  ARG  84           1HD      ARG  84  -7.291  14.182   0.112
  684    HE   ARG  84           HE       ARG  84  -9.775  13.458   0.070
  685   HH11  ARG  84          1HH1      ARG  84  -8.484  16.324   1.588
  686   HH12  ARG  84          2HH1      ARG  84  -9.930  17.260   1.362
  687   HH21  ARG  84          1HH2      ARG  84 -11.698  14.674  -0.234
  688   HH22  ARG  84          2HH2      ARG  84 -11.770  16.302   0.364
  689    H    GLY  85           HN       GLY  85  -8.372  11.908   5.987
  690    HA2  GLY  85           2HA      GLY  85  -9.726  12.205   7.941
  691    HA3  GLY  85           1HA      GLY  85 -10.975  12.905   6.925
  692    H    TYR  86           HN       TYR  86  -9.400  10.011   5.850
  693    HA   TYR  86           HA       TYR  86 -11.890   8.549   6.299
  694    HB2  TYR  86           2HB      TYR  86  -9.433   7.815   4.688
  695    HB3  TYR  86           1HB      TYR  86 -10.887   6.826   4.817
  696    HD1  TYR  86           1HD      TYR  86 -13.129   8.214   4.260
  697    HD2  TYR  86           2HD      TYR  86  -9.243   9.119   2.793
  698    HE1  TYR  86           1HE      TYR  86 -14.129   9.435   2.374
  699    HE2  TYR  86           2HE      TYR  86 -10.233  10.339   0.901
  700    HH   TYR  86           HH       TYR  86 -13.437  11.298   0.829
  701    H    ARG  87           HN       ARG  87  -8.898   9.003   7.711
  702    HA   ARG  87           HA       ARG  87  -9.393   7.055   9.734
  703    HB2  ARG  87           2HB      ARG  87  -7.377   5.724   9.450
  704    HB3  ARG  87           1HB      ARG  87  -8.368   5.610   8.002
  705    HG2  ARG  87           2HG      ARG  87  -6.927   7.210   6.871
  706    HG3  ARG  87           1HG      ARG  87  -5.945   7.367   8.329
  707    HD2  ARG  87           2HD      ARG  87  -6.302   4.917   6.610
  708    HD3  ARG  87           1HD      ARG  87  -4.833   5.867   6.825
  709    HE   ARG  87           HE       ARG  87  -5.843   3.814   8.552
  710   HH11  ARG  87          1HH1      ARG  87  -3.885   6.725   8.438
  711   HH12  ARG  87          2HH1      ARG  87  -2.927   6.280   9.816
  712   HH21  ARG  87          1HH2      ARG  87  -4.590   3.248  10.401
  713   HH22  ARG  87          2HH2      ARG  87  -3.338   4.324  10.928
  714    H    GLU  88           HN       GLU  88  -8.024   7.369  11.553
  715    HA   GLU  88           HA       GLU  88  -6.276   9.729  11.383
  716    HB2  GLU  88           2HB      GLU  88  -8.104   8.881  13.636
  717    HB3  GLU  88           1HB      GLU  88  -6.865  10.119  13.799
  718    HG2  GLU  88           2HG      GLU  88  -7.964  11.468  12.101
  719    HG3  GLU  88           1HG      GLU  88  -9.185  10.217  11.876
  720    H    GLY  89           HN       GLY  89  -4.704   9.741  13.338
  721    HA2  GLY  89           2HA      GLY  89  -3.364   8.425  14.835
  722    HA3  GLY  89           1HA      GLY  89  -3.796   6.998  13.900
  723    H    ASP  90           HN       ASP  90  -1.677   6.364  13.480
  724    HA   ASP  90           HA       ASP  90  -0.031   8.264  11.954
  725    HB2  ASP  90           2HB      ASP  90   0.736   6.867  14.110
  726    HB3  ASP  90           1HB      ASP  90   1.082   5.657  12.881
  727    H    ASN  91           HN       ASN  91   1.595   6.628  10.571
  728    HA   ASN  91           HA       ASN  91  -0.230   5.331   8.663
  729    HB2  ASN  91           2HB      ASN  91   1.216   7.205   7.808
  730    HB3  ASN  91           1HB      ASN  91   2.626   6.207   8.158
  731   HD21  ASN  91          1HD2      ASN  91   1.994   7.157   5.580
  732   HD22  ASN  91          2HD2      ASN  91   1.600   5.809   4.581
  733    HA   PRO  92           HA       PRO  92   1.590   1.632  10.703
  734    HB2  PRO  92           2HB      PRO  92  -0.066  -0.063   9.256
  735    HB3  PRO  92           1HB      PRO  92  -0.433   0.616  10.844
  736    HG2  PRO  92           2HG      PRO  92  -1.290   1.546   8.137
  737    HG3  PRO  92           1HG      PRO  92  -2.223   1.476   9.644
  738    HD2  PRO  92           2HD      PRO  92  -1.241   3.785   8.739
  739    HD3  PRO  92           1HD      PRO  92  -1.242   3.417  10.477
  740    H    ALA  93           HN       ALA  93   1.512   2.642   7.405
  741    HA   ALA  93           HA       ALA  93   3.085   0.394   6.438
  742    HB1  ALA  93           1HB      ALA  93   1.450   1.425   4.953
  743    HB2  ALA  93           2HB      ALA  93   3.080   1.582   4.298
  744    HB3  ALA  93           3HB      ALA  93   2.301   2.966   5.066
  745    H    ARG  94           HN       ARG  94   3.629   3.228   8.088
  746    HA   ARG  94           HA       ARG  94   6.233   3.884   7.024
  747    HB2  ARG  94           2HB      ARG  94   4.700   5.561   7.943
  748    HB3  ARG  94           1HB      ARG  94   4.752   4.774   9.500
  749    HG2  ARG  94           2HG      ARG  94   7.144   5.364   9.674
  750    HG3  ARG  94           1HG      ARG  94   6.994   6.241   8.142
  751    HD2  ARG  94           2HD      ARG  94   5.172   7.585   9.141
  752    HD3  ARG  94           1HD      ARG  94   5.439   6.764  10.673
  753    HE   ARG  94           HE       ARG  94   7.777   8.088   9.621
  754   HH11  ARG  94          1HH1      ARG  94   4.872   8.399  11.562
  755   HH12  ARG  94          2HH1      ARG  94   5.443   9.794  12.433
  756   HH21  ARG  94          1HH2      ARG  94   8.531   9.938  10.773
  757   HH22  ARG  94          2HH2      ARG  94   7.532  10.631  12.013
  758    H    TRP  95           HN       TRP  95   8.153   3.236   7.819
  759    HA   TRP  95           HA       TRP  95   8.119   1.441  10.156
  760    HB2  TRP  95           2HB      TRP  95   8.737   0.751   7.419
  761    HB3  TRP  95           1HB      TRP  95  10.117   0.447   8.469
  762    HD1  TRP  95           1HD      TRP  95   8.922  -0.763  11.005
  763    HE1  TRP  95           1HE      TRP  95   7.617  -2.984  10.983
  764    HE3  TRP  95           3HE      TRP  95   7.593  -0.881   6.066
  765    HZ2  TRP  95           2HZ      TRP  95   6.216  -4.573   9.117
  766    HZ3  TRP  95           3HZ      TRP  95   6.274  -2.786   5.247
  767    HH2  TRP  95           2HH      TRP  95   5.604  -4.596   6.741
  768    H    ARG  96           HN       ARG  96  10.009   3.568   8.084
  769    HA   ARG  96           HA       ARG  96  12.017   4.501   8.182
  770    HB2  ARG  96           2HB      ARG  96  11.540   4.334  11.144
  771    HB3  ARG  96           1HB      ARG  96  12.720   5.339  10.336
  772    HG2  ARG  96           2HG      ARG  96  10.998   6.609   9.246
  773    HG3  ARG  96           1HG      ARG  96   9.760   5.548   9.920
  774    HD2  ARG  96           2HD      ARG  96  11.658   7.183  11.593
  775    HD3  ARG  96           1HD      ARG  96  10.057   7.738  11.108
  776    HE   ARG  96           HE       ARG  96   9.144   5.828  12.369
  777   HH11  ARG  96          1HH1      ARG  96  12.427   6.846  13.047
  778   HH12  ARG  96          2HH1      ARG  96  12.409   6.278  14.689
  779   HH21  ARG  96          1HH2      ARG  96   9.102   5.086  14.523
  780   HH22  ARG  96          2HH2      ARG  96  10.511   5.253  15.527
  781    H    GLY  97           HN       GLY  97  11.731   1.616  10.126
  782    HA2  GLY  97           2HA      GLY  97  14.416   0.853   9.226
  783    HA3  GLY  97           1HA      GLY  97  14.024   0.721  10.938
  784    H    TYR  98           HN       TYR  98  13.375  -0.523   7.745
  785    HA   TYR  98           HA       TYR  98  11.413  -2.411   8.638
  786    HB2  TYR  98           2HB      TYR  98  11.439  -3.221   6.328
  787    HB3  TYR  98           1HB      TYR  98  11.269  -1.478   6.393
  788    HD1  TYR  98           1HD      TYR  98  13.698  -0.227   6.291
  789    HD2  TYR  98           2HD      TYR  98  12.779  -4.057   4.686
  790    HE1  TYR  98           1HE      TYR  98  15.540   0.013   4.684
  791    HE2  TYR  98           2HE      TYR  98  14.631  -3.834   3.084
  792    HH   TYR  98           HH       TYR  98  15.919  -1.927   1.996
  793    H    LEU  99           HN       LEU  99  11.995  -4.734   7.369
  794    HA   LEU  99           HA       LEU  99  13.111  -6.239   9.317
  795    HB2  LEU  99           2HB      LEU  99  13.245  -6.851   6.367
  796    HB3  LEU  99           1HB      LEU  99  13.377  -8.024   7.662
  797    HG   LEU  99           HG       LEU  99  10.924  -6.368   7.056
  798   HD11  LEU  99          1HD1      LEU  99   9.953  -8.483   6.309
  799   HD12  LEU  99          2HD1      LEU  99  11.502  -9.284   6.563
  800   HD13  LEU  99          3HD1      LEU  99  11.351  -8.030   5.334
  801   HD21  LEU  99          3HD2      LEU  99  11.115  -6.905   9.424
  802   HD22  LEU  99          1HD2      LEU  99  11.358  -8.606   9.031
  803   HD23  LEU  99          2HD2      LEU  99   9.815  -7.830   8.672
  804    H    GLU 100           HN       GLU 100  14.911  -5.680   6.279
  805    HA   GLU 100           HA       GLU 100  17.341  -5.276   7.817
  806    HB2  GLU 100           2HB      GLU 100  17.204  -7.725   7.445
  807    HB3  GLU 100           1HB      GLU 100  17.144  -7.439   5.711
  808    HG2  GLU 100           2HG      GLU 100  19.360  -6.544   5.718
  809    HG3  GLU 100           1HG      GLU 100  19.422  -6.587   7.478
  810    H    HIS 101           HN       HIS 101  18.610  -3.783   6.887
  811    HA   HIS 101           HA       HIS 101  17.544  -2.365   4.655
  812    HB2  HIS 101           2HB      HIS 101  18.682  -1.252   6.562
  813    HB3  HIS 101           1HB      HIS 101  20.202  -1.978   6.050
  814    HD1  HIS 101           1HD      HIS 101  21.606  -0.499   4.657
  815    HD2  HIS 101           2HD      HIS 101  17.564   0.441   4.321
  816    HE1  HIS 101           1HE      HIS 101  21.496   1.514   3.151
  817    HE2  HIS 101           2HE      HIS 101  19.052   2.128   3.034
  818    H    HIS 102           HN       HIS 102  17.764  -2.996   2.636
  819    HA   HIS 102           HA       HIS 102  20.351  -4.105   1.758
  820    HB2  HIS 102           2HB      HIS 102  17.548  -4.923   1.032
  821    HB3  HIS 102           1HB      HIS 102  18.877  -5.205  -0.086
  822    HD1  HIS 102           1HD      HIS 102  19.546  -7.562   0.056
  823    HD2  HIS 102           2HD      HIS 102  18.588  -6.015   3.796
  824    HE1  HIS 102           1HE      HIS 102  19.950  -9.433   1.689
  825    HE2  HIS 102           2HE      HIS 102  19.559  -8.411   3.963
  826    H    HIS 103           HN       HIS 103  21.158  -3.356  -0.201
  827    HA   HIS 103           HA       HIS 103  19.724  -1.601  -1.921
  828    HB2  HIS 103           2HB      HIS 103  20.035  -0.129   0.088
  829    HB3  HIS 103           1HB      HIS 103  21.774  -0.273  -0.134
  830    HD1  HIS 103           1HD      HIS 103  22.742   1.657  -1.318
  831    HD2  HIS 103           2HD      HIS 103  18.814   0.945  -2.480
  832    HE1  HIS 103           1HE      HIS 103  22.179   3.479  -2.959
  833    HE2  HIS 103           2HE      HIS 103  19.718   3.170  -3.442
  834    H    HIS 104           HN       HIS 104  20.617  -2.097  -3.820
  835    HA   HIS 104           HA       HIS 104  23.550  -2.369  -3.929
  836    HB2  HIS 104           2HB      HIS 104  23.376  -4.048  -5.626
  837    HB3  HIS 104           1HB      HIS 104  22.327  -4.534  -4.306
  838    HD1  HIS 104           1HD      HIS 104  19.819  -4.728  -4.793
  839    HD2  HIS 104           2HD      HIS 104  22.058  -3.343  -8.018
  840    HE1  HIS 104           1HE      HIS 104  18.286  -4.826  -6.779
  841    HE2  HIS 104           2HE      HIS 104  19.719  -4.179  -8.748
  842    H    HIS 105           HN       HIS 105  24.585  -1.588  -5.835
  843    HA   HIS 105           HA       HIS 105  23.117  -0.156  -7.840
  844    HB2  HIS 105           2HB      HIS 105  23.097   1.393  -5.798
  845    HB3  HIS 105           1HB      HIS 105  24.838   1.531  -6.011
  846    HD1  HIS 105           1HD      HIS 105  25.641   2.716  -8.283
  847    HD2  HIS 105           2HD      HIS 105  21.579   2.968  -7.427
  848    HE1  HIS 105           1HE      HIS 105  24.755   4.560  -9.740
  849    HE2  HIS 105           2HE      HIS 105  22.288   4.688  -9.226
  850    H    HIS 106           HN       HIS 106  24.324  -0.309  -9.648
  851    HA   HIS 106           HA       HIS 106  27.196  -0.043  -9.542
  852    HB2  HIS 106           2HB      HIS 106  26.798  -2.441  -8.918
  853    HB3  HIS 106           1HB      HIS 106  26.025  -2.676 -10.481
  854    HD1  HIS 106           1HD      HIS 106  29.300  -2.622  -8.830
  855    HD2  HIS 106           2HD      HIS 106  27.838  -2.404 -12.714
  856    HE1  HIS 106           1HE      HIS 106  31.271  -3.067 -10.319
  857    HE2  HIS 106           2HE      HIS 106  30.403  -2.725 -12.661
  Start of MODEL    5
    1    H1   MET   1           H1       MET   1 -16.115   2.646   5.357
    2    H2   MET   1           H2       MET   1 -16.217   4.327   5.137
    3    H3   MET   1           H3       MET   1 -15.009   3.677   6.127
    4    HA   MET   1           HA       MET   1 -15.260   3.295   3.204
    5    HB2  MET   1           2HB      MET   1 -14.498   5.516   3.679
    6    HB3  MET   1           1HB      MET   1 -13.400   4.941   4.922
    7    HG2  MET   1           2HG      MET   1 -11.989   3.911   3.265
    8    HG3  MET   1           1HG      MET   1 -13.116   4.335   1.983
    9    HE1  MET   1           2HE      MET   1 -13.686   6.920   1.350
   10    HE2  MET   1           3HE      MET   1 -12.905   8.288   2.143
   11    HE3  MET   1           1HE      MET   1 -13.996   7.246   3.055
   12    H    THR   2           HN       THR   2 -14.387   1.482   2.497
   13    HA   THR   2           HA       THR   2 -12.715  -0.098   4.290
   14    HB   THR   2           HB       THR   2 -12.854  -1.831   2.500
   15    HG1  THR   2           1HG      THR   2 -14.736  -0.074   1.272
   16   HG21  THR   2          3HG2      THR   2 -14.493  -1.774   4.329
   17   HG22  THR   2          1HG2      THR   2 -15.219  -2.351   2.828
   18   HG23  THR   2          2HG2      THR   2 -15.517  -0.703   3.375
   19    H    PHE   3           HN       PHE   3 -10.789  -1.234   3.196
   20    HA   PHE   3           HA       PHE   3  -8.916   0.758   2.522
   21    HB2  PHE   3           2HB      PHE   3  -8.308  -1.378   3.603
   22    HB3  PHE   3           1HB      PHE   3  -8.699  -2.232   2.115
   23    HD1  PHE   3           1HD      PHE   3  -6.422   0.288   3.577
   24    HD2  PHE   3           2HD      PHE   3  -7.121  -2.454   0.400
   25    HE1  PHE   3           1HE      PHE   3  -4.114   0.610   2.798
   26    HE2  PHE   3           2HE      PHE   3  -4.810  -2.137  -0.385
   27    HZ   PHE   3           HZ       PHE   3  -3.302  -0.604   0.817
   28    H    SER   4           HN       SER   4 -10.713  -1.546   0.551
   29    HA   SER   4           HA       SER   4  -9.438  -1.049  -1.905
   30    HB2  SER   4           2HB      SER   4 -12.329  -1.827  -1.450
   31    HB3  SER   4           1HB      SER   4 -11.399  -2.065  -2.931
   32    HG   SER   4           HG       SER   4 -11.154  -3.363  -0.444
   33    H    GLU   5           HN       GLU   5 -12.290   0.443  -0.422
   34    HA   GLU   5           HA       GLU   5 -12.966   2.147  -2.549
   35    HB2  GLU   5           2HB      GLU   5 -13.450   2.370   0.425
   36    HB3  GLU   5           1HB      GLU   5 -14.196   3.418  -0.764
   37    HG2  GLU   5           2HG      GLU   5 -15.322   1.543  -1.775
   38    HG3  GLU   5           1HG      GLU   5 -14.498   0.434  -0.682
   39    H    CYS   6           HN       CYS   6 -11.012   2.672   0.348
   40    HA   CYS   6           HA       CYS   6 -10.409   5.388  -0.067
   41    HB2  CYS   6           2HB      CYS   6 -10.068   4.164   2.050
   42    HB3  CYS   6           1HB      CYS   6  -8.774   3.259   1.313
   43    HG   CYS   6           HG       CYS   6  -8.084   6.409   0.891
   44    H    ALA   7           HN       ALA   7  -8.575   2.464  -0.838
   45    HA   ALA   7           HA       ALA   7  -6.358   3.631  -2.042
   46    HB1  ALA   7           1HB      ALA   7  -6.543   1.231  -1.516
   47    HB2  ALA   7           2HB      ALA   7  -6.007   1.517  -3.173
   48    HB3  ALA   7           3HB      ALA   7  -7.676   1.043  -2.857
   49    H    ALA   8           HN       ALA   8  -9.444   2.693  -3.529
   50    HA   ALA   8           HA       ALA   8  -8.799   3.410  -6.166
   51    HB1  ALA   8           1HB      ALA   8 -10.747   2.038  -5.557
   52    HB2  ALA   8           2HB      ALA   8 -11.186   3.396  -6.593
   53    HB3  ALA   8           3HB      ALA   8 -11.522   3.463  -4.862
   54    H    LEU   9           HN       LEU   9 -10.110   5.297  -3.481
   55    HA   LEU   9           HA       LEU   9 -10.679   7.641  -4.945
   56    HB2  LEU   9           2HB      LEU   9  -9.999   7.272  -2.029
   57    HB3  LEU   9           1HB      LEU   9 -10.559   8.778  -2.720
   58    HG   LEU   9           HG       LEU   9 -12.118   6.200  -2.612
   59   HD11  LEU   9          1HD1      LEU   9 -12.474   8.808  -1.148
   60   HD12  LEU   9          2HD1      LEU   9 -11.905   7.293  -0.447
   61   HD13  LEU   9          3HD1      LEU   9 -13.555   7.416  -1.060
   62   HD21  LEU   9          3HD2      LEU   9 -13.971   7.493  -3.511
   63   HD22  LEU   9          1HD2      LEU   9 -12.611   7.499  -4.633
   64   HD23  LEU   9          2HD2      LEU   9 -12.939   8.916  -3.637
   65    H    TYR  10           HN       TYR  10  -7.804   6.654  -3.098
   66    HA   TYR  10           HA       TYR  10  -6.261   8.944  -3.552
   67    HB2  TYR  10           2HB      TYR  10  -5.592   7.199  -1.956
   68    HB3  TYR  10           1HB      TYR  10  -5.331   6.073  -3.280
   69    HD1  TYR  10           2HD      TYR  10  -4.074   9.168  -1.698
   70    HD2  TYR  10           1HD      TYR  10  -3.319   6.114  -4.558
   71    HE1  TYR  10           2HE      TYR  10  -1.758   9.964  -1.930
   72    HE2  TYR  10           1HE      TYR  10  -1.006   6.906  -4.805
   73    HH   TYR  10           HH       TYR  10   0.384   9.258  -2.680
   74    H    ILE  11           HN       ILE  11  -6.586   5.975  -5.403
   75    HA   ILE  11           HA       ILE  11  -4.775   6.545  -7.457
   76    HB   ILE  11           HB       ILE  11  -7.278   4.858  -7.435
   77   HG12  ILE  11          2HG1      ILE  11  -4.352   4.091  -7.386
   78   HG13  ILE  11          1HG1      ILE  11  -5.370   4.216  -5.954
   79   HG21  ILE  11          1HG2      ILE  11  -6.532   3.838  -9.501
   80   HG22  ILE  11          2HG2      ILE  11  -5.146   4.920  -9.565
   81   HG23  ILE  11          3HG2      ILE  11  -6.775   5.567  -9.737
   82   HD11  ILE  11          3HD1      ILE  11  -6.765   2.415  -6.762
   83   HD12  ILE  11          1HD1      ILE  11  -5.078   1.908  -6.711
   84   HD13  ILE  11          2HD1      ILE  11  -5.827   2.326  -8.252
   85    H    LYS  12           HN       LYS  12  -8.290   7.140  -7.300
   86    HA   LYS  12           HA       LYS  12  -8.483   8.370  -9.835
   87    HB2  LYS  12           2HB      LYS  12 -10.221   8.536  -7.375
   88    HB3  LYS  12           1HB      LYS  12 -10.626   9.343  -8.883
   89    HG2  LYS  12           2HG      LYS  12 -10.703   7.218 -10.038
   90    HG3  LYS  12           1HG      LYS  12 -10.212   6.378  -8.567
   91    HD2  LYS  12           2HD      LYS  12 -12.632   6.216  -8.948
   92    HD3  LYS  12           1HD      LYS  12 -12.259   7.080  -7.457
   93    HE2  LYS  12           2HE      LYS  12 -12.655   9.204  -8.556
   94    HE3  LYS  12           1HE      LYS  12 -12.939   8.386 -10.092
   95    HZ1  LYS  12           3HZ      LYS  12 -14.581   7.956  -7.653
   96    HZ2  LYS  12           1HZ      LYS  12 -14.900   7.375  -9.213
   97    HZ3  LYS  12           2HZ      LYS  12 -14.994   9.036  -8.892
   98    H    ALA  13           HN       ALA  13  -7.743   9.651  -6.646
   99    HA   ALA  13           HA       ALA  13  -7.972  12.385  -7.298
  100    HB1  ALA  13           1HB      ALA  13  -6.257  11.089  -5.185
  101    HB2  ALA  13           2HB      ALA  13  -7.944  11.567  -4.997
  102    HB3  ALA  13           3HB      ALA  13  -6.703  12.793  -5.257
  103    H    HIS  14           HN       HIS  14  -5.609  10.075  -8.186
  104    HA   HIS  14           HA       HIS  14  -3.800  12.249  -9.014
  105    HB2  HIS  14           2HB      HIS  14  -2.999   9.537  -7.940
  106    HB3  HIS  14           1HB      HIS  14  -1.887  10.736  -8.589
  107    HD1  HIS  14           1HD      HIS  14  -4.048  10.010  -5.612
  108    HD2  HIS  14           2HD      HIS  14  -1.257  12.827  -6.863
  109    HE1  HIS  14           1HE      HIS  14  -3.523  11.397  -3.577
  110    HE2  HIS  14           2HE      HIS  14  -1.749  13.020  -4.327
  111    H    ARG  15           HN       ARG  15  -5.945  10.433 -10.301
  112    HA   ARG  15           HA       ARG  15  -4.793   8.680 -12.130
  113    HB2  ARG  15           2HB      ARG  15  -7.307  10.305 -12.089
  114    HB3  ARG  15           1HB      ARG  15  -6.875   9.439 -13.551
  115    HG2  ARG  15           2HG      ARG  15  -6.942   8.027 -10.927
  116    HG3  ARG  15           1HG      ARG  15  -8.427   8.319 -11.836
  117    HD2  ARG  15           2HD      ARG  15  -7.504   7.150 -13.758
  118    HD3  ARG  15           1HD      ARG  15  -5.982   6.915 -12.898
  119    HE   ARG  15           HE       ARG  15  -7.690   5.719 -11.245
  120   HH11  ARG  15          1HH1      ARG  15  -7.446   5.534 -14.724
  121   HH12  ARG  15          2HH1      ARG  15  -7.948   3.871 -14.812
  122   HH21  ARG  15          1HH2      ARG  15  -8.356   3.521 -11.340
  123   HH22  ARG  15          2HH2      ARG  15  -8.467   2.720 -12.878
  124    H    SER  16           HN       SER  16  -5.435  12.159 -12.468
  125    HA   SER  16           HA       SER  16  -4.419  12.294 -15.125
  126    HB2  SER  16           2HB      SER  16  -4.980  14.473 -13.110
  127    HB3  SER  16           1HB      SER  16  -4.742  14.693 -14.834
  128    HG   SER  16           HG       SER  16  -7.005  14.192 -13.597
  129    H    SER  17           HN       SER  17  -3.016  12.358 -12.012
  130    HA   SER  17           HA       SER  17  -0.747  13.969 -12.648
  131    HB2  SER  17           2HB      SER  17  -1.102  12.055 -10.333
  132    HB3  SER  17           1HB      SER  17   0.008  13.417 -10.430
  133    HG   SER  17           HG       SER  17  -1.641  14.301  -9.374
  134    H    TRP  18           HN       TRP  18  -1.425  10.494 -12.463
  135    HA   TRP  18           HA       TRP  18   1.362   9.832 -12.996
  136    HB2  TRP  18           2HB      TRP  18  -1.002   7.970 -12.793
  137    HB3  TRP  18           1HB      TRP  18   0.694   7.522 -12.760
  138    HD1  TRP  18           1HD      TRP  18   1.655   9.643 -10.538
  139    HE1  TRP  18           1HE      TRP  18   0.960   9.216  -8.077
  140    HE3  TRP  18           3HE      TRP  18  -2.357   6.612 -11.372
  141    HZ2  TRP  18           2HZ      TRP  18  -1.041   7.757  -6.702
  142    HZ3  TRP  18           3HZ      TRP  18  -3.595   5.723  -9.457
  143    HH2  TRP  18           2HH      TRP  18  -2.961   6.290  -7.163
  144    H    LYS  19           HN       LYS  19  -1.052  10.860 -14.917
  145    HA   LYS  19           HA       LYS  19  -1.682  10.628 -17.082
  146    HB2  LYS  19           2HB      LYS  19   0.464   8.487 -17.226
  147    HB3  LYS  19           1HB      LYS  19  -0.489   9.047 -18.595
  148    HG2  LYS  19           2HG      LYS  19   0.453  11.278 -18.356
  149    HG3  LYS  19           1HG      LYS  19   1.378  10.748 -16.953
  150    HD2  LYS  19           2HD      LYS  19   2.562   9.122 -18.382
  151    HD3  LYS  19           1HD      LYS  19   1.670   9.725 -19.778
  152    HE2  LYS  19           2HE      LYS  19   3.884  10.723 -19.691
  153    HE3  LYS  19           1HE      LYS  19   2.646  11.951 -19.426
  154    HZ1  LYS  19           3HZ      LYS  19   3.068  11.802 -17.044
  155    HZ2  LYS  19           1HZ      LYS  19   4.481  12.218 -17.886
  156    HZ3  LYS  19           2HZ      LYS  19   4.268  10.637 -17.312
  157    H    ASN  20           HN       ASN  20  -4.112   8.383 -17.010
  158    HA   ASN  20           HA       ASN  20  -4.271   8.949 -19.158
  159    HB2  ASN  20           2HB      ASN  20  -1.771  10.570 -18.622
  160    HB3  ASN  20           1HB      ASN  20  -2.633  10.577 -20.155
  161   HD21  ASN  20          1HD2      ASN  20  -4.689  11.491 -20.255
  162   HD22  ASN  20          2HD2      ASN  20  -5.266  12.593 -19.049
  163    H    THR  21           HN       THR  21  -2.484   6.873 -17.907
  164    HA   THR  21           HA       THR  21  -1.769   5.561 -20.383
  165    HB   THR  21           HB       THR  21   0.446   4.824 -19.366
  166    HG1  THR  21           1HG      THR  21  -0.110   7.065 -17.703
  167   HG21  THR  21          3HG2      THR  21   1.697   6.789 -20.120
  168   HG22  THR  21          1HG2      THR  21   0.210   7.738 -20.126
  169   HG23  THR  21          2HG2      THR  21   0.398   6.386 -21.242
  170    H    LYS  22           HN       LYS  22  -0.648   3.289 -19.411
  171    HA   LYS  22           HA       LYS  22  -2.790   2.142 -17.866
  172    HB2  LYS  22           2HB      LYS  22  -0.223   0.986 -18.946
  173    HB3  LYS  22           1HB      LYS  22  -1.421   0.049 -18.068
  174    HG2  LYS  22           2HG      LYS  22  -3.091   0.592 -19.785
  175    HG3  LYS  22           1HG      LYS  22  -1.861   1.496 -20.672
  176    HD2  LYS  22           2HD      LYS  22  -2.082  -0.692 -21.650
  177    HD3  LYS  22           1HD      LYS  22  -0.520  -0.584 -20.835
  178    HE2  LYS  22           2HE      LYS  22  -1.440  -1.773 -18.911
  179    HE3  LYS  22           1HE      LYS  22  -3.007  -1.874 -19.711
  180    HZ1  LYS  22           3HZ      LYS  22  -0.474  -3.119 -20.647
  181    HZ2  LYS  22           1HZ      LYS  22  -1.954  -3.177 -21.477
  182    HZ3  LYS  22           2HZ      LYS  22  -1.797  -3.928 -19.965
  183    H    HIS  23           HN       HIS  23  -0.475   4.045 -16.796
  184    HA   HIS  23           HA       HIS  23   0.792   2.636 -14.702
  185    HB2  HIS  23           2HB      HIS  23   0.062   5.570 -14.917
  186    HB3  HIS  23           1HB      HIS  23   1.058   4.897 -13.633
  187    HD1  HIS  23           1HD      HIS  23   2.035   7.080 -15.674
  188    HD2  HIS  23           2HD      HIS  23   2.770   2.997 -15.973
  189    HE1  HIS  23           1HE      HIS  23   4.113   6.861 -17.078
  190    HE2  HIS  23           2HE      HIS  23   4.661   4.401 -17.043
  191    H    ALA  24           HN       ALA  24  -2.254   4.435 -14.839
  192    HA   ALA  24           HA       ALA  24  -2.934   4.225 -12.111
  193    HB1  ALA  24           1HB      ALA  24  -3.968   5.825 -13.628
  194    HB2  ALA  24           2HB      ALA  24  -5.185   4.823 -12.836
  195    HB3  ALA  24           3HB      ALA  24  -4.736   4.507 -14.512
  196    H    ASP  25           HN       ASP  25  -3.582   2.111 -14.885
  197    HA   ASP  25           HA       ASP  25  -5.285   0.283 -13.573
  198    HB2  ASP  25           2HB      ASP  25  -4.987   0.355 -16.043
  199    HB3  ASP  25           1HB      ASP  25  -3.357  -0.273 -15.848
  200    H    GLN  26           HN       GLN  26  -1.793   0.317 -14.102
  201    HA   GLN  26           HA       GLN  26  -1.170  -2.069 -12.815
  202    HB2  GLN  26           2HB      GLN  26   0.372   0.444 -13.373
  203    HB3  GLN  26           1HB      GLN  26   1.112  -0.929 -12.570
  204    HG2  GLN  26           2HG      GLN  26   0.718  -2.336 -14.457
  205    HG3  GLN  26           1HG      GLN  26  -0.249  -1.092 -15.242
  206   HE21  GLN  26          1HE2      GLN  26   0.756   0.630 -16.213
  207   HE22  GLN  26          2HE2      GLN  26   2.456   0.654 -16.558
  208    H    TRP  27           HN       TRP  27  -1.522   1.207 -11.503
  209    HA   TRP  27           HA       TRP  27  -0.690   0.607  -8.873
  210    HB2  TRP  27           2HB      TRP  27  -2.249   2.766 -10.174
  211    HB3  TRP  27           1HB      TRP  27  -2.500   2.562  -8.444
  212    HD1  TRP  27           1HD      TRP  27   0.397   3.217 -10.934
  213    HE1  TRP  27           1HE      TRP  27   2.205   4.575  -9.702
  214    HE3  TRP  27           3HE      TRP  27  -1.656   3.244  -6.253
  215    HZ2  TRP  27           2HZ      TRP  27   2.694   5.531  -7.091
  216    HZ3  TRP  27           3HZ      TRP  27  -0.459   4.401  -4.446
  217    HH2  TRP  27           2HH      TRP  27   1.670   5.521  -4.855
  218    H    THR  28           HN       THR  28  -3.876   0.578 -10.397
  219    HA   THR  28           HA       THR  28  -5.308  -0.080  -8.036
  220    HB   THR  28           HB       THR  28  -6.225  -0.560 -10.876
  221    HG1  THR  28           1HG      THR  28  -5.553   1.595 -10.734
  222   HG21  THR  28          3HG2      THR  28  -7.736   0.054  -8.330
  223   HG22  THR  28          1HG2      THR  28  -7.664  -1.508  -9.143
  224   HG23  THR  28          2HG2      THR  28  -8.457  -0.142  -9.929
  225    H    ASN  29           HN       ASN  29  -4.186  -1.985 -10.802
  226    HA   ASN  29           HA       ASN  29  -5.591  -4.331 -10.314
  227    HB2  ASN  29           2HB      ASN  29  -4.245  -3.630 -12.374
  228    HB3  ASN  29           1HB      ASN  29  -2.830  -4.241 -11.527
  229   HD21  ASN  29          1HD2      ASN  29  -4.072  -5.091 -14.009
  230   HD22  ASN  29          2HD2      ASN  29  -4.437  -6.774 -13.814
  231    H    THR  30           HN       THR  30  -2.279  -3.494  -9.288
  232    HA   THR  30           HA       THR  30  -1.668  -5.958  -8.107
  233    HB   THR  30           HB       THR  30  -0.603  -3.338  -7.095
  234    HG1  THR  30           1HG      THR  30  -0.013  -4.711  -9.531
  235   HG21  THR  30          3HG2      THR  30   0.651  -6.061  -7.470
  236   HG22  THR  30          1HG2      THR  30   0.143  -5.357  -5.937
  237   HG23  THR  30          2HG2      THR  30   1.471  -4.630  -6.841
  238    H    ILE  31           HN       ILE  31  -2.981  -2.983  -6.656
  239    HA   ILE  31           HA       ILE  31  -3.017  -4.003  -4.009
  240    HB   ILE  31           HB       ILE  31  -4.589  -1.709  -5.195
  241   HG12  ILE  31          2HG1      ILE  31  -1.978  -1.715  -3.656
  242   HG13  ILE  31          1HG1      ILE  31  -2.135  -1.472  -5.393
  243   HG21  ILE  31          1HG2      ILE  31  -5.610  -2.459  -3.132
  244   HG22  ILE  31          2HG2      ILE  31  -4.797  -0.918  -2.867
  245   HG23  ILE  31          3HG2      ILE  31  -4.050  -2.415  -2.312
  246   HD11  ILE  31          3HD1      ILE  31  -3.409   0.568  -4.992
  247   HD12  ILE  31          1HD1      ILE  31  -1.818   0.634  -4.231
  248   HD13  ILE  31          2HD1      ILE  31  -3.252   0.324  -3.251
  249    H    LYS  32           HN       LYS  32  -5.453  -3.712  -6.535
  250    HA   LYS  32           HA       LYS  32  -7.681  -4.647  -5.128
  251    HB2  LYS  32           2HB      LYS  32  -7.768  -3.584  -7.343
  252    HB3  LYS  32           1HB      LYS  32  -6.959  -4.963  -8.050
  253    HG2  LYS  32           2HG      LYS  32  -9.554  -5.369  -6.639
  254    HG3  LYS  32           1HG      LYS  32  -9.544  -4.684  -8.264
  255    HD2  LYS  32           2HD      LYS  32  -8.108  -6.671  -8.930
  256    HD3  LYS  32           1HD      LYS  32  -8.518  -7.368  -7.364
  257    HE2  LYS  32           2HE      LYS  32 -10.901  -7.230  -7.942
  258    HE3  LYS  32           1HE      LYS  32 -10.471  -6.565  -9.517
  259    HZ1  LYS  32           3HZ      LYS  32 -10.807  -8.840  -9.882
  260    HZ2  LYS  32           1HZ      LYS  32  -9.958  -9.292  -8.482
  261    HZ3  LYS  32           2HZ      LYS  32  -9.121  -8.672  -9.819
  262    H    THR  33           HN       THR  33  -5.077  -6.340  -6.750
  263    HA   THR  33           HA       THR  33  -6.388  -8.901  -6.534
  264    HB   THR  33           HB       THR  33  -3.578  -8.244  -7.435
  265    HG1  THR  33           1HG      THR  33  -4.841  -7.328  -8.943
  266   HG21  THR  33          3HG2      THR  33  -3.687 -10.438  -8.553
  267   HG22  THR  33          1HG2      THR  33  -5.257 -10.732  -7.805
  268   HG23  THR  33          2HG2      THR  33  -3.815 -10.589  -6.802
  269    H    TYR  34           HN       TYR  34  -3.411  -7.475  -5.128
  270    HA   TYR  34           HA       TYR  34  -2.977  -9.854  -3.560
  271    HB2  TYR  34           2HB      TYR  34  -1.484  -7.249  -3.780
  272    HB3  TYR  34           1HB      TYR  34  -1.019  -8.515  -2.646
  273    HD1  TYR  34           2HD      TYR  34  -1.256  -7.598  -6.199
  274    HD2  TYR  34           1HD      TYR  34  -0.011 -10.565  -3.413
  275    HE1  TYR  34           2HE      TYR  34  -0.002  -8.734  -7.983
  276    HE2  TYR  34           1HE      TYR  34   1.249 -11.709  -5.188
  277    HH   TYR  34           HH       TYR  34   1.164 -11.878  -7.683
  278    H    CYS  35           HN       CYS  35  -3.801  -6.474  -2.805
  279    HA   CYS  35           HA       CYS  35  -3.845  -7.034   0.021
  280    HB2  CYS  35           2HB      CYS  35  -4.775  -4.556  -1.440
  281    HB3  CYS  35           1HB      CYS  35  -4.434  -4.689   0.282
  282    HG   CYS  35           HG       CYS  35  -1.656  -5.324  -0.268
  283    H    GLY  36           HN       GLY  36  -6.060  -7.168  -2.553
  284    HA2  GLY  36           2HA      GLY  36  -8.501  -6.495  -1.470
  285    HA3  GLY  36           1HA      GLY  36  -8.272  -7.730  -2.691
  286    HA   PRO  37           HA       PRO  37  -9.506 -10.966  -0.062
  287    HB2  PRO  37           2HB      PRO  37  -7.460 -12.768   0.106
  288    HB3  PRO  37           1HB      PRO  37  -8.484 -12.575  -1.319
  289    HG2  PRO  37           2HG      PRO  37  -5.758 -11.458  -0.781
  290    HG3  PRO  37           1HG      PRO  37  -6.393 -12.190  -2.266
  291    HD2  PRO  37           2HD      PRO  37  -6.192  -9.530  -1.981
  292    HD3  PRO  37           1HD      PRO  37  -7.535 -10.273  -2.873
  293    H    VAL  38           HN       VAL  38  -6.686  -9.283   0.952
  294    HA   VAL  38           HA       VAL  38  -6.658 -10.608   3.557
  295    HB   VAL  38           HB       VAL  38  -4.795  -8.439   2.581
  296   HG11  VAL  38          1HG1      VAL  38  -4.869  -8.674   4.999
  297   HG12  VAL  38          2HG1      VAL  38  -3.328  -9.257   4.368
  298   HG13  VAL  38          3HG1      VAL  38  -4.574 -10.405   4.857
  299   HG21  VAL  38          3HG2      VAL  38  -4.444 -11.435   2.490
  300   HG22  VAL  38          1HG2      VAL  38  -3.190 -10.249   2.133
  301   HG23  VAL  38          2HG2      VAL  38  -4.615 -10.359   1.104
  302    H    ILE  39           HN       ILE  39  -6.501  -7.201   2.454
  303    HA   ILE  39           HA       ILE  39  -8.066  -6.482   4.852
  304    HB   ILE  39           HB       ILE  39  -6.774  -4.352   4.930
  305   HG12  ILE  39          2HG1      ILE  39  -4.968  -5.758   2.945
  306   HG13  ILE  39          1HG1      ILE  39  -5.984  -4.367   2.586
  307   HG21  ILE  39          1HG2      ILE  39  -5.201  -6.903   5.251
  308   HG22  ILE  39          2HG2      ILE  39  -6.216  -6.122   6.464
  309   HG23  ILE  39          3HG2      ILE  39  -4.734  -5.339   5.919
  310   HD11  ILE  39          3HD1      ILE  39  -3.693  -4.401   4.538
  311   HD12  ILE  39          1HD1      ILE  39  -4.688  -3.005   4.126
  312   HD13  ILE  39          2HD1      ILE  39  -3.648  -3.739   2.905
  313    H    GLY  40           HN       GLY  40  -8.335  -6.696   1.680
  314    HA2  GLY  40           2HA      GLY  40  -8.913  -4.202   0.629
  315    HA3  GLY  40           1HA      GLY  40  -9.627  -5.703   0.071
  316    HA   PRO  41           HA       PRO  41 -13.510  -4.414   1.700
  317    HB2  PRO  41           2HB      PRO  41 -14.640  -6.576   2.793
  318    HB3  PRO  41           1HB      PRO  41 -14.254  -6.514   1.069
  319    HG2  PRO  41           2HG      PRO  41 -12.751  -7.827   3.301
  320    HG3  PRO  41           1HG      PRO  41 -13.104  -8.443   1.676
  321    HD2  PRO  41           2HD      PRO  41 -10.713  -7.302   2.408
  322    HD3  PRO  41           1HD      PRO  41 -11.333  -7.333   0.746
  323    H    LEU  42           HN       LEU  42 -11.105  -4.902   3.880
  324    HA   LEU  42           HA       LEU  42 -12.713  -4.722   6.287
  325    HB2  LEU  42           2HB      LEU  42  -9.725  -4.507   5.892
  326    HB3  LEU  42           1HB      LEU  42 -10.533  -4.533   7.446
  327    HG   LEU  42           HG       LEU  42 -10.434  -6.791   5.442
  328   HD11  LEU  42          1HD1      LEU  42  -9.159  -7.935   7.191
  329   HD12  LEU  42          2HD1      LEU  42  -9.209  -6.476   8.178
  330   HD13  LEU  42          3HD1      LEU  42  -8.346  -6.468   6.641
  331   HD21  LEU  42          3HD2      LEU  42 -11.764  -6.672   8.150
  332   HD22  LEU  42          1HD2      LEU  42 -11.605  -8.108   7.136
  333   HD23  LEU  42          2HD2      LEU  42 -12.588  -6.747   6.591
  334    H    SER  43           HN       SER  43 -12.529  -2.916   7.771
  335    HA   SER  43           HA       SER  43 -12.892  -0.397   6.659
  336    HB2  SER  43           2HB      SER  43 -13.579  -0.938   8.952
  337    HB3  SER  43           1HB      SER  43 -11.895  -1.108   9.430
  338    HG   SER  43           HG       SER  43 -12.896   0.962   9.932
  339    H    VAL  44           HN       VAL  44 -11.563   1.218   6.069
  340    HA   VAL  44           HA       VAL  44  -8.773   0.664   5.772
  341    HB   VAL  44           HB       VAL  44 -10.292   2.095   4.243
  342   HG11  VAL  44          1HG1      VAL  44 -10.218   4.512   4.694
  343   HG12  VAL  44          2HG1      VAL  44  -9.516   4.177   6.278
  344   HG13  VAL  44          3HG1      VAL  44 -11.146   3.623   5.901
  345   HG21  VAL  44          3HG2      VAL  44  -8.370   3.428   3.500
  346   HG22  VAL  44          1HG2      VAL  44  -7.934   1.755   3.851
  347   HG23  VAL  44          2HG2      VAL  44  -7.532   3.029   5.000
  348    H    GLN  45           HN       GLN  45 -10.620   1.715   8.336
  349    HA   GLN  45           HA       GLN  45  -8.476   3.253   9.581
  350    HB2  GLN  45           2HB      GLN  45 -10.815   4.007   9.840
  351    HB3  GLN  45           1HB      GLN  45 -11.203   2.489  10.639
  352    HG2  GLN  45           2HG      GLN  45  -9.674   3.027  12.448
  353    HG3  GLN  45           1HG      GLN  45  -9.223   4.526  11.639
  354   HE21  GLN  45          1HE2      GLN  45 -12.482   3.246  11.760
  355   HE22  GLN  45          2HE2      GLN  45 -13.129   4.501  12.760
  356    H    ASP  46           HN       ASP  46  -9.856   0.072   9.539
  357    HA   ASP  46           HA       ASP  46  -8.467  -0.660  11.997
  358    HB2  ASP  46           2HB      ASP  46 -10.533  -2.044  10.306
  359    HB3  ASP  46           1HB      ASP  46  -9.653  -2.887  11.574
  360    H    VAL  47           HN       VAL  47  -7.137  -0.096   9.364
  361    HA   VAL  47           HA       VAL  47  -5.890  -2.654   8.755
  362    HB   VAL  47           HB       VAL  47  -5.236   0.107   7.692
  363   HG11  VAL  47          1HG1      VAL  47  -3.342  -1.415   7.547
  364   HG12  VAL  47          2HG1      VAL  47  -3.994  -1.061   5.948
  365   HG13  VAL  47          3HG1      VAL  47  -4.347  -2.606   6.723
  366   HG21  VAL  47          3HG2      VAL  47  -6.874  -2.111   6.474
  367   HG22  VAL  47          1HG2      VAL  47  -6.412  -0.614   5.662
  368   HG23  VAL  47          2HG2      VAL  47  -7.476  -0.563   7.066
  369    H    ASP  48           HN       ASP  48  -4.497  -3.361  10.259
  370    HA   ASP  48           HA       ASP  48  -2.917  -1.451  11.805
  371    HB2  ASP  48           2HB      ASP  48  -3.253  -4.441  12.109
  372    HB3  ASP  48           1HB      ASP  48  -2.263  -3.438  13.158
  373    H    THR  49           HN       THR  49  -0.638  -2.076  12.308
  374    HA   THR  49           HA       THR  49   0.999  -2.320  10.061
  375    HB   THR  49           HB       THR  49   2.710  -2.961  11.909
  376    HG1  THR  49           1HG      THR  49   1.887  -3.297  13.819
  377   HG21  THR  49          3HG2      THR  49   2.520  -0.701  10.980
  378   HG22  THR  49          1HG2      THR  49   2.838  -0.659  12.713
  379   HG23  THR  49          2HG2      THR  49   1.210  -0.354  12.108
  380    H    LYS  50           HN       LYS  50  -0.040  -4.615  12.506
  381    HA   LYS  50           HA       LYS  50   1.405  -6.868  11.788
  382    HB2  LYS  50           2HB      LYS  50   0.008  -6.481  13.845
  383    HB3  LYS  50           1HB      LYS  50  -1.414  -6.797  12.873
  384    HG2  LYS  50           2HG      LYS  50   0.723  -8.856  12.931
  385    HG3  LYS  50           1HG      LYS  50  -0.296  -8.660  14.356
  386    HD2  LYS  50           2HD      LYS  50  -2.274  -8.812  12.746
  387    HD3  LYS  50           1HD      LYS  50  -1.104  -9.407  11.563
  388    HE2  LYS  50           2HE      LYS  50  -2.211 -11.255  12.714
  389    HE3  LYS  50           1HE      LYS  50  -0.486 -11.217  13.077
  390    HZ1  LYS  50           3HZ      LYS  50  -2.609 -10.113  14.844
  391    HZ2  LYS  50           1HZ      LYS  50  -0.951 -10.207  15.196
  392    HZ3  LYS  50           2HZ      LYS  50  -1.870 -11.625  15.046
  393    H    LEU  51           HN       LEU  51  -1.743  -5.742  10.635
  394    HA   LEU  51           HA       LEU  51  -2.332  -7.964   9.017
  395    HB2  LEU  51           2HB      LEU  51  -3.249  -5.101   8.814
  396    HB3  LEU  51           1HB      LEU  51  -3.934  -6.425   7.903
  397    HG   LEU  51           HG       LEU  51  -4.026  -6.059  10.887
  398   HD11  LEU  51          1HD1      LEU  51  -6.439  -5.916  10.526
  399   HD12  LEU  51          2HD1      LEU  51  -6.187  -6.064   8.788
  400   HD13  LEU  51          3HD1      LEU  51  -5.582  -4.651   9.648
  401   HD21  LEU  51          3HD2      LEU  51  -5.399  -8.101  10.912
  402   HD22  LEU  51          1HD2      LEU  51  -3.746  -8.416  10.379
  403   HD23  LEU  51          2HD2      LEU  51  -5.054  -8.335   9.198
  404    H    ILE  52           HN       ILE  52  -0.723  -4.886   8.312
  405    HA   ILE  52           HA       ILE  52  -0.444  -5.295   5.530
  406    HB   ILE  52           HB       ILE  52   1.318  -3.632   7.341
  407   HG12  ILE  52          2HG1      ILE  52  -1.139  -2.837   5.757
  408   HG13  ILE  52          1HG1      ILE  52  -1.094  -3.060   7.504
  409   HG21  ILE  52          1HG2      ILE  52   0.844  -3.485   4.363
  410   HG22  ILE  52          2HG2      ILE  52   2.317  -4.049   5.151
  411   HG23  ILE  52          3HG2      ILE  52   1.824  -2.363   5.305
  412   HD11  ILE  52          3HD1      ILE  52   0.477  -1.013   5.954
  413   HD12  ILE  52          1HD1      ILE  52   0.474  -1.215   7.706
  414   HD13  ILE  52          2HD1      ILE  52  -0.996  -0.709   6.874
  415    H    MET  53           HN       MET  53   1.584  -6.145   8.290
  416    HA   MET  53           HA       MET  53   3.849  -7.042   6.901
  417    HB2  MET  53           2HB      MET  53   2.670  -8.030   9.506
  418    HB3  MET  53           1HB      MET  53   4.265  -8.470   8.912
  419    HG2  MET  53           2HG      MET  53   4.952  -6.129   9.013
  420    HG3  MET  53           1HG      MET  53   3.349  -5.684   9.597
  421    HE1  MET  53           3HE      MET  53   5.602  -5.206  12.768
  422    HE2  MET  53           1HE      MET  53   4.451  -4.443  11.672
  423    HE3  MET  53           2HE      MET  53   6.056  -4.889  11.094
  424    H    LYS  54           HN       LYS  54   0.798  -8.621   7.638
  425    HA   LYS  54           HA       LYS  54   1.553 -11.187   6.701
  426    HB2  LYS  54           2HB      LYS  54  -1.079  -9.872   7.271
  427    HB3  LYS  54           1HB      LYS  54  -1.022 -11.448   6.492
  428    HG2  LYS  54           2HG      LYS  54   0.491 -10.998   9.027
  429    HG3  LYS  54           1HG      LYS  54  -1.250 -11.274   9.077
  430    HD2  LYS  54           2HD      LYS  54  -0.115 -13.381   9.375
  431    HD3  LYS  54           1HD      LYS  54  -0.913 -13.377   7.804
  432    HE2  LYS  54           2HE      LYS  54   1.236 -14.344   7.499
  433    HE3  LYS  54           1HE      LYS  54   1.290 -12.730   6.797
  434    HZ1  LYS  54           3HZ      LYS  54   2.393 -13.562   9.428
  435    HZ2  LYS  54           1HZ      LYS  54   2.353 -11.960   8.875
  436    HZ3  LYS  54           2HZ      LYS  54   3.281 -13.113   8.049
  437    H    VAL  55           HN       VAL  55   0.083  -8.382   5.146
  438    HA   VAL  55           HA       VAL  55  -0.476  -9.586   2.662
  439    HB   VAL  55           HB       VAL  55   0.323  -6.713   3.170
  440   HG11  VAL  55          1HG1      VAL  55   0.419  -7.308   0.812
  441   HG12  VAL  55          2HG1      VAL  55  -0.944  -6.232   1.123
  442   HG13  VAL  55          3HG1      VAL  55  -1.218  -7.959   0.894
  443   HG21  VAL  55          3HG2      VAL  55  -1.564  -7.369   4.570
  444   HG22  VAL  55          1HG2      VAL  55  -2.420  -7.962   3.147
  445   HG23  VAL  55          2HG2      VAL  55  -2.067  -6.242   3.311
  446    H    LEU  56           HN       LEU  56   2.403  -7.961   3.910
  447    HA   LEU  56           HA       LEU  56   3.859  -8.154   1.447
  448    HB2  LEU  56           2HB      LEU  56   4.799  -7.523   4.245
  449    HB3  LEU  56           1HB      LEU  56   5.761  -7.336   2.793
  450    HG   LEU  56           HG       LEU  56   3.233  -5.812   3.431
  451   HD11  LEU  56          1HD1      LEU  56   4.740  -3.883   3.632
  452   HD12  LEU  56          2HD1      LEU  56   6.124  -4.955   3.423
  453   HD13  LEU  56          3HD1      LEU  56   5.086  -5.124   4.837
  454   HD21  LEU  56          3HD2      LEU  56   5.154  -5.519   1.122
  455   HD22  LEU  56          1HD2      LEU  56   3.765  -4.488   1.456
  456   HD23  LEU  56          2HD2      LEU  56   3.522  -6.181   1.026
  457    H    ASP  57           HN       ASP  57   3.377 -10.203   4.151
  458    HA   ASP  57           HA       ASP  57   5.718 -11.547   4.529
  459    HB2  ASP  57           2HB      ASP  57   3.432 -11.836   5.686
  460    HB3  ASP  57           1HB      ASP  57   3.114 -13.042   4.462
  461    HA   PRO  58           HA       PRO  58   4.871 -14.853   1.183
  462    HB2  PRO  58           2HB      PRO  58   2.838 -14.615  -0.560
  463    HB3  PRO  58           1HB      PRO  58   2.599 -15.279   1.062
  464    HG2  PRO  58           2HG      PRO  58   2.066 -12.505   0.058
  465    HG3  PRO  58           1HG      PRO  58   1.034 -13.547   1.058
  466    HD2  PRO  58           2HD      PRO  58   2.578 -11.581   2.114
  467    HD3  PRO  58           1HD      PRO  58   2.207 -13.082   2.978
  468    H    ILE  59           HN       ILE  59   4.800 -11.504   0.513
  469    HA   ILE  59           HA       ILE  59   5.298 -11.711  -2.311
  470    HB   ILE  59           HB       ILE  59   5.785  -9.292  -0.567
  471   HG12  ILE  59          2HG1      ILE  59   3.271 -10.115  -2.044
  472   HG13  ILE  59          1HG1      ILE  59   3.474 -10.114  -0.294
  473   HG21  ILE  59          1HG2      ILE  59   6.799  -9.161  -2.773
  474   HG22  ILE  59          2HG2      ILE  59   5.417  -8.070  -2.678
  475   HG23  ILE  59          3HG2      ILE  59   5.269  -9.609  -3.526
  476   HD11  ILE  59          3HD1      ILE  59   2.225  -8.177  -1.038
  477   HD12  ILE  59          1HD1      ILE  59   3.559  -7.699  -2.085
  478   HD13  ILE  59          2HD1      ILE  59   3.766  -7.693  -0.333
  479    H    TRP  60           HN       TRP  60   7.243 -11.544   0.590
  480    HA   TRP  60           HA       TRP  60   9.719 -10.923  -0.665
  481    HB2  TRP  60           2HB      TRP  60   9.157 -12.370   1.932
  482    HB3  TRP  60           1HB      TRP  60  10.749 -11.818   1.419
  483    HD1  TRP  60           1HD      TRP  60   7.676 -10.677   3.205
  484    HE1  TRP  60           1HE      TRP  60   7.887  -8.192   3.833
  485    HE3  TRP  60           3HE      TRP  60  11.793  -9.484   0.419
  486    HZ2  TRP  60           2HZ      TRP  60   9.585  -6.009   3.230
  487    HZ3  TRP  60           3HZ      TRP  60  12.649  -7.181   0.500
  488    HH2  TRP  60           2HH      TRP  60  11.568  -5.480   1.876
  489    H    GLU  61           HN       GLU  61   7.800 -13.722  -0.622
  490    HA   GLU  61           HA       GLU  61   9.888 -15.618  -1.131
  491    HB2  GLU  61           2HB      GLU  61   6.881 -15.668  -1.298
  492    HB3  GLU  61           1HB      GLU  61   7.870 -17.033  -1.755
  493    HG2  GLU  61           2HG      GLU  61   7.983 -15.769   0.960
  494    HG3  GLU  61           1HG      GLU  61   6.901 -17.099   0.555
  495    H    GLN  62           HN       GLN  62   7.915 -13.438  -2.953
  496    HA   GLN  62           HA       GLN  62   8.460 -14.862  -5.451
  497    HB2  GLN  62           2HB      GLN  62   6.489 -12.636  -4.949
  498    HB3  GLN  62           1HB      GLN  62   6.606 -13.637  -6.380
  499    HG2  GLN  62           2HG      GLN  62   5.858 -14.616  -3.639
  500    HG3  GLN  62           1HG      GLN  62   4.726 -14.259  -4.941
  501   HE21  GLN  62          1HE2      GLN  62   3.929 -16.344  -4.969
  502   HE22  GLN  62          2HE2      GLN  62   4.844 -17.690  -5.573
  503    H    LYS  63           HN       LYS  63   8.184 -11.479  -4.329
  504    HA   LYS  63           HA       LYS  63  10.426 -10.755  -6.062
  505    HB2  LYS  63           2HB      LYS  63   7.702  -9.455  -6.193
  506    HB3  LYS  63           1HB      LYS  63   9.149  -8.794  -6.935
  507    HG2  LYS  63           2HG      LYS  63   9.315 -10.909  -8.275
  508    HG3  LYS  63           1HG      LYS  63   7.730 -11.351  -7.638
  509    HD2  LYS  63           2HD      LYS  63   7.462 -10.320  -9.808
  510    HD3  LYS  63           1HD      LYS  63   6.814  -9.245  -8.565
  511    HE2  LYS  63           2HE      LYS  63   9.038  -8.064  -8.589
  512    HE3  LYS  63           1HE      LYS  63   9.447  -9.022 -10.010
  513    HZ1  LYS  63           3HZ      LYS  63   7.624  -8.040 -11.202
  514    HZ2  LYS  63           1HZ      LYS  63   8.577  -6.805 -10.543
  515    HZ3  LYS  63           2HZ      LYS  63   7.099  -7.210  -9.821
  516    HA   PRO  64           HA       PRO  64  10.936  -9.088  -1.816
  517    HB2  PRO  64           2HB      PRO  64  13.599  -8.616  -3.067
  518    HB3  PRO  64           1HB      PRO  64  13.206  -9.276  -1.477
  519    HG2  PRO  64           2HG      PRO  64  13.999 -10.873  -3.446
  520    HG3  PRO  64           1HG      PRO  64  12.721 -11.383  -2.327
  521    HD2  PRO  64           2HD      PRO  64  12.508 -10.435  -5.147
  522    HD3  PRO  64           1HD      PRO  64  11.545 -11.656  -4.292
  523    H    GLU  65           HN       GLU  65  12.224  -7.509  -4.769
  524    HA   GLU  65           HA       GLU  65  12.422  -4.966  -3.594
  525    HB2  GLU  65           2HB      GLU  65  12.162  -5.784  -6.477
  526    HB3  GLU  65           1HB      GLU  65  12.616  -4.191  -5.923
  527    HG2  GLU  65           2HG      GLU  65  14.578  -5.212  -4.788
  528    HG3  GLU  65           1HG      GLU  65  14.147  -6.738  -5.557
  529    H    THR  66           HN       THR  66   9.880  -6.598  -5.394
  530    HA   THR  66           HA       THR  66   8.237  -4.307  -5.741
  531    HB   THR  66           HB       THR  66   7.444  -7.231  -5.774
  532    HG1  THR  66           1HG      THR  66   8.783  -5.575  -7.552
  533   HG21  THR  66          3HG2      THR  66   6.082  -4.804  -6.951
  534   HG22  THR  66          1HG2      THR  66   5.524  -5.717  -5.551
  535   HG23  THR  66          2HG2      THR  66   5.558  -6.479  -7.142
  536    H    ALA  67           HN       ALA  67   8.562  -6.726  -3.228
  537    HA   ALA  67           HA       ALA  67   6.245  -6.248  -1.760
  538    HB1  ALA  67           1HB      ALA  67   7.815  -8.077  -1.277
  539    HB2  ALA  67           2HB      ALA  67   7.450  -7.128   0.163
  540    HB3  ALA  67           3HB      ALA  67   8.985  -6.905  -0.674
  541    H    SER  68           HN       SER  68   9.435  -4.698  -1.419
  542    HA   SER  68           HA       SER  68   8.612  -2.896   0.582
  543    HB2  SER  68           2HB      SER  68  10.724  -1.650  -0.050
  544    HB3  SER  68           1HB      SER  68  10.944  -3.346   0.373
  545    HG   SER  68           HG       SER  68  10.494  -3.203  -2.249
  546    H    ARG  69           HN       ARG  69   8.573  -2.704  -2.929
  547    HA   ARG  69           HA       ARG  69   8.022   0.084  -3.031
  548    HB2  ARG  69           2HB      ARG  69   7.695  -2.092  -5.095
  549    HB3  ARG  69           1HB      ARG  69   7.516  -0.380  -5.415
  550    HG2  ARG  69           2HG      ARG  69   9.886  -0.110  -4.569
  551    HG3  ARG  69           1HG      ARG  69   9.992  -1.867  -4.650
  552    HD2  ARG  69           2HD      ARG  69  10.895  -1.000  -6.679
  553    HD3  ARG  69           1HD      ARG  69   9.329  -1.719  -7.058
  554    HE   ARG  69           HE       ARG  69   8.936   0.996  -6.514
  555   HH11  ARG  69          1HH1      ARG  69  10.505  -1.008  -8.919
  556   HH12  ARG  69          2HH1      ARG  69  10.312   0.157 -10.199
  557   HH21  ARG  69          1HH2      ARG  69   8.684   2.528  -8.165
  558   HH22  ARG  69          2HH2      ARG  69   9.251   2.170  -9.775
  559    H    LEU  70           HN       LEU  70   6.057  -2.838  -2.979
  560    HA   LEU  70           HA       LEU  70   3.585  -1.589  -3.563
  561    HB2  LEU  70           2HB      LEU  70   3.956  -4.032  -3.661
  562    HB3  LEU  70           1HB      LEU  70   4.104  -4.066  -1.914
  563    HG   LEU  70           HG       LEU  70   1.769  -3.303  -1.705
  564   HD11  LEU  70          1HD1      LEU  70   0.316  -3.288  -3.676
  565   HD12  LEU  70          2HD1      LEU  70   1.720  -3.561  -4.709
  566   HD13  LEU  70          3HD1      LEU  70   1.581  -2.064  -3.787
  567   HD21  LEU  70          3HD2      LEU  70   2.082  -5.745  -3.449
  568   HD22  LEU  70          1HD2      LEU  70   0.714  -5.377  -2.396
  569   HD23  LEU  70          2HD2      LEU  70   2.304  -5.698  -1.700
  570    H    ARG  71           HN       ARG  71   5.324  -2.207  -0.547
  571    HA   ARG  71           HA       ARG  71   3.415  -1.205   1.239
  572    HB2  ARG  71           2HB      ARG  71   5.516  -2.387   1.904
  573    HB3  ARG  71           1HB      ARG  71   6.419  -0.940   1.480
  574    HG2  ARG  71           2HG      ARG  71   4.533   0.068   3.164
  575    HG3  ARG  71           1HG      ARG  71   4.818  -1.528   3.855
  576    HD2  ARG  71           2HD      ARG  71   6.303   0.115   4.856
  577    HD3  ARG  71           1HD      ARG  71   7.221  -1.067   3.919
  578    HE   ARG  71           HE       ARG  71   7.645   0.585   2.286
  579   HH11  ARG  71          1HH1      ARG  71   5.790   1.838   4.989
  580   HH12  ARG  71          2HH1      ARG  71   6.195   3.503   4.650
  581   HH21  ARG  71          1HH2      ARG  71   8.170   2.794   1.863
  582   HH22  ARG  71          2HH2      ARG  71   7.543   4.032   2.906
  583    H    GLY  72           HN       GLY  72   5.815   0.387  -0.772
  584    HA2  GLY  72           2HA      GLY  72   5.581   2.993   0.240
  585    HA3  GLY  72           1HA      GLY  72   6.065   2.578  -1.398
  586    H    ARG  73           HN       ARG  73   3.676   1.266  -2.180
  587    HA   ARG  73           HA       ARG  73   2.000   3.421  -2.902
  588    HB2  ARG  73           2HB      ARG  73   1.469   0.443  -2.894
  589    HB3  ARG  73           1HB      ARG  73   0.371   1.627  -3.581
  590    HG2  ARG  73           2HG      ARG  73   2.168   2.308  -5.153
  591    HG3  ARG  73           1HG      ARG  73   3.168   1.005  -4.508
  592    HD2  ARG  73           2HD      ARG  73   1.482  -0.631  -5.185
  593    HD3  ARG  73           1HD      ARG  73   0.468   0.666  -5.809
  594    HE   ARG  73           HE       ARG  73   2.997   0.763  -7.054
  595   HH11  ARG  73          1HH1      ARG  73   0.046  -1.122  -7.016
  596   HH12  ARG  73          2HH1      ARG  73   0.253  -1.728  -8.631
  597   HH21  ARG  73          1HH2      ARG  73   3.268  -0.025  -9.197
  598   HH22  ARG  73          2HH2      ARG  73   2.081  -1.111  -9.855
  599    H    ILE  74           HN       ILE  74   1.649   0.850  -0.483
  600    HA   ILE  74           HA       ILE  74  -0.871   1.573   0.495
  601    HB   ILE  74           HB       ILE  74   1.378   0.229   2.014
  602   HG12  ILE  74          2HG1      ILE  74  -0.884  -0.988   0.411
  603   HG13  ILE  74          1HG1      ILE  74   0.789  -0.888  -0.128
  604   HG21  ILE  74          1HG2      ILE  74  -1.607   0.176   2.482
  605   HG22  ILE  74          2HG2      ILE  74  -0.431   1.056   3.456
  606   HG23  ILE  74          3HG2      ILE  74  -0.393  -0.707   3.411
  607   HD11  ILE  74          3HD1      ILE  74   1.468  -2.315   1.738
  608   HD12  ILE  74          1HD1      ILE  74   0.274  -3.101   0.705
  609   HD13  ILE  74          2HD1      ILE  74  -0.214  -2.423   2.259
  610    H    GLU  75           HN       GLU  75   2.384   2.513   1.612
  611    HA   GLU  75           HA       GLU  75   1.642   4.082   3.804
  612    HB2  GLU  75           2HB      GLU  75   3.983   3.475   3.241
  613    HB3  GLU  75           1HB      GLU  75   3.926   4.590   1.883
  614    HG2  GLU  75           2HG      GLU  75   3.482   6.432   3.486
  615    HG3  GLU  75           1HG      GLU  75   3.718   5.285   4.802
  616    H    SER  76           HN       SER  76   2.052   4.993   0.410
  617    HA   SER  76           HA       SER  76   1.501   7.729   0.733
  618    HB2  SER  76           2HB      SER  76   1.121   6.021  -1.719
  619    HB3  SER  76           1HB      SER  76   1.281   7.776  -1.691
  620    HG   SER  76           HG       SER  76   3.221   5.792  -1.334
  621    H    VAL  77           HN       VAL  77  -0.597   4.987  -0.087
  622    HA   VAL  77           HA       VAL  77  -2.934   6.519  -0.540
  623    HB   VAL  77           HB       VAL  77  -2.674   3.623   0.288
  624   HG11  VAL  77          1HG1      VAL  77  -5.068   5.087  -0.820
  625   HG12  VAL  77          2HG1      VAL  77  -4.888   4.490   0.830
  626   HG13  VAL  77          3HG1      VAL  77  -4.964   3.353  -0.514
  627   HG21  VAL  77          3HG2      VAL  77  -3.099   4.874  -2.425
  628   HG22  VAL  77          1HG2      VAL  77  -3.064   3.144  -2.079
  629   HG23  VAL  77          2HG2      VAL  77  -1.611   4.119  -1.850
  630    H    LEU  78           HN       LEU  78  -1.781   4.760   2.344
  631    HA   LEU  78           HA       LEU  78  -4.072   5.408   3.886
  632    HB2  LEU  78           2HB      LEU  78  -1.330   4.500   4.726
  633    HB3  LEU  78           1HB      LEU  78  -2.668   4.706   5.836
  634    HG   LEU  78           HG       LEU  78  -2.366   2.665   3.646
  635   HD11  LEU  78          1HD1      LEU  78  -2.661   1.084   5.437
  636   HD12  LEU  78          2HD1      LEU  78  -2.986   2.385   6.582
  637   HD13  LEU  78          3HD1      LEU  78  -1.384   2.219   5.873
  638   HD21  LEU  78          3HD2      LEU  78  -4.864   3.318   5.205
  639   HD22  LEU  78          1HD2      LEU  78  -4.645   1.924   4.146
  640   HD23  LEU  78          2HD2      LEU  78  -4.625   3.554   3.474
  641    H    ASP  79           HN       ASP  79  -0.881   6.912   3.561
  642    HA   ASP  79           HA       ASP  79  -1.098   8.748   5.672
  643    HB2  ASP  79           2HB      ASP  79   1.017   8.386   4.536
  644    HB3  ASP  79           1HB      ASP  79   0.350   8.990   3.024
  645    H    TRP  80           HN       TRP  80  -2.164   8.887   2.335
  646    HA   TRP  80           HA       TRP  80  -3.124  11.498   2.234
  647    HB2  TRP  80           2HB      TRP  80  -2.912  10.111   0.260
  648    HB3  TRP  80           1HB      TRP  80  -4.090   8.967   0.887
  649    HD1  TRP  80           1HD      TRP  80  -3.923  12.584  -0.468
  650    HE1  TRP  80           1HE      TRP  80  -6.210  13.149  -1.515
  651    HE3  TRP  80           3HE      TRP  80  -6.457   8.344   0.833
  652    HZ2  TRP  80           2HZ      TRP  80  -8.764  11.923  -1.753
  653    HZ3  TRP  80           3HZ      TRP  80  -8.808   8.112   0.157
  654    HH2  TRP  80           2HH      TRP  80  -9.938   9.867  -1.107
  655    H    ALA  81           HN       ALA  81  -4.810   8.503   3.159
  656    HA   ALA  81           HA       ALA  81  -7.299   9.763   3.630
  657    HB1  ALA  81           1HB      ALA  81  -6.319   7.122   4.697
  658    HB2  ALA  81           2HB      ALA  81  -7.056   7.378   3.115
  659    HB3  ALA  81           3HB      ALA  81  -7.997   7.653   4.581
  660    H    THR  82           HN       THR  82  -4.543   9.091   5.732
  661    HA   THR  82           HA       THR  82  -5.867   9.597   8.183
  662    HB   THR  82           HB       THR  82  -2.942   9.830   7.456
  663    HG1  THR  82           1HG      THR  82  -3.171   7.849   9.020
  664   HG21  THR  82          3HG2      THR  82  -3.434  11.232   9.407
  665   HG22  THR  82          1HG2      THR  82  -2.491   9.813   9.866
  666   HG23  THR  82          2HG2      THR  82  -4.224   9.866  10.195
  667    H    VAL  83           HN       VAL  83  -4.054  11.688   5.965
  668    HA   VAL  83           HA       VAL  83  -4.339  14.037   7.543
  669    HB   VAL  83           HB       VAL  83  -3.786  13.786   4.578
  670   HG11  VAL  83          1HG1      VAL  83  -2.882  16.047   4.747
  671   HG12  VAL  83          2HG1      VAL  83  -3.370  16.120   6.440
  672   HG13  VAL  83          3HG1      VAL  83  -4.594  16.013   5.174
  673   HG21  VAL  83          3HG2      VAL  83  -1.435  14.150   5.253
  674   HG22  VAL  83          1HG2      VAL  83  -2.104  12.646   5.888
  675   HG23  VAL  83          2HG2      VAL  83  -1.931  14.050   6.942
  676    H    ARG  84           HN       ARG  84  -6.230  12.580   4.952
  677    HA   ARG  84           HA       ARG  84  -8.065  14.712   4.619
  678    HB2  ARG  84           2HB      ARG  84  -8.380  11.749   4.110
  679    HB3  ARG  84           1HB      ARG  84  -9.538  12.970   3.604
  680    HG2  ARG  84           2HG      ARG  84  -6.661  12.914   2.727
  681    HG3  ARG  84           1HG      ARG  84  -7.992  12.199   1.817
  682    HD2  ARG  84           2HD      ARG  84  -7.808  15.103   2.603
  683    HD3  ARG  84           1HD      ARG  84  -7.355  14.458   1.026
  684    HE   ARG  84           HE       ARG  84 -10.094  14.455   2.139
  685   HH11  ARG  84          1HH1      ARG  84  -7.874  14.411  -0.574
  686   HH12  ARG  84          2HH1      ARG  84  -9.121  14.546  -1.772
  687   HH21  ARG  84          1HH2      ARG  84 -11.748  14.655   0.557
  688   HH22  ARG  84          2HH2      ARG  84 -11.319  14.679  -1.123
  689    H    GLY  85           HN       GLY  85  -7.744  12.215   6.990
  690    HA2  GLY  85           2HA      GLY  85  -8.773  12.195   9.087
  691    HA3  GLY  85           1HA      GLY  85  -9.930  13.384   8.506
  692    H    TYR  86           HN       TYR  86  -9.119  10.290   6.999
  693    HA   TYR  86           HA       TYR  86 -11.934   9.517   7.225
  694    HB2  TYR  86           2HB      TYR  86  -9.663   8.357   5.605
  695    HB3  TYR  86           1HB      TYR  86 -11.284   7.676   5.645
  696    HD1  TYR  86           2HD      TYR  86 -12.968  10.078   5.539
  697    HD2  TYR  86           1HD      TYR  86  -9.372   9.172   3.447
  698    HE1  TYR  86           2HE      TYR  86 -13.648  11.593   3.727
  699    HE2  TYR  86           1HE      TYR  86 -10.044  10.687   1.630
  700    HH   TYR  86           HH       TYR  86 -12.604  12.896   1.934
  701    H    ARG  87           HN       ARG  87  -9.350   9.255   9.109
  702    HA   ARG  87           HA       ARG  87 -10.434   7.070  10.600
  703    HB2  ARG  87           2HB      ARG  87  -8.586   5.559  10.519
  704    HB3  ARG  87           1HB      ARG  87  -9.005   5.920   8.849
  705    HG2  ARG  87           2HG      ARG  87  -7.154   7.436   8.652
  706    HG3  ARG  87           1HG      ARG  87  -6.778   7.264  10.367
  707    HD2  ARG  87           2HD      ARG  87  -5.238   5.908   9.162
  708    HD3  ARG  87           1HD      ARG  87  -6.389   4.823   9.941
  709    HE   ARG  87           HE       ARG  87  -7.232   4.239   7.871
  710   HH11  ARG  87          1HH1      ARG  87  -4.862   6.793   7.610
  711   HH12  ARG  87          2HH1      ARG  87  -4.779   6.714   5.877
  712   HH21  ARG  87          1HH2      ARG  87  -7.145   4.137   5.597
  713   HH22  ARG  87          2HH2      ARG  87  -6.086   5.196   4.725
  714    H    GLU  88           HN       GLU  88  -8.621   6.574  12.431
  715    HA   GLU  88           HA       GLU  88  -8.058   9.022  13.756
  716    HB2  GLU  88           2HB      GLU  88  -8.471   6.877  14.922
  717    HB3  GLU  88           1HB      GLU  88  -6.951   6.254  14.305
  718    HG2  GLU  88           2HG      GLU  88  -6.818   6.995  16.646
  719    HG3  GLU  88           1HG      GLU  88  -5.725   7.884  15.583
  720    H    GLY  89           HN       GLY  89  -5.795   9.558  14.518
  721    HA2  GLY  89           2HA      GLY  89  -4.288  10.259  12.234
  722    HA3  GLY  89           1HA      GLY  89  -3.790  10.491  13.899
  723    H    ASP  90           HN       ASP  90  -1.769  10.070  12.530
  724    HA   ASP  90           HA       ASP  90   0.087   8.858  12.150
  725    HB2  ASP  90           2HB      ASP  90  -0.280   8.029  14.442
  726    HB3  ASP  90           1HB      ASP  90  -1.257   6.717  13.800
  727    H    ASN  91           HN       ASN  91   0.944   6.878  11.071
  728    HA   ASN  91           HA       ASN  91  -1.015   5.630   9.293
  729    HB2  ASN  91           2HB      ASN  91  -0.095   7.516   8.021
  730    HB3  ASN  91           1HB      ASN  91   1.541   6.925   8.315
  731   HD21  ASN  91          1HD2      ASN  91   1.820   6.784   6.010
  732   HD22  ASN  91          2HD2      ASN  91   1.148   5.473   5.126
  733    HA   PRO  92           HA       PRO  92   1.499   2.368  11.265
  734    HB2  PRO  92           2HB      PRO  92  -0.249   0.415  10.329
  735    HB3  PRO  92           1HB      PRO  92  -0.343   1.213  11.901
  736    HG2  PRO  92           2HG      PRO  92  -1.836   1.792   9.380
  737    HG3  PRO  92           1HG      PRO  92  -2.404   1.839  11.060
  738    HD2  PRO  92           2HD      PRO  92  -1.841   4.084   9.727
  739    HD3  PRO  92           1HD      PRO  92  -1.454   3.919  11.453
  740    H    ALA  93           HN       ALA  93   0.537   2.827   7.945
  741    HA   ALA  93           HA       ALA  93   1.956   0.605   6.849
  742    HB1  ALA  93           1HB      ALA  93   0.987   3.172   5.608
  743    HB2  ALA  93           2HB      ALA  93   0.237   1.578   5.525
  744    HB3  ALA  93           3HB      ALA  93   1.763   1.877   4.700
  745    H    ARG  94           HN       ARG  94   2.895   3.651   8.082
  746    HA   ARG  94           HA       ARG  94   5.465   3.591   6.707
  747    HB2  ARG  94           2HB      ARG  94   4.442   5.779   6.940
  748    HB3  ARG  94           1HB      ARG  94   4.317   5.568   8.680
  749    HG2  ARG  94           2HG      ARG  94   6.607   5.810   9.001
  750    HG3  ARG  94           1HG      ARG  94   6.973   5.482   7.307
  751    HD2  ARG  94           2HD      ARG  94   5.493   7.911   8.298
  752    HD3  ARG  94           1HD      ARG  94   7.220   7.869   7.938
  753    HE   ARG  94           HE       ARG  94   6.203   7.004   5.636
  754   HH11  ARG  94          1HH1      ARG  94   5.286   9.718   7.657
  755   HH12  ARG  94          2HH1      ARG  94   4.691  10.672   6.327
  756   HH21  ARG  94          1HH2      ARG  94   5.443   8.247   3.891
  757   HH22  ARG  94          2HH2      ARG  94   4.765   9.827   4.185
  758    H    TRP  95           HN       TRP  95   7.261   2.916   7.582
  759    HA   TRP  95           HA       TRP  95   7.198   1.985  10.375
  760    HB2  TRP  95           2HB      TRP  95   7.853   0.556   7.870
  761    HB3  TRP  95           1HB      TRP  95   8.893   0.234   9.255
  762    HD1  TRP  95           1HD      TRP  95   7.472  -0.454  11.562
  763    HE1  TRP  95           1HE      TRP  95   5.525  -2.113  11.741
  764    HE3  TRP  95           3HE      TRP  95   5.940  -0.411   6.695
  765    HZ2  TRP  95           2HZ      TRP  95   3.571  -3.250  10.038
  766    HZ3  TRP  95           3HZ      TRP  95   4.023  -1.813   6.049
  767    HH2  TRP  95           2HH      TRP  95   2.864  -3.202   7.687
  768    H    ARG  96           HN       ARG  96   9.141   3.170   7.702
  769    HA   ARG  96           HA       ARG  96  11.282   3.681   7.403
  770    HB2  ARG  96           2HB      ARG  96  10.703   5.470   8.977
  771    HB3  ARG  96           1HB      ARG  96  11.173   4.428  10.316
  772    HG2  ARG  96           2HG      ARG  96  13.428   4.321   9.395
  773    HG3  ARG  96           1HG      ARG  96  12.956   5.444   8.126
  774    HD2  ARG  96           2HD      ARG  96  12.869   6.014  11.088
  775    HD3  ARG  96           1HD      ARG  96  14.105   6.591   9.971
  776    HE   ARG  96           HE       ARG  96  11.767   7.460   8.877
  777   HH11  ARG  96          1HH1      ARG  96  13.253   7.808  12.035
  778   HH12  ARG  96          2HH1      ARG  96  12.549   9.375  12.326
  779   HH21  ARG  96          1HH2      ARG  96  10.851   9.481   9.241
  780   HH22  ARG  96          2HH2      ARG  96  11.177  10.340  10.723
  781    H    GLY  97           HN       GLY  97  11.174   2.233  10.645
  782    HA2  GLY  97           2HA      GLY  97  13.463   0.544   9.900
  783    HA3  GLY  97           1HA      GLY  97  12.893   0.838  11.536
  784    H    TYR  98           HN       TYR  98  11.249  -0.285   8.572
  785    HA   TYR  98           HA       TYR  98   9.816  -2.329   9.978
  786    HB2  TYR  98           2HB      TYR  98   8.915  -1.328   7.917
  787    HB3  TYR  98           1HB      TYR  98  10.274  -1.965   6.998
  788    HD1  TYR  98           1HD      TYR  98   7.647  -3.240   9.336
  789    HD2  TYR  98           2HD      TYR  98   9.874  -3.890   5.773
  790    HE1  TYR  98           1HE      TYR  98   6.382  -5.305   8.929
  791    HE2  TYR  98           2HE      TYR  98   8.608  -5.960   5.355
  792    HH   TYR  98           HH       TYR  98   7.316  -7.641   6.747
  793    H    LEU  99           HN       LEU  99  12.381  -2.419   7.523
  794    HA   LEU  99           HA       LEU  99  13.124  -5.118   8.269
  795    HB2  LEU  99           2HB      LEU  99  14.372  -3.212   6.279
  796    HB3  LEU  99           1HB      LEU  99  14.803  -4.899   6.482
  797    HG   LEU  99           HG       LEU  99  12.105  -3.907   5.559
  798   HD11  LEU  99          1HD1      LEU  99  13.808  -3.447   3.898
  799   HD12  LEU  99          2HD1      LEU  99  12.791  -4.787   3.369
  800   HD13  LEU  99          3HD1      LEU  99  14.401  -5.103   4.012
  801   HD21  LEU  99          3HD2      LEU  99  11.702  -6.255   5.002
  802   HD22  LEU  99          1HD2      LEU  99  11.993  -6.044   6.729
  803   HD23  LEU  99          2HD2      LEU  99  13.266  -6.688   5.693
  804    H    GLU 100           HN       GLU 100  15.223  -2.359   7.615
  805    HA   GLU 100           HA       GLU 100  16.001  -1.840  10.257
  806    HB2  GLU 100           2HB      GLU 100  17.236  -4.147   9.215
  807    HB3  GLU 100           1HB      GLU 100  18.450  -2.876   9.122
  808    HG2  GLU 100           2HG      GLU 100  16.939  -3.720  11.587
  809    HG3  GLU 100           1HG      GLU 100  18.623  -4.085  11.214
  810    H    HIS 101           HN       HIS 101  17.496  -2.064   7.021
  811    HA   HIS 101           HA       HIS 101  18.101   0.817   7.226
  812    HB2  HIS 101           2HB      HIS 101  19.729  -1.359   5.888
  813    HB3  HIS 101           1HB      HIS 101  20.068   0.363   5.748
  814    HD1  HIS 101           1HD      HIS 101  21.134   1.540   7.786
  815    HD2  HIS 101           2HD      HIS 101  20.403  -2.517   8.361
  816    HE1  HIS 101           1HE      HIS 101  22.375   0.916   9.875
  817    HE2  HIS 101           2HE      HIS 101  21.792  -1.495  10.291
  818    H    HIS 102           HN       HIS 102  18.723   1.548   4.775
  819    HA   HIS 102           HA       HIS 102  16.493   0.631   3.077
  820    HB2  HIS 102           2HB      HIS 102  17.299   3.493   3.618
  821    HB3  HIS 102           1HB      HIS 102  16.179   3.004   2.354
  822    HD1  HIS 102           1HD      HIS 102  13.802   2.343   3.058
  823    HD2  HIS 102           2HD      HIS 102  16.282   3.369   6.238
  824    HE1  HIS 102           1HE      HIS 102  12.286   2.616   5.047
  825    HE2  HIS 102           2HE      HIS 102  13.843   2.977   6.989
  826    H    HIS 103           HN       HIS 103  19.441   2.644   3.073
  827    HA   HIS 103           HA       HIS 103  21.029   3.046   1.502
  828    HB2  HIS 103           2HB      HIS 103  20.103   0.332   0.589
  829    HB3  HIS 103           1HB      HIS 103  21.261   1.246  -0.369
  830    HD1  HIS 103           1HD      HIS 103  22.199  -1.383   0.725
  831    HD2  HIS 103           2HD      HIS 103  22.569   2.200   2.813
  832    HE1  HIS 103           1HE      HIS 103  24.075  -1.737   2.363
  833    HE2  HIS 103           2HE      HIS 103  24.417   0.505   3.459
  834    H    HIS 104           HN       HIS 104  18.482   4.238   1.228
  835    HA   HIS 104           HA       HIS 104  17.613   4.045  -1.497
  836    HB2  HIS 104           2HB      HIS 104  16.054   5.822  -1.006
  837    HB3  HIS 104           1HB      HIS 104  16.051   4.687   0.333
  838    HD1  HIS 104           1HD      HIS 104  16.129   8.202  -0.364
  839    HD2  HIS 104           2HD      HIS 104  17.758   5.749   2.583
  840    HE1  HIS 104           1HE      HIS 104  16.679   9.719   1.565
  841    HE2  HIS 104           2HE      HIS 104  17.771   8.240   3.289
  842    H    HIS 105           HN       HIS 105  18.616   4.821  -3.157
  843    HA   HIS 105           HA       HIS 105  19.833   6.095  -4.547
  844    HB2  HIS 105           2HB      HIS 105  18.817   8.066  -2.672
  845    HB3  HIS 105           1HB      HIS 105  20.386   8.524  -3.328
  846    HD1  HIS 105           1HD      HIS 105  19.939  10.139  -5.143
  847    HD2  HIS 105           2HD      HIS 105  17.286   6.937  -5.216
  848    HE1  HIS 105           1HE      HIS 105  18.519  10.482  -7.189
  849    HE2  HIS 105           2HE      HIS 105  17.061   8.434  -7.317
  850    H    HIS 106           HN       HIS 106  21.640   4.994  -4.605
  851    HA   HIS 106           HA       HIS 106  23.861   5.988  -2.967
  852    HB2  HIS 106           2HB      HIS 106  23.304   3.880  -1.957
  853    HB3  HIS 106           1HB      HIS 106  23.166   3.097  -3.528
  854    HD1  HIS 106           1HD      HIS 106  25.145   1.795  -4.218
  855    HD2  HIS 106           2HD      HIS 106  26.126   4.743  -1.453
  856    HE1  HIS 106           1HE      HIS 106  27.593   1.491  -3.745
  857    HE2  HIS 106           2HE      HIS 106  28.200   3.363  -2.176
  Start of MODEL    6
    1    H1   MET   1           H1       MET   1 -15.471   5.080   5.705
    2    H2   MET   1           H2       MET   1 -14.270   4.235   6.553
    3    H3   MET   1           H3       MET   1 -15.525   3.383   5.794
    4    HA   MET   1           HA       MET   1 -14.756   4.101   3.640
    5    HB2  MET   1           2HB      MET   1 -13.753   6.233   4.446
    6    HB3  MET   1           1HB      MET   1 -12.451   5.309   5.183
    7    HG2  MET   1           2HG      MET   1 -11.692   6.197   3.093
    8    HG3  MET   1           1HG      MET   1 -11.844   4.447   2.955
    9    HE1  MET   1           2HE      MET   1 -15.044   7.331   1.292
   10    HE2  MET   1           3HE      MET   1 -13.627   7.895   2.178
   11    HE3  MET   1           1HE      MET   1 -14.864   6.938   3.000
   12    H    THR   2           HN       THR   2 -13.968   2.342   2.685
   13    HA   THR   2           HA       THR   2 -12.358   0.493   4.286
   14    HB   THR   2           HB       THR   2 -12.756  -1.110   2.421
   15    HG1  THR   2           1HG      THR   2 -14.619   0.790   1.412
   16   HG21  THR   2          3HG2      THR   2 -15.153  -1.443   2.862
   17   HG22  THR   2          1HG2      THR   2 -15.234   0.164   3.585
   18   HG23  THR   2          2HG2      THR   2 -14.254  -1.093   4.339
   19    H    PHE   3           HN       PHE   3 -10.586  -0.694   3.011
   20    HA   PHE   3           HA       PHE   3  -8.709   1.240   2.136
   21    HB2  PHE   3           2HB      PHE   3  -8.075  -0.900   3.233
   22    HB3  PHE   3           1HB      PHE   3  -8.585  -1.764   1.785
   23    HD1  PHE   3           2HD      PHE   3  -6.259   0.899   2.926
   24    HD2  PHE   3           1HD      PHE   3  -7.068  -2.154   0.074
   25    HE1  PHE   3           2HE      PHE   3  -4.025   1.225   1.949
   26    HE2  PHE   3           1HE      PHE   3  -4.840  -1.828  -0.913
   27    HZ   PHE   3           HZ       PHE   3  -3.314  -0.136   0.024
   28    H    SER   4           HN       SER   4 -10.754  -1.107   0.454
   29    HA   SER   4           HA       SER   4  -9.788  -0.739  -2.133
   30    HB2  SER   4           2HB      SER   4 -12.660  -1.240  -1.328
   31    HB3  SER   4           1HB      SER   4 -11.928  -1.602  -2.893
   32    HG   SER   4           HG       SER   4 -10.787  -3.232  -2.013
   33    H    GLU   5           HN       GLU   5 -12.375   0.992  -0.429
   34    HA   GLU   5           HA       GLU   5 -13.072   2.730  -2.522
   35    HB2  GLU   5           2HB      GLU   5 -13.324   2.960   0.471
   36    HB3  GLU   5           1HB      GLU   5 -14.005   4.135  -0.635
   37    HG2  GLU   5           2HG      GLU   5 -15.416   2.434  -1.618
   38    HG3  GLU   5           1HG      GLU   5 -14.694   1.216  -0.567
   39    H    CYS   6           HN       CYS   6 -10.885   3.130   0.231
   40    HA   CYS   6           HA       CYS   6 -10.257   5.833  -0.261
   41    HB2  CYS   6           2HB      CYS   6  -9.899   4.470   1.865
   42    HB3  CYS   6           1HB      CYS   6  -8.443   3.860   1.107
   43    HG   CYS   6           HG       CYS   6  -7.765   6.779   0.659
   44    H    ALA   7           HN       ALA   7  -8.575   2.834  -1.087
   45    HA   ALA   7           HA       ALA   7  -6.376   3.953  -2.409
   46    HB1  ALA   7           1HB      ALA   7  -7.762   1.339  -3.018
   47    HB2  ALA   7           2HB      ALA   7  -6.498   1.580  -1.813
   48    HB3  ALA   7           3HB      ALA   7  -6.134   1.789  -3.525
   49    H    ALA   8           HN       ALA   8  -9.551   2.989  -3.657
   50    HA   ALA   8           HA       ALA   8  -9.113   3.643  -6.345
   51    HB1  ALA   8           1HB      ALA   8 -11.037   2.338  -5.577
   52    HB2  ALA   8           2HB      ALA   8 -11.536   3.712  -6.562
   53    HB3  ALA   8           3HB      ALA   8 -11.706   3.777  -4.807
   54    H    LEU   9           HN       LEU   9 -10.360   5.607  -3.661
   55    HA   LEU   9           HA       LEU   9 -10.875   7.943  -5.125
   56    HB2  LEU   9           2HB      LEU   9 -10.045   7.657  -2.235
   57    HB3  LEU   9           1HB      LEU   9 -10.687   9.119  -2.952
   58    HG   LEU   9           HG       LEU   9 -12.178   6.509  -2.675
   59   HD11  LEU   9          1HD1      LEU   9 -11.877   7.610  -0.542
   60   HD12  LEU   9          2HD1      LEU   9 -13.554   7.752  -1.072
   61   HD13  LEU   9          3HD1      LEU   9 -12.462   9.130  -1.219
   62   HD21  LEU   9          3HD2      LEU   9 -13.090   9.190  -3.710
   63   HD22  LEU   9          1HD2      LEU   9 -14.115   7.779  -3.449
   64   HD23  LEU   9          2HD2      LEU   9 -12.847   7.732  -4.673
   65    H    TYR  10           HN       TYR  10  -7.940   6.856  -3.459
   66    HA   TYR  10           HA       TYR  10  -6.387   9.149  -3.881
   67    HB2  TYR  10           2HB      TYR  10  -5.677   7.356  -2.372
   68    HB3  TYR  10           1HB      TYR  10  -5.497   6.258  -3.734
   69    HD1  TYR  10           1HD      TYR  10  -4.225   9.508  -2.434
   70    HD2  TYR  10           2HD      TYR  10  -3.416   6.053  -4.780
   71    HE1  TYR  10           1HE      TYR  10  -1.899  10.244  -2.708
   72    HE2  TYR  10           2HE      TYR  10  -1.082   6.784  -5.057
   73    HH   TYR  10           HH       TYR  10   0.243   9.419  -3.241
   74    H    ILE  11           HN       ILE  11  -6.701   6.214  -5.827
   75    HA   ILE  11           HA       ILE  11  -4.871   7.000  -7.834
   76    HB   ILE  11           HB       ILE  11  -7.121   4.982  -7.932
   77   HG12  ILE  11          2HG1      ILE  11  -4.140   4.605  -7.537
   78   HG13  ILE  11          1HG1      ILE  11  -5.326   4.606  -6.235
   79   HG21  ILE  11          1HG2      ILE  11  -4.802   5.371  -9.821
   80   HG22  ILE  11          2HG2      ILE  11  -6.500   5.675 -10.183
   81   HG23  ILE  11          3HG2      ILE  11  -5.947   4.031  -9.865
   82   HD11  ILE  11          3HD1      ILE  11  -5.204   2.646  -8.515
   83   HD12  ILE  11          1HD1      ILE  11  -6.396   2.644  -7.214
   84   HD13  ILE  11          2HD1      ILE  11  -4.694   2.351  -6.852
   85    H    LYS  12           HN       LYS  12  -8.431   7.133  -7.698
   86    HA   LYS  12           HA       LYS  12  -8.719   8.142 -10.331
   87    HB2  LYS  12           2HB      LYS  12 -10.606   8.177  -7.977
   88    HB3  LYS  12           1HB      LYS  12 -11.053   8.692  -9.599
   89    HG2  LYS  12           2HG      LYS  12 -10.619   6.487 -10.469
   90    HG3  LYS  12           1HG      LYS  12 -10.026   5.949  -8.901
   91    HD2  LYS  12           2HD      LYS  12 -12.271   5.141  -9.209
   92    HD3  LYS  12           1HD      LYS  12 -12.276   6.379  -7.953
   93    HE2  LYS  12           2HE      LYS  12 -13.193   7.997  -9.441
   94    HE3  LYS  12           1HE      LYS  12 -12.947   6.942 -10.835
   95    HZ1  LYS  12           3HZ      LYS  12 -14.792   6.373  -8.572
   96    HZ2  LYS  12           1HZ      LYS  12 -14.584   5.424  -9.963
   97    HZ3  LYS  12           2HZ      LYS  12 -15.262   6.971 -10.085
   98    H    ALA  13           HN       ALA  13  -8.326   9.721  -7.207
   99    HA   ALA  13           HA       ALA  13  -8.839  12.348  -8.277
  100    HB1  ALA  13           1HB      ALA  13  -9.286  11.849  -5.920
  101    HB2  ALA  13           2HB      ALA  13  -8.142  13.178  -6.095
  102    HB3  ALA  13           3HB      ALA  13  -7.566  11.570  -5.652
  103    H    HIS  14           HN       HIS  14  -6.384  10.314  -8.888
  104    HA   HIS  14           HA       HIS  14  -4.535  12.555  -9.359
  105    HB2  HIS  14           2HB      HIS  14  -3.880   9.836  -8.241
  106    HB3  HIS  14           1HB      HIS  14  -2.663  10.834  -9.025
  107    HD1  HIS  14           1HD      HIS  14  -4.584  10.446  -5.883
  108    HD2  HIS  14           2HD      HIS  14  -1.931  13.159  -7.580
  109    HE1  HIS  14           1HE      HIS  14  -3.834  11.934  -3.994
  110    HE2  HIS  14           2HE      HIS  14  -2.069  13.425  -5.005
  111    H    ARG  15           HN       ARG  15  -6.481  10.428 -10.818
  112    HA   ARG  15           HA       ARG  15  -4.766   9.187 -12.702
  113    HB2  ARG  15           2HB      ARG  15  -6.765   8.577 -13.911
  114    HB3  ARG  15           1HB      ARG  15  -7.035   8.349 -12.194
  115    HG2  ARG  15           2HG      ARG  15  -8.318  10.411 -12.104
  116    HG3  ARG  15           1HG      ARG  15  -8.007  10.690 -13.818
  117    HD2  ARG  15           2HD      ARG  15  -9.204   8.661 -14.397
  118    HD3  ARG  15           1HD      ARG  15  -9.459   8.298 -12.691
  119    HE   ARG  15           HE       ARG  15 -10.667  10.622 -12.808
  120   HH11  ARG  15          1HH1      ARG  15 -10.759   8.006 -15.148
  121   HH12  ARG  15          2HH1      ARG  15 -12.345   8.416 -15.732
  122   HH21  ARG  15          1HH2      ARG  15 -12.787  11.116 -13.536
  123   HH22  ARG  15          2HH2      ARG  15 -13.506  10.151 -14.794
  124    H    SER  16           HN       SER  16  -6.301  12.298 -12.536
  125    HA   SER  16           HA       SER  16  -5.905  13.080 -15.223
  126    HB2  SER  16           2HB      SER  16  -6.019  14.850 -12.778
  127    HB3  SER  16           1HB      SER  16  -6.498  15.248 -14.424
  128    HG   SER  16           HG       SER  16  -8.372  14.777 -13.362
  129    H    SER  17           HN       SER  17  -3.900  12.923 -12.409
  130    HA   SER  17           HA       SER  17  -1.822  14.633 -13.444
  131    HB2  SER  17           2HB      SER  17  -1.706  12.760 -11.068
  132    HB3  SER  17           1HB      SER  17  -0.714  14.182 -11.369
  133    HG   SER  17           HG       SER  17  -2.939  15.270 -11.391
  134    H    TRP  18           HN       TRP  18  -2.754  11.393 -13.747
  135    HA   TRP  18           HA       TRP  18  -0.056  10.537 -14.495
  136    HB2  TRP  18           2HB      TRP  18  -2.512   9.000 -13.671
  137    HB3  TRP  18           1HB      TRP  18  -1.154   8.214 -14.468
  138    HD1  TRP  18           1HD      TRP  18   1.204   9.708 -12.934
  139    HE1  TRP  18           1HE      TRP  18   1.668   9.133 -10.470
  140    HE3  TRP  18           3HE      TRP  18  -3.348   7.728 -11.701
  141    HZ2  TRP  18           2HZ      TRP  18   0.279   7.983  -8.288
  142    HZ3  TRP  18           3HZ      TRP  18  -3.695   6.910  -9.407
  143    HH2  TRP  18           2HH      TRP  18  -1.922   7.034  -7.739
  144    H    LYS  19           HN       LYS  19  -1.427  12.229 -16.255
  145    HA   LYS  19           HA       LYS  19  -1.593  12.457 -18.417
  146    HB2  LYS  19           2HB      LYS  19  -0.563   9.660 -18.466
  147    HB3  LYS  19           1HB      LYS  19  -0.940  10.563 -19.933
  148    HG2  LYS  19           2HG      LYS  19   0.561  12.394 -19.044
  149    HG3  LYS  19           1HG      LYS  19   1.085  11.247 -17.814
  150    HD2  LYS  19           2HD      LYS  19   2.639  11.318 -19.688
  151    HD3  LYS  19           1HD      LYS  19   1.872   9.736 -19.553
  152    HE2  LYS  19           2HE      LYS  19   0.378  10.240 -21.363
  153    HE3  LYS  19           1HE      LYS  19   0.938  11.911 -21.418
  154    HZ1  LYS  19           3HZ      LYS  19   2.924   9.788 -21.778
  155    HZ2  LYS  19           1HZ      LYS  19   2.856  11.337 -22.466
  156    HZ3  LYS  19           2HZ      LYS  19   1.858  10.100 -23.060
  157    H    ASN  20           HN       ASN  20  -4.044  11.293 -20.210
  158    HA   ASN  20           HA       ASN  20  -4.095   8.659 -19.600
  159    HB2  ASN  20           2HB      ASN  20  -3.594  10.038 -22.192
  160    HB3  ASN  20           1HB      ASN  20  -3.733   8.287 -22.071
  161   HD21  ASN  20          1HD2      ASN  20  -5.441  10.169 -23.454
  162   HD22  ASN  20          2HD2      ASN  20  -7.023   9.968 -22.780
  163    H    THR  21           HN       THR  21  -2.401   8.080 -18.320
  164    HA   THR  21           HA       THR  21  -0.865   6.347 -20.103
  165    HB   THR  21           HB       THR  21   0.855   6.149 -18.123
  166    HG1  THR  21           1HG      THR  21  -0.533   8.355 -17.421
  167   HG21  THR  21          3HG2      THR  21   2.335   7.732 -19.269
  168   HG22  THR  21          1HG2      THR  21   0.950   8.379 -20.148
  169   HG23  THR  21          2HG2      THR  21   1.454   6.706 -20.401
  170    H    LYS  22           HN       LYS  22  -0.296   4.261 -18.984
  171    HA   LYS  22           HA       LYS  22  -2.734   3.278 -17.860
  172    HB2  LYS  22           2HB      LYS  22  -0.086   1.907 -18.305
  173    HB3  LYS  22           1HB      LYS  22  -1.564   1.097 -17.816
  174    HG2  LYS  22           2HG      LYS  22  -2.622   1.902 -19.919
  175    HG3  LYS  22           1HG      LYS  22  -1.043   2.516 -20.412
  176    HD2  LYS  22           2HD      LYS  22  -1.714  -0.358 -19.777
  177    HD3  LYS  22           1HD      LYS  22  -1.470   0.317 -21.389
  178    HE2  LYS  22           2HE      LYS  22   0.839   0.818 -20.868
  179    HE3  LYS  22           1HE      LYS  22   0.610   0.272 -19.207
  180    HZ1  LYS  22           3HZ      LYS  22   0.446  -1.412 -21.650
  181    HZ2  LYS  22           1HZ      LYS  22   0.121  -1.957 -20.075
  182    HZ3  LYS  22           2HZ      LYS  22   1.681  -1.438 -20.490
  183    H    HIS  23           HN       HIS  23  -0.388   4.925 -16.330
  184    HA   HIS  23           HA       HIS  23   0.471   3.378 -14.187
  185    HB2  HIS  23           2HB      HIS  23   0.062   6.336 -14.501
  186    HB3  HIS  23           1HB      HIS  23   0.545   5.668 -12.946
  187    HD1  HIS  23           1HD      HIS  23   2.994   5.326 -12.609
  188    HD2  HIS  23           2HD      HIS  23   1.989   5.697 -16.630
  189    HE1  HIS  23           1HE      HIS  23   5.175   5.357 -13.856
  190    HE2  HIS  23           2HE      HIS  23   4.541   5.421 -16.293
  191    H    ALA  24           HN       ALA  24  -2.449   5.413 -14.391
  192    HA   ALA  24           HA       ALA  24  -3.318   5.052 -11.757
  193    HB1  ALA  24           1HB      ALA  24  -4.998   5.480 -14.227
  194    HB2  ALA  24           2HB      ALA  24  -4.251   6.744 -13.250
  195    HB3  ALA  24           3HB      ALA  24  -5.523   5.733 -12.562
  196    H    ASP  25           HN       ASP  25  -3.962   3.138 -14.662
  197    HA   ASP  25           HA       ASP  25  -5.792   1.369 -13.378
  198    HB2  ASP  25           2HB      ASP  25  -5.731   1.837 -15.841
  199    HB3  ASP  25           1HB      ASP  25  -4.235   0.920 -15.931
  200    H    GLN  26           HN       GLN  26  -2.370   1.179 -14.279
  201    HA   GLN  26           HA       GLN  26  -1.867  -1.442 -13.458
  202    HB2  GLN  26           2HB      GLN  26  -0.080   0.985 -13.590
  203    HB3  GLN  26           1HB      GLN  26   0.509  -0.632 -13.258
  204    HG2  GLN  26           2HG      GLN  26  -0.937   0.223 -15.751
  205    HG3  GLN  26           1HG      GLN  26   0.800  -0.015 -15.598
  206   HE21  GLN  26          1HE2      GLN  26   1.622  -2.091 -15.448
  207   HE22  GLN  26          2HE2      GLN  26   0.684  -3.493 -15.843
  208    H    TRP  27           HN       TRP  27  -1.685   1.606 -11.632
  209    HA   TRP  27           HA       TRP  27  -0.778   0.612  -9.194
  210    HB2  TRP  27           2HB      TRP  27  -2.469   2.928 -10.003
  211    HB3  TRP  27           1HB      TRP  27  -2.475   2.480  -8.303
  212    HD1  TRP  27           1HD      TRP  27   0.234   3.222 -10.998
  213    HE1  TRP  27           1HE      TRP  27   2.113   4.570  -9.861
  214    HE3  TRP  27           3HE      TRP  27  -1.623   3.319  -6.237
  215    HZ2  TRP  27           2HZ      TRP  27   2.716   5.541  -7.273
  216    HZ3  TRP  27           3HZ      TRP  27  -0.337   4.477  -4.492
  217    HH2  TRP  27           2HH      TRP  27   1.787   5.566  -4.999
  218    H    THR  28           HN       THR  28  -4.081   0.868 -10.424
  219    HA   THR  28           HA       THR  28  -5.394  -0.208  -8.192
  220    HB   THR  28           HB       THR  28  -6.291  -0.384 -11.078
  221    HG1  THR  28           1HG      THR  28  -5.823   1.777 -10.573
  222   HG21  THR  28          3HG2      THR  28  -7.862  -0.303  -8.499
  223   HG22  THR  28          1HG2      THR  28  -7.613  -1.728  -9.509
  224   HG23  THR  28          2HG2      THR  28  -8.539  -0.361 -10.127
  225    H    ASN  29           HN       ASN  29  -4.309  -1.740 -11.209
  226    HA   ASN  29           HA       ASN  29  -5.444  -4.226 -10.874
  227    HB2  ASN  29           2HB      ASN  29  -2.907  -3.385 -12.273
  228    HB3  ASN  29           1HB      ASN  29  -3.594  -4.988 -12.409
  229   HD21  ASN  29          1HD2      ASN  29  -3.138  -2.946 -14.427
  230   HD22  ASN  29          2HD2      ASN  29  -4.675  -2.614 -15.150
  231    H    THR  30           HN       THR  30  -2.199  -3.163  -9.860
  232    HA   THR  30           HA       THR  30  -1.369  -5.713  -8.977
  233    HB   THR  30           HB       THR  30  -0.337  -3.085  -7.930
  234    HG1  THR  30           1HG      THR  30  -0.126  -4.260 -10.461
  235   HG21  THR  30          3HG2      THR  30   0.535  -5.070  -6.812
  236   HG22  THR  30          1HG2      THR  30   1.790  -4.308  -7.787
  237   HG23  THR  30          2HG2      THR  30   0.982  -5.764  -8.371
  238    H    ILE  31           HN       ILE  31  -2.645  -2.904  -7.187
  239    HA   ILE  31           HA       ILE  31  -2.423  -4.121  -4.637
  240    HB   ILE  31           HB       ILE  31  -4.169  -1.808  -5.498
  241   HG12  ILE  31          2HG1      ILE  31  -1.438  -1.826  -4.192
  242   HG13  ILE  31          1HG1      ILE  31  -1.737  -1.482  -5.891
  243   HG21  ILE  31          1HG2      ILE  31  -4.951  -2.770  -3.410
  244   HG22  ILE  31          2HG2      ILE  31  -4.181  -1.212  -3.108
  245   HG23  ILE  31          3HG2      ILE  31  -3.321  -2.709  -2.743
  246   HD11  ILE  31          3HD1      ILE  31  -3.069   0.476  -5.231
  247   HD12  ILE  31          1HD1      ILE  31  -1.400   0.566  -4.672
  248   HD13  ILE  31          2HD1      ILE  31  -2.685   0.142  -3.541
  249    H    LYS  32           HN       LYS  32  -5.097  -3.776  -6.927
  250    HA   LYS  32           HA       LYS  32  -7.171  -4.774  -5.339
  251    HB2  LYS  32           2HB      LYS  32  -7.231  -3.619  -7.645
  252    HB3  LYS  32           1HB      LYS  32  -6.931  -5.211  -8.316
  253    HG2  LYS  32           2HG      LYS  32  -9.273  -4.668  -6.518
  254    HG3  LYS  32           1HG      LYS  32  -9.329  -4.377  -8.255
  255    HD2  LYS  32           2HD      LYS  32  -8.641  -6.768  -8.580
  256    HD3  LYS  32           1HD      LYS  32  -8.867  -6.996  -6.844
  257    HE2  LYS  32           2HE      LYS  32 -11.211  -6.224  -7.102
  258    HE3  LYS  32           1HE      LYS  32 -10.958  -6.144  -8.845
  259    HZ1  LYS  32           3HZ      LYS  32 -10.362  -8.556  -8.724
  260    HZ2  LYS  32           1HZ      LYS  32 -11.987  -8.205  -8.376
  261    HZ3  LYS  32           2HZ      LYS  32 -10.904  -8.551  -7.119
  262    H    THR  33           HN       THR  33  -4.679  -6.378  -7.182
  263    HA   THR  33           HA       THR  33  -5.919  -8.971  -7.059
  264    HB   THR  33           HB       THR  33  -3.132  -8.162  -7.916
  265    HG1  THR  33           1HG      THR  33  -4.448  -7.255  -9.386
  266   HG21  THR  33          3HG2      THR  33  -3.090 -10.307  -9.093
  267   HG22  THR  33          1HG2      THR  33  -4.675 -10.711  -8.434
  268   HG23  THR  33          2HG2      THR  33  -3.287 -10.548  -7.358
  269    H    TYR  34           HN       TYR  34  -3.010  -7.489  -5.578
  270    HA   TYR  34           HA       TYR  34  -2.426  -9.915  -4.149
  271    HB2  TYR  34           2HB      TYR  34  -1.144  -7.199  -4.203
  272    HB3  TYR  34           1HB      TYR  34  -0.606  -8.460  -3.099
  273    HD1  TYR  34           2HD      TYR  34   0.310 -10.595  -4.039
  274    HD2  TYR  34           1HD      TYR  34  -0.525  -7.217  -6.490
  275    HE1  TYR  34           2HE      TYR  34   1.733 -11.534  -5.808
  276    HE2  TYR  34           1HE      TYR  34   0.901  -8.147  -8.264
  277    HH   TYR  34           HH       TYR  34   1.991 -11.357  -8.241
  278    H    CYS  35           HN       CYS  35  -3.540  -6.670  -3.174
  279    HA   CYS  35           HA       CYS  35  -3.758  -7.690  -0.426
  280    HB2  CYS  35           2HB      CYS  35  -3.662  -4.835  -1.417
  281    HB3  CYS  35           1HB      CYS  35  -3.762  -5.324   0.271
  282    HG   CYS  35           HG       CYS  35  -1.210  -6.864  -1.050
  283    H    GLY  36           HN       GLY  36  -5.639  -6.990  -3.093
  284    HA2  GLY  36           2HA      GLY  36  -7.873  -5.661  -2.150
  285    HA3  GLY  36           1HA      GLY  36  -7.899  -6.854  -3.437
  286    HA   PRO  37           HA       PRO  37 -10.171  -9.739  -1.028
  287    HB2  PRO  37           2HB      PRO  37  -8.060 -11.805  -1.084
  288    HB3  PRO  37           1HB      PRO  37  -9.697 -11.852  -1.748
  289    HG2  PRO  37           2HG      PRO  37  -7.562 -11.649  -3.344
  290    HG3  PRO  37           1HG      PRO  37  -9.070 -10.796  -3.714
  291    HD2  PRO  37           2HD      PRO  37  -6.540  -9.737  -2.511
  292    HD3  PRO  37           1HD      PRO  37  -7.599  -9.002  -3.734
  293    H    VAL  38           HN       VAL  38  -7.063  -8.875   0.113
  294    HA   VAL  38           HA       VAL  38  -7.336 -10.370   2.599
  295    HB   VAL  38           HB       VAL  38  -5.083  -8.536   1.767
  296   HG11  VAL  38          1HG1      VAL  38  -3.806  -9.745   3.484
  297   HG12  VAL  38          2HG1      VAL  38  -5.258 -10.645   3.917
  298   HG13  VAL  38          3HG1      VAL  38  -5.196  -8.901   4.167
  299   HG21  VAL  38          3HG2      VAL  38  -5.308 -10.370   0.177
  300   HG22  VAL  38          1HG2      VAL  38  -5.303 -11.535   1.502
  301   HG23  VAL  38          2HG2      VAL  38  -3.862 -10.574   1.165
  302    H    ILE  39           HN       ILE  39  -6.475  -6.972   1.829
  303    HA   ILE  39           HA       ILE  39  -7.778  -6.236   4.375
  304    HB   ILE  39           HB       ILE  39  -6.223  -4.301   4.461
  305   HG12  ILE  39          2HG1      ILE  39  -4.833  -5.721   2.175
  306   HG13  ILE  39          1HG1      ILE  39  -5.700  -4.195   2.051
  307   HG21  ILE  39          1HG2      ILE  39  -5.786  -6.356   5.724
  308   HG22  ILE  39          2HG2      ILE  39  -4.289  -5.572   5.220
  309   HG23  ILE  39          3HG2      ILE  39  -4.869  -6.998   4.359
  310   HD11  ILE  39          3HD1      ILE  39  -3.239  -4.668   3.715
  311   HD12  ILE  39          1HD1      ILE  39  -4.093  -3.136   3.526
  312   HD13  ILE  39          2HD1      ILE  39  -3.286  -3.872   2.141
  313    H    GLY  40           HN       GLY  40  -8.339  -6.111   1.204
  314    HA2  GLY  40           2HA      GLY  40  -8.837  -3.449   0.545
  315    HA3  GLY  40           1HA      GLY  40  -9.643  -4.834  -0.167
  316    HA   PRO  41           HA       PRO  41 -13.446  -3.838   1.782
  317    HB2  PRO  41           2HB      PRO  41 -13.763  -6.405   3.164
  318    HB3  PRO  41           1HB      PRO  41 -14.672  -5.747   1.802
  319    HG2  PRO  41           2HG      PRO  41 -12.973  -7.818   1.523
  320    HG3  PRO  41           1HG      PRO  41 -13.212  -6.616   0.240
  321    HD2  PRO  41           2HD      PRO  41 -10.992  -6.839   2.241
  322    HD3  PRO  41           1HD      PRO  41 -10.907  -6.474   0.505
  323    H    LEU  42           HN       LEU  42 -10.829  -4.323   3.752
  324    HA   LEU  42           HA       LEU  42 -12.229  -4.022   6.278
  325    HB2  LEU  42           2HB      LEU  42  -9.277  -3.952   5.631
  326    HB3  LEU  42           1HB      LEU  42  -9.955  -3.913   7.246
  327    HG   LEU  42           HG       LEU  42 -10.152  -6.214   5.299
  328   HD11  LEU  42          1HD1      LEU  42  -8.730  -7.371   6.928
  329   HD12  LEU  42          2HD1      LEU  42  -8.606  -5.885   7.868
  330   HD13  LEU  42          3HD1      LEU  42  -7.926  -5.959   6.242
  331   HD21  LEU  42          3HD2      LEU  42 -11.156  -5.955   8.131
  332   HD22  LEU  42          1HD2      LEU  42 -11.167  -7.430   7.164
  333   HD23  LEU  42          2HD2      LEU  42 -12.152  -6.051   6.680
  334    H    SER  43           HN       SER  43 -11.717  -2.180   7.704
  335    HA   SER  43           HA       SER  43 -12.111   0.283   6.430
  336    HB2  SER  43           2HB      SER  43 -11.169  -0.202   9.257
  337    HB3  SER  43           1HB      SER  43 -12.103   1.145   8.641
  338    HG   SER  43           HG       SER  43 -12.940  -1.530   8.984
  339    H    VAL  44           HN       VAL  44 -10.678   1.818   5.784
  340    HA   VAL  44           HA       VAL  44  -7.968   1.108   5.398
  341    HB   VAL  44           HB       VAL  44  -9.213   2.640   3.912
  342   HG11  VAL  44          1HG1      VAL  44  -8.914   4.639   6.152
  343   HG12  VAL  44          2HG1      VAL  44 -10.422   3.936   5.566
  344   HG13  VAL  44          3HG1      VAL  44  -9.482   5.002   4.521
  345   HG21  VAL  44          3HG2      VAL  44  -7.379   4.177   3.469
  346   HG22  VAL  44          1HG2      VAL  44  -6.774   2.565   3.850
  347   HG23  VAL  44          2HG2      VAL  44  -6.697   3.845   5.061
  348    H    GLN  45           HN       GLN  45  -9.596   2.758   7.961
  349    HA   GLN  45           HA       GLN  45  -7.268   3.964   9.095
  350    HB2  GLN  45           2HB      GLN  45  -8.792   4.404  10.992
  351    HB3  GLN  45           1HB      GLN  45  -9.432   4.959   9.460
  352    HG2  GLN  45           2HG      GLN  45 -10.751   2.830   9.359
  353    HG3  GLN  45           1HG      GLN  45 -10.234   2.516  11.014
  354   HE21  GLN  45          1HE2      GLN  45 -10.322   5.391  11.691
  355   HE22  GLN  45          2HE2      GLN  45 -12.005   5.757  11.867
  356    H    ASP  46           HN       ASP  46  -8.656   0.842   9.111
  357    HA   ASP  46           HA       ASP  46  -7.519   0.073  11.676
  358    HB2  ASP  46           2HB      ASP  46  -9.319  -1.285   9.688
  359    HB3  ASP  46           1HB      ASP  46  -8.538  -2.197  10.972
  360    H    VAL  47           HN       VAL  47  -6.465   0.302   8.538
  361    HA   VAL  47           HA       VAL  47  -4.943  -2.055   8.246
  362    HB   VAL  47           HB       VAL  47  -4.356   0.688   7.112
  363   HG11  VAL  47          1HG1      VAL  47  -2.416  -0.788   7.032
  364   HG12  VAL  47          2HG1      VAL  47  -3.066  -0.503   5.418
  365   HG13  VAL  47          3HG1      VAL  47  -3.386  -2.031   6.239
  366   HG21  VAL  47          3HG2      VAL  47  -5.877  -1.628   5.920
  367   HG22  VAL  47          1HG2      VAL  47  -5.482  -0.118   5.097
  368   HG23  VAL  47          2HG2      VAL  47  -6.573  -0.108   6.483
  369    H    ASP  48           HN       ASP  48  -3.436  -2.722   9.602
  370    HA   ASP  48           HA       ASP  48  -1.632  -0.736  10.815
  371    HB2  ASP  48           2HB      ASP  48  -3.217  -1.452  12.510
  372    HB3  ASP  48           1HB      ASP  48  -2.898  -3.142  12.156
  373    H    THR  49           HN       THR  49   0.343  -1.837  11.734
  374    HA   THR  49           HA       THR  49   1.814  -3.025   9.695
  375    HB   THR  49           HB       THR  49   2.652  -3.664  12.464
  376    HG1  THR  49           1HG      THR  49   2.102  -1.727  13.148
  377   HG21  THR  49          3HG2      THR  49   3.987  -2.229  10.161
  378   HG22  THR  49          1HG2      THR  49   4.154  -3.943  10.542
  379   HG23  THR  49          2HG2      THR  49   4.772  -2.726  11.659
  380    H    LYS  50           HN       LYS  50  -0.072  -4.462  12.294
  381    HA   LYS  50           HA       LYS  50   0.827  -7.101  12.146
  382    HB2  LYS  50           2HB      LYS  50  -1.300  -5.644  13.363
  383    HB3  LYS  50           1HB      LYS  50  -1.981  -7.076  12.610
  384    HG2  LYS  50           2HG      LYS  50   0.302  -7.065  14.568
  385    HG3  LYS  50           1HG      LYS  50  -1.377  -7.441  14.954
  386    HD2  LYS  50           2HD      LYS  50  -1.280  -9.306  13.321
  387    HD3  LYS  50           1HD      LYS  50   0.438  -8.964  13.091
  388    HE2  LYS  50           2HE      LYS  50   0.832  -9.382  15.468
  389    HE3  LYS  50           1HE      LYS  50  -0.882  -9.726  15.692
  390    HZ1  LYS  50           3HZ      LYS  50   0.277 -11.774  15.486
  391    HZ2  LYS  50           1HZ      LYS  50   1.050 -11.273  14.059
  392    HZ3  LYS  50           2HZ      LYS  50  -0.622 -11.554  14.065
  393    H    LEU  51           HN       LEU  51  -1.768  -5.477  10.373
  394    HA   LEU  51           HA       LEU  51  -2.511  -7.748   8.832
  395    HB2  LEU  51           2HB      LEU  51  -2.983  -4.799   8.401
  396    HB3  LEU  51           1HB      LEU  51  -3.759  -6.072   7.491
  397    HG   LEU  51           HG       LEU  51  -4.082  -5.555  10.437
  398   HD11  LEU  51          1HD1      LEU  51  -6.017  -5.202   8.152
  399   HD12  LEU  51          2HD1      LEU  51  -5.197  -3.900   9.015
  400   HD13  LEU  51          3HD1      LEU  51  -6.359  -4.921   9.860
  401   HD21  LEU  51          3HD2      LEU  51  -5.421  -7.600   8.672
  402   HD22  LEU  51          1HD2      LEU  51  -5.792  -7.295  10.368
  403   HD23  LEU  51          2HD2      LEU  51  -4.215  -7.941   9.912
  404    H    ILE  52           HN       ILE  52  -0.386  -5.000   8.378
  405    HA   ILE  52           HA       ILE  52   0.178  -5.361   5.653
  406    HB   ILE  52           HB       ILE  52   1.745  -4.032   7.856
  407   HG12  ILE  52          2HG1      ILE  52   0.062  -2.907   5.612
  408   HG13  ILE  52          1HG1      ILE  52  -0.466  -3.083   7.282
  409   HG21  ILE  52          1HG2      ILE  52   3.312  -4.655   6.119
  410   HG22  ILE  52          2HG2      ILE  52   3.035  -2.913   6.088
  411   HG23  ILE  52          3HG2      ILE  52   2.264  -3.950   4.888
  412   HD11  ILE  52          3HD1      ILE  52   1.234  -1.509   8.000
  413   HD12  ILE  52          1HD1      ILE  52   0.190  -0.798   6.769
  414   HD13  ILE  52          2HD1      ILE  52   1.807  -1.356   6.339
  415    H    MET  53           HN       MET  53   1.799  -6.584   8.562
  416    HA   MET  53           HA       MET  53   3.961  -7.840   7.262
  417    HB2  MET  53           2HB      MET  53   2.602  -8.422   9.896
  418    HB3  MET  53           1HB      MET  53   4.039  -9.275   9.354
  419    HG2  MET  53           2HG      MET  53   5.281  -7.189   9.310
  420    HG3  MET  53           1HG      MET  53   3.837  -6.308   9.808
  421    HE1  MET  53           3HE      MET  53   6.124  -6.162  12.988
  422    HE2  MET  53           1HE      MET  53   5.177  -5.216  11.839
  423    HE3  MET  53           2HE      MET  53   6.619  -6.076  11.298
  424    H    LYS  54           HN       LYS  54   0.745  -9.022   8.154
  425    HA   LYS  54           HA       LYS  54   1.158 -11.705   7.492
  426    HB2  LYS  54           2HB      LYS  54  -1.225  -9.972   7.870
  427    HB3  LYS  54           1HB      LYS  54  -1.461 -11.518   7.065
  428    HG2  LYS  54           2HG      LYS  54   0.144 -11.658   9.514
  429    HG3  LYS  54           1HG      LYS  54  -1.524 -11.140   9.752
  430    HD2  LYS  54           2HD      LYS  54  -1.257 -13.583   9.946
  431    HD3  LYS  54           1HD      LYS  54  -2.346 -13.123   8.639
  432    HE2  LYS  54           2HE      LYS  54  -0.979 -14.863   7.794
  433    HE3  LYS  54           1HE      LYS  54  -0.387 -13.369   7.072
  434    HZ1  LYS  54           3HZ      LYS  54   0.817 -14.781   9.391
  435    HZ2  LYS  54           1HZ      LYS  54   1.395 -13.330   8.728
  436    HZ3  LYS  54           2HZ      LYS  54   1.433 -14.758   7.815
  437    H    VAL  55           HN       VAL  55   0.130  -8.990   5.485
  438    HA   VAL  55           HA       VAL  55  -0.474 -10.531   3.183
  439    HB   VAL  55           HB       VAL  55   0.421  -7.641   3.303
  440   HG11  VAL  55          1HG1      VAL  55  -0.746  -7.434   1.149
  441   HG12  VAL  55          2HG1      VAL  55  -1.062  -9.170   1.163
  442   HG13  VAL  55          3HG1      VAL  55   0.595  -8.575   1.064
  443   HG21  VAL  55          3HG2      VAL  55  -1.963  -7.091   3.269
  444   HG22  VAL  55          1HG2      VAL  55  -1.550  -8.037   4.698
  445   HG23  VAL  55          2HG2      VAL  55  -2.366  -8.807   3.336
  446    H    LEU  56           HN       LEU  56   2.461  -8.908   4.293
  447    HA   LEU  56           HA       LEU  56   3.894  -9.435   1.853
  448    HB2  LEU  56           2HB      LEU  56   4.735  -8.298   4.507
  449    HB3  LEU  56           1HB      LEU  56   5.825  -8.482   3.148
  450    HG   LEU  56           HG       LEU  56   3.363  -6.736   3.241
  451   HD11  LEU  56          1HD1      LEU  56   4.972  -4.904   3.074
  452   HD12  LEU  56          2HD1      LEU  56   6.299  -6.062   3.140
  453   HD13  LEU  56          3HD1      LEU  56   5.234  -5.863   4.531
  454   HD21  LEU  56          3HD2      LEU  56   3.702  -7.686   1.013
  455   HD22  LEU  56          1HD2      LEU  56   5.374  -7.126   1.025
  456   HD23  LEU  56          2HD2      LEU  56   4.052  -5.956   1.035
  457    H    ASP  57           HN       ASP  57   3.440 -11.052   4.835
  458    HA   ASP  57           HA       ASP  57   5.751 -12.261   5.503
  459    HB2  ASP  57           2HB      ASP  57   3.396 -12.489   6.507
  460    HB3  ASP  57           1HB      ASP  57   3.210 -13.854   5.433
  461    HA   PRO  58           HA       PRO  58   5.364 -15.943   2.478
  462    HB2  PRO  58           2HB      PRO  58   3.462 -16.023   0.584
  463    HB3  PRO  58           1HB      PRO  58   3.138 -16.535   2.246
  464    HG2  PRO  58           2HG      PRO  58   2.512 -13.920   0.920
  465    HG3  PRO  58           1HG      PRO  58   1.474 -14.920   1.954
  466    HD2  PRO  58           2HD      PRO  58   2.822 -12.750   2.879
  467    HD3  PRO  58           1HD      PRO  58   2.459 -14.162   3.887
  468    H    ILE  59           HN       ILE  59   5.108 -12.691   1.451
  469    HA   ILE  59           HA       ILE  59   5.859 -13.210  -1.304
  470    HB   ILE  59           HB       ILE  59   5.603 -10.545   0.098
  471   HG12  ILE  59          2HG1      ILE  59   3.570 -12.059  -1.564
  472   HG13  ILE  59          1HG1      ILE  59   3.493 -11.819   0.178
  473   HG21  ILE  59          1HG2      ILE  59   5.601 -11.254  -2.836
  474   HG22  ILE  59          2HG2      ILE  59   6.922 -10.480  -1.962
  475   HG23  ILE  59          3HG2      ILE  59   5.384  -9.640  -2.159
  476   HD11  ILE  59          3HD1      ILE  59   2.004 -10.297  -0.955
  477   HD12  ILE  59          1HD1      ILE  59   3.338  -9.675  -1.925
  478   HD13  ILE  59          2HD1      ILE  59   3.313  -9.400  -0.182
  479    H    TRP  60           HN       TRP  60   7.355 -11.997   1.655
  480    HA   TRP  60           HA       TRP  60   9.738 -10.991   0.598
  481    HB2  TRP  60           2HB      TRP  60   9.247 -12.349   3.257
  482    HB3  TRP  60           1HB      TRP  60  10.739 -11.518   2.838
  483    HD1  TRP  60           1HD      TRP  60   7.639 -10.929   4.618
  484    HE1  TRP  60           1HE      TRP  60   7.190  -8.420   4.928
  485    HE3  TRP  60           3HE      TRP  60  10.985  -9.070   1.226
  486    HZ2  TRP  60           2HZ      TRP  60   8.115  -5.975   3.871
  487    HZ3  TRP  60           3HZ      TRP  60  11.136  -6.635   0.939
  488    HH2  TRP  60           2HH      TRP  60   9.731  -5.121   2.234
  489    H    GLU  61           HN       GLU  61   8.725 -14.276   1.164
  490    HA   GLU  61           HA       GLU  61  11.188 -15.575   1.069
  491    HB2  GLU  61           2HB      GLU  61   8.559 -16.226   1.441
  492    HB3  GLU  61           1HB      GLU  61   8.889 -16.948  -0.126
  493    HG2  GLU  61           2HG      GLU  61  10.705 -17.410   2.193
  494    HG3  GLU  61           1HG      GLU  61   9.218 -18.323   1.988
  495    H    GLN  62           HN       GLN  62   8.759 -15.185  -1.517
  496    HA   GLN  62           HA       GLN  62  10.546 -16.283  -3.444
  497    HB2  GLN  62           2HB      GLN  62   8.039 -16.629  -3.336
  498    HB3  GLN  62           1HB      GLN  62   7.879 -14.991  -3.954
  499    HG2  GLN  62           2HG      GLN  62   9.178 -15.607  -5.901
  500    HG3  GLN  62           1HG      GLN  62   9.305 -17.253  -5.293
  501   HE21  GLN  62          1HE2      GLN  62   8.173 -16.333  -7.775
  502   HE22  GLN  62          2HE2      GLN  62   6.515 -16.836  -7.785
  503    H    LYS  63           HN       LYS  63   8.937 -13.113  -3.042
  504    HA   LYS  63           HA       LYS  63  11.073 -11.936  -4.678
  505    HB2  LYS  63           2HB      LYS  63   8.131 -11.379  -5.116
  506    HB3  LYS  63           1HB      LYS  63   9.464 -10.630  -5.980
  507    HG2  LYS  63           2HG      LYS  63  10.090 -12.844  -6.875
  508    HG3  LYS  63           1HG      LYS  63   8.694 -13.540  -6.059
  509    HD2  LYS  63           2HD      LYS  63   8.181 -13.147  -8.397
  510    HD3  LYS  63           1HD      LYS  63   7.212 -12.083  -7.375
  511    HE2  LYS  63           2HE      LYS  63   8.631 -10.216  -7.869
  512    HE3  LYS  63           1HE      LYS  63   9.788 -11.250  -8.707
  513    HZ1  LYS  63           3HZ      LYS  63   8.357 -11.529 -10.499
  514    HZ2  LYS  63           1HZ      LYS  63   8.161  -9.893 -10.103
  515    HZ3  LYS  63           2HZ      LYS  63   6.987 -11.027  -9.642
  516    HA   PRO  64           HA       PRO  64  10.340  -9.676  -0.713
  517    HB2  PRO  64           2HB      PRO  64  12.965  -8.924  -0.448
  518    HB3  PRO  64           1HB      PRO  64  12.299 -10.437   0.172
  519    HG2  PRO  64           2HG      PRO  64  13.834  -9.929  -2.342
  520    HG3  PRO  64           1HG      PRO  64  13.965 -11.280  -1.202
  521    HD2  PRO  64           2HD      PRO  64  12.651 -11.515  -3.540
  522    HD3  PRO  64           1HD      PRO  64  12.115 -12.363  -2.073
  523    H    GLU  65           HN       GLU  65  12.500  -8.571  -3.333
  524    HA   GLU  65           HA       GLU  65  12.299  -5.851  -2.719
  525    HB2  GLU  65           2HB      GLU  65  13.100  -7.329  -5.209
  526    HB3  GLU  65           1HB      GLU  65  13.220  -5.593  -5.040
  527    HG2  GLU  65           2HG      GLU  65  14.714  -5.880  -3.122
  528    HG3  GLU  65           1HG      GLU  65  14.613  -7.627  -3.330
  529    H    THR  66           HN       THR  66  10.359  -7.971  -4.717
  530    HA   THR  66           HA       THR  66   8.881  -5.913  -6.014
  531    HB   THR  66           HB       THR  66   7.923  -8.723  -5.471
  532    HG1  THR  66           1HG      THR  66  10.049  -7.820  -6.995
  533   HG21  THR  66          3HG2      THR  66   7.419  -6.817  -7.764
  534   HG22  THR  66          1HG2      THR  66   6.289  -7.167  -6.458
  535   HG23  THR  66          2HG2      THR  66   6.744  -8.438  -7.593
  536    H    ALA  67           HN       ALA  67   8.554  -7.676  -2.997
  537    HA   ALA  67           HA       ALA  67   5.976  -6.807  -2.266
  538    HB1  ALA  67           1HB      ALA  67   7.138  -8.624  -1.098
  539    HB2  ALA  67           2HB      ALA  67   6.627  -7.365   0.025
  540    HB3  ALA  67           3HB      ALA  67   8.316  -7.471  -0.472
  541    H    SER  68           HN       SER  68   9.178  -5.390  -1.816
  542    HA   SER  68           HA       SER  68   8.393  -3.151  -0.307
  543    HB2  SER  68           2HB      SER  68  10.679  -3.302  -2.283
  544    HB3  SER  68           1HB      SER  68  10.541  -2.215  -0.903
  545    HG   SER  68           HG       SER  68  10.516  -4.156   0.419
  546    H    ARG  69           HN       ARG  69   8.572  -3.721  -3.789
  547    HA   ARG  69           HA       ARG  69   8.040  -1.134  -4.692
  548    HB2  ARG  69           2HB      ARG  69   7.363  -3.818  -5.898
  549    HB3  ARG  69           1HB      ARG  69   7.221  -2.300  -6.745
  550    HG2  ARG  69           2HG      ARG  69   9.631  -1.942  -6.527
  551    HG3  ARG  69           1HG      ARG  69   9.760  -3.485  -5.680
  552    HD2  ARG  69           2HD      ARG  69   8.818  -4.605  -7.679
  553    HD3  ARG  69           1HD      ARG  69   8.829  -3.054  -8.514
  554    HE   ARG  69           HE       ARG  69  11.414  -3.609  -7.519
  555   HH11  ARG  69          1HH1      ARG  69   9.169  -4.644 -10.008
  556   HH12  ARG  69          2HH1      ARG  69  10.416  -5.195 -11.085
  557   HH21  ARG  69          1HH2      ARG  69  13.060  -4.398  -8.926
  558   HH22  ARG  69          2HH2      ARG  69  12.609  -5.101 -10.456
  559    H    LEU  70           HN       LEU  70   5.896  -3.762  -3.737
  560    HA   LEU  70           HA       LEU  70   3.485  -2.445  -4.504
  561    HB2  LEU  70           2HB      LEU  70   3.600  -4.866  -4.345
  562    HB3  LEU  70           1HB      LEU  70   4.002  -4.765  -2.642
  563    HG   LEU  70           HG       LEU  70   1.755  -3.784  -2.210
  564   HD11  LEU  70          1HD1      LEU  70   1.315  -2.840  -4.400
  565   HD12  LEU  70          2HD1      LEU  70   0.040  -3.972  -3.950
  566   HD13  LEU  70          3HD1      LEU  70   1.278  -4.452  -5.110
  567   HD21  LEU  70          3HD2      LEU  70   0.528  -5.867  -2.448
  568   HD22  LEU  70          1HD2      LEU  70   2.181  -6.177  -1.917
  569   HD23  LEU  70          2HD2      LEU  70   1.727  -6.460  -3.597
  570    H    ARG  71           HN       ARG  71   5.378  -2.654  -1.555
  571    HA   ARG  71           HA       ARG  71   3.357  -1.692   0.179
  572    HB2  ARG  71           2HB      ARG  71   5.512  -2.950   0.794
  573    HB3  ARG  71           1HB      ARG  71   6.301  -1.380   0.700
  574    HG2  ARG  71           2HG      ARG  71   5.804  -1.600   2.951
  575    HG3  ARG  71           1HG      ARG  71   4.484  -0.600   2.346
  576    HD2  ARG  71           2HD      ARG  71   4.426  -3.554   2.948
  577    HD3  ARG  71           1HD      ARG  71   3.560  -2.274   3.793
  578    HE   ARG  71           HE       ARG  71   2.634  -2.094   1.248
  579   HH11  ARG  71          1HH1      ARG  71   2.821  -4.693   3.582
  580   HH12  ARG  71          2HH1      ARG  71   1.484  -5.567   2.915
  581   HH21  ARG  71          1HH2      ARG  71   0.873  -3.251   0.351
  582   HH22  ARG  71          2HH2      ARG  71   0.365  -4.739   1.077
  583    H    GLY  72           HN       GLY  72   5.928  -0.100  -1.643
  584    HA2  GLY  72           2HA      GLY  72   5.777   2.437  -0.450
  585    HA3  GLY  72           1HA      GLY  72   6.344   2.117  -2.082
  586    H    ARG  73           HN       ARG  73   3.843   0.995  -3.009
  587    HA   ARG  73           HA       ARG  73   2.536   3.369  -3.824
  588    HB2  ARG  73           2HB      ARG  73   1.562   0.509  -3.966
  589    HB3  ARG  73           1HB      ARG  73   0.861   1.865  -4.835
  590    HG2  ARG  73           2HG      ARG  73   2.997   2.156  -6.039
  591    HG3  ARG  73           1HG      ARG  73   3.627   0.732  -5.206
  592    HD2  ARG  73           2HD      ARG  73   1.782  -0.597  -6.169
  593    HD3  ARG  73           1HD      ARG  73   1.254   0.827  -7.061
  594    HE   ARG  73           HE       ARG  73   3.969   0.306  -7.621
  595   HH11  ARG  73          1HH1      ARG  73   0.768  -0.928  -8.294
  596   HH12  ARG  73          2HH1      ARG  73   1.226  -1.688  -9.783
  597   HH21  ARG  73          1HH2      ARG  73   4.589  -0.669  -9.594
  598   HH22  ARG  73          2HH2      ARG  73   3.402  -1.544 -10.528
  599    H    ILE  74           HN       ILE  74   1.605   0.793  -1.569
  600    HA   ILE  74           HA       ILE  74  -0.853   1.957  -0.797
  601    HB   ILE  74           HB       ILE  74   0.879  -0.092   0.583
  602   HG12  ILE  74          2HG1      ILE  74  -1.620  -0.230  -1.112
  603   HG13  ILE  74          1HG1      ILE  74  -0.026  -0.849  -1.520
  604   HG21  ILE  74          1HG2      ILE  74  -1.057  -0.590   2.000
  605   HG22  ILE  74          2HG2      ILE  74  -1.921   0.774   1.293
  606   HG23  ILE  74          3HG2      ILE  74  -0.474   1.054   2.259
  607   HD11  ILE  74          3HD1      ILE  74  -1.775  -1.883   0.693
  608   HD12  ILE  74          1HD1      ILE  74  -0.208  -2.530   0.209
  609   HD13  ILE  74          2HD1      ILE  74  -1.582  -2.623  -0.896
  610    H    GLU  75           HN       GLU  75   2.423   2.229   0.487
  611    HA   GLU  75           HA       GLU  75   1.987   3.620   2.842
  612    HB2  GLU  75           2HB      GLU  75   4.207   2.902   2.068
  613    HB3  GLU  75           1HB      GLU  75   4.152   4.095   0.781
  614    HG2  GLU  75           2HG      GLU  75   3.955   5.842   2.606
  615    HG3  GLU  75           1HG      GLU  75   4.389   4.556   3.734
  616    H    SER  76           HN       SER  76   2.268   4.887  -0.445
  617    HA   SER  76           HA       SER  76   1.910   7.599   0.198
  618    HB2  SER  76           2HB      SER  76   1.280   6.191  -2.391
  619    HB3  SER  76           1HB      SER  76   1.555   7.919  -2.190
  620    HG   SER  76           HG       SER  76   3.393   5.782  -2.038
  621    H    VAL  77           HN       VAL  77  -0.380   5.035  -0.607
  622    HA   VAL  77           HA       VAL  77  -2.681   6.670  -0.827
  623    HB   VAL  77           HB       VAL  77  -2.523   3.767   0.002
  624   HG11  VAL  77          1HG1      VAL  77  -4.837   3.635  -0.790
  625   HG12  VAL  77          2HG1      VAL  77  -4.828   5.372  -1.097
  626   HG13  VAL  77          3HG1      VAL  77  -4.671   4.766   0.553
  627   HG21  VAL  77          3HG2      VAL  77  -3.011   3.294  -2.367
  628   HG22  VAL  77          1HG2      VAL  77  -1.458   4.099  -2.143
  629   HG23  VAL  77          2HG2      VAL  77  -2.850   5.014  -2.721
  630    H    LEU  78           HN       LEU  78  -1.361   4.774   1.875
  631    HA   LEU  78           HA       LEU  78  -3.361   5.417   3.748
  632    HB2  LEU  78           2HB      LEU  78  -0.472   4.655   4.185
  633    HB3  LEU  78           1HB      LEU  78  -1.678   4.738   5.455
  634    HG   LEU  78           HG       LEU  78  -1.711   2.845   3.104
  635   HD11  LEU  78          1HD1      LEU  78  -0.019   2.286   4.762
  636   HD12  LEU  78          2HD1      LEU  78  -1.346   1.125   4.802
  637   HD13  LEU  78          3HD1      LEU  78  -1.231   2.373   6.041
  638   HD21  LEU  78          3HD2      LEU  78  -3.970   3.485   3.760
  639   HD22  LEU  78          1HD2      LEU  78  -3.605   3.088   5.441
  640   HD23  LEU  78          2HD2      LEU  78  -3.629   1.816   4.218
  641    H    ASP  79           HN       ASP  79  -0.368   7.022   2.863
  642    HA   ASP  79           HA       ASP  79  -0.331   8.887   4.997
  643    HB2  ASP  79           2HB      ASP  79   1.665   8.390   3.682
  644    HB3  ASP  79           1HB      ASP  79   0.900   9.041   2.237
  645    H    TRP  80           HN       TRP  80  -1.456   9.103   1.644
  646    HA   TRP  80           HA       TRP  80  -2.425  11.726   1.695
  647    HB2  TRP  80           2HB      TRP  80  -2.195  10.586  -0.394
  648    HB3  TRP  80           1HB      TRP  80  -3.264   9.290   0.121
  649    HD1  TRP  80           1HD      TRP  80  -3.399  12.998  -0.948
  650    HE1  TRP  80           1HE      TRP  80  -5.756  13.480  -1.873
  651    HE3  TRP  80           3HE      TRP  80  -5.609   8.517   0.118
  652    HZ2  TRP  80           2HZ      TRP  80  -8.226  12.120  -2.119
  653    HZ3  TRP  80           3HZ      TRP  80  -7.966   8.184  -0.496
  654    HH2  TRP  80           2HH      TRP  80  -9.248   9.952  -1.592
  655    H    ALA  81           HN       ALA  81  -4.033   8.671   2.467
  656    HA   ALA  81           HA       ALA  81  -6.596   9.698   2.960
  657    HB1  ALA  81           1HB      ALA  81  -7.005   7.611   4.161
  658    HB2  ALA  81           2HB      ALA  81  -5.273   7.275   4.179
  659    HB3  ALA  81           3HB      ALA  81  -6.148   7.318   2.648
  660    H    THR  82           HN       THR  82  -3.764   9.457   5.027
  661    HA   THR  82           HA       THR  82  -5.036  10.042   7.475
  662    HB   THR  82           HB       THR  82  -2.182  10.712   6.713
  663    HG1  THR  82           1HG      THR  82  -2.350   8.550   6.379
  664   HG21  THR  82          3HG2      THR  82  -1.737  10.491   9.099
  665   HG22  THR  82          1HG2      THR  82  -3.437  10.140   9.401
  666   HG23  THR  82          2HG2      THR  82  -2.957  11.732   8.814
  667    H    VAL  83           HN       VAL  83  -3.517  12.088   5.014
  668    HA   VAL  83           HA       VAL  83  -3.855  14.544   6.397
  669    HB   VAL  83           HB       VAL  83  -3.623  14.088   3.415
  670   HG11  VAL  83          1HG1      VAL  83  -4.408  16.328   3.956
  671   HG12  VAL  83          2HG1      VAL  83  -2.751  16.385   3.355
  672   HG13  VAL  83          3HG1      VAL  83  -3.067  16.544   5.082
  673   HG21  VAL  83          3HG2      VAL  83  -1.221  14.500   3.729
  674   HG22  VAL  83          1HG2      VAL  83  -1.764  13.050   4.574
  675   HG23  VAL  83          2HG2      VAL  83  -1.468  14.537   5.476
  676    H    ARG  84           HN       ARG  84  -5.788  12.774   4.039
  677    HA   ARG  84           HA       ARG  84  -7.730  14.823   3.670
  678    HB2  ARG  84           2HB      ARG  84  -7.765  11.878   3.033
  679    HB3  ARG  84           1HB      ARG  84  -9.068  12.977   2.604
  680    HG2  ARG  84           2HG      ARG  84  -6.212  13.199   1.682
  681    HG3  ARG  84           1HG      ARG  84  -7.561  12.576   0.728
  682    HD2  ARG  84           2HD      ARG  84  -7.204  15.378   1.781
  683    HD3  ARG  84           1HD      ARG  84  -7.156  14.861   0.097
  684    HE   ARG  84           HE       ARG  84  -9.563  14.930   1.798
  685   HH11  ARG  84          1HH1      ARG  84  -8.048  14.937  -1.363
  686   HH12  ARG  84          2HH1      ARG  84  -9.546  15.181  -2.217
  687   HH21  ARG  84          1HH2      ARG  84 -11.521  15.243   0.697
  688   HH22  ARG  84          2HH2      ARG  84 -11.530  15.347  -1.045
  689    H    GLY  85           HN       GLY  85  -7.366  12.267   6.000
  690    HA2  GLY  85           2HA      GLY  85  -8.463  12.432   8.113
  691    HA3  GLY  85           1HA      GLY  85  -9.792  13.268   7.324
  692    H    TYR  86           HN       TYR  86  -8.905  10.697   5.416
  693    HA   TYR  86           HA       TYR  86 -11.280   9.242   6.030
  694    HB2  TYR  86           2HB      TYR  86  -8.951   8.584   4.220
  695    HB3  TYR  86           1HB      TYR  86 -10.398   7.590   4.354
  696    HD1  TYR  86           2HD      TYR  86 -12.647   9.151   4.160
  697    HD2  TYR  86           1HD      TYR  86  -8.877   9.927   2.357
  698    HE1  TYR  86           2HE      TYR  86 -13.755  10.527   2.448
  699    HE2  TYR  86           1HE      TYR  86  -9.971  11.305   0.643
  700    HH   TYR  86           HH       TYR  86 -13.209  12.342   0.906
  701    H    ARG  87           HN       ARG  87  -7.968   9.049   6.977
  702    HA   ARG  87           HA       ARG  87  -8.692   7.080   8.985
  703    HB2  ARG  87           2HB      ARG  87  -6.771   5.652   8.552
  704    HB3  ARG  87           1HB      ARG  87  -7.781   5.727   7.115
  705    HG2  ARG  87           2HG      ARG  87  -6.253   7.234   6.047
  706    HG3  ARG  87           1HG      ARG  87  -5.303   7.388   7.525
  707    HD2  ARG  87           2HD      ARG  87  -5.680   4.849   5.942
  708    HD3  ARG  87           1HD      ARG  87  -4.252   5.883   5.894
  709    HE   ARG  87           HE       ARG  87  -5.088   4.144   8.091
  710   HH11  ARG  87          1HH1      ARG  87  -2.790   6.441   6.784
  711   HH12  ARG  87          2HH1      ARG  87  -1.572   6.092   7.966
  712   HH21  ARG  87          1HH2      ARG  87  -3.468   3.675   9.660
  713   HH22  ARG  87          2HH2      ARG  87  -1.954   4.533   9.592
  714    H    GLU  88           HN       GLU  88  -7.329   7.189  10.822
  715    HA   GLU  88           HA       GLU  88  -5.294   9.302  10.741
  716    HB2  GLU  88           2HB      GLU  88  -7.382   8.904  12.887
  717    HB3  GLU  88           1HB      GLU  88  -6.000   9.982  13.034
  718    HG2  GLU  88           2HG      GLU  88  -6.806  11.244  11.081
  719    HG3  GLU  88           1HG      GLU  88  -8.219  10.193  11.010
  720    H    GLY  89           HN       GLY  89  -3.755   9.173  12.550
  721    HA2  GLY  89           2HA      GLY  89  -2.940   7.545  14.315
  722    HA3  GLY  89           1HA      GLY  89  -3.140   6.337  13.050
  723    H    ASP  90           HN       ASP  90  -1.283   5.782  12.166
  724    HA   ASP  90           HA       ASP  90   0.554   7.911  11.320
  725    HB2  ASP  90           2HB      ASP  90   1.268   6.663  13.517
  726    HB3  ASP  90           1HB      ASP  90   1.671   5.342  12.427
  727    H    ASN  91           HN       ASN  91   2.458   6.232  10.132
  728    HA   ASN  91           HA       ASN  91   0.811   4.785   8.163
  729    HB2  ASN  91           2HB      ASN  91   2.798   6.834   7.779
  730    HB3  ASN  91           1HB      ASN  91   3.315   5.343   6.996
  731   HD21  ASN  91          1HD2      ASN  91   3.022   6.097   4.935
  732   HD22  ASN  91          2HD2      ASN  91   1.467   6.416   4.256
  733    HA   PRO  92           HA       PRO  92   3.323   1.619  10.326
  734    HB2  PRO  92           2HB      PRO  92   1.591  -0.422   9.843
  735    HB3  PRO  92           1HB      PRO  92   1.405   0.711  11.185
  736    HG2  PRO  92           2HG      PRO  92   0.053   0.701   8.513
  737    HG3  PRO  92           1HG      PRO  92  -0.642   0.997  10.118
  738    HD2  PRO  92           2HD      PRO  92  -0.034   3.003   8.423
  739    HD3  PRO  92           1HD      PRO  92   0.117   3.177  10.183
  740    H    ALA  93           HN       ALA  93   2.458   2.066   7.092
  741    HA   ALA  93           HA       ALA  93   3.858  -0.321   6.158
  742    HB1  ALA  93           1HB      ALA  93   3.138   0.375   3.923
  743    HB2  ALA  93           2HB      ALA  93   2.448   1.849   4.605
  744    HB3  ALA  93           3HB      ALA  93   1.774   0.276   5.037
  745    H    ARG  94           HN       ARG  94   4.769   2.532   7.305
  746    HA   ARG  94           HA       ARG  94   6.620   3.353   5.219
  747    HB2  ARG  94           2HB      ARG  94   5.249   4.911   6.717
  748    HB3  ARG  94           1HB      ARG  94   6.363   4.482   8.006
  749    HG2  ARG  94           2HG      ARG  94   8.217   5.407   6.721
  750    HG3  ARG  94           1HG      ARG  94   7.104   5.817   5.408
  751    HD2  ARG  94           2HD      ARG  94   5.810   7.187   7.055
  752    HD3  ARG  94           1HD      ARG  94   7.099   6.899   8.221
  753    HE   ARG  94           HE       ARG  94   8.449   7.943   6.150
  754   HH11  ARG  94          1HH1      ARG  94   5.558   8.953   7.845
  755   HH12  ARG  94          2HH1      ARG  94   5.785  10.641   7.504
  756   HH21  ARG  94          1HH2      ARG  94   8.766  10.169   5.696
  757   HH22  ARG  94          2HH2      ARG  94   7.631  11.338   6.299
  758    H    TRP  95           HN       TRP  95   6.720   2.157   8.553
  759    HA   TRP  95           HA       TRP  95   8.261   1.057   9.767
  760    HB2  TRP  95           2HB      TRP  95   8.960   0.273   7.004
  761    HB3  TRP  95           1HB      TRP  95  10.203   0.006   8.221
  762    HD1  TRP  95           1HD      TRP  95   9.081  -1.321  10.550
  763    HE1  TRP  95           1HE      TRP  95   7.667  -3.472  10.501
  764    HE3  TRP  95           3HE      TRP  95   7.473  -1.111   5.704
  765    HZ2  TRP  95           2HZ      TRP  95   6.073  -4.888   8.649
  766    HZ3  TRP  95           3HZ      TRP  95   6.006  -2.904   4.869
  767    HH2  TRP  95           2HH      TRP  95   5.322  -4.754   6.315
  768    H    ARG  96           HN       ARG  96  10.767   0.785  10.024
  769    HA   ARG  96           HA       ARG  96  12.057   3.393   9.613
  770    HB2  ARG  96           2HB      ARG  96  13.233   2.626  11.873
  771    HB3  ARG  96           1HB      ARG  96  11.726   3.529  11.875
  772    HG2  ARG  96           2HG      ARG  96  10.485   1.426  12.109
  773    HG3  ARG  96           1HG      ARG  96  12.010   0.539  12.152
  774    HD2  ARG  96           2HD      ARG  96  11.527   2.774  14.076
  775    HD3  ARG  96           1HD      ARG  96  10.797   1.195  14.369
  776    HE   ARG  96           HE       ARG  96  13.210   0.364  14.133
  777   HH11  ARG  96          1HH1      ARG  96  12.403   3.538  15.369
  778   HH12  ARG  96          2HH1      ARG  96  13.710   3.563  16.519
  779   HH21  ARG  96          1HH2      ARG  96  14.925   0.381  15.627
  780   HH22  ARG  96          2HH2      ARG  96  15.150   1.762  16.666
  781    H    GLY  97           HN       GLY  97  12.174   0.939   8.057
  782    HA2  GLY  97           2HA      GLY  97  14.415   0.491   6.972
  783    HA3  GLY  97           1HA      GLY  97  14.931   0.028   8.589
  784    H    TYR  98           HN       TYR  98  13.020  -1.473   9.570
  785    HA   TYR  98           HA       TYR  98  12.111  -3.530   9.663
  786    HB2  TYR  98           2HB      TYR  98  10.627  -2.722   7.886
  787    HB3  TYR  98           1HB      TYR  98  11.799  -3.216   6.672
  788    HD1  TYR  98           1HD      TYR  98   9.981  -4.732   9.575
  789    HD2  TYR  98           2HD      TYR  98  11.373  -5.202   5.585
  790    HE1  TYR  98           1HE      TYR  98   8.928  -6.948   9.474
  791    HE2  TYR  98           2HE      TYR  98  10.325  -7.425   5.476
  792    HH   TYR  98           HH       TYR  98   9.562  -9.182   6.976
  793    H    LEU  99           HN       LEU  99  13.602  -3.914   6.466
  794    HA   LEU  99           HA       LEU  99  15.036  -6.238   7.427
  795    HB2  LEU  99           2HB      LEU  99  14.863  -4.941   4.710
  796    HB3  LEU  99           1HB      LEU  99  15.840  -6.357   5.047
  797    HG   LEU  99           HG       LEU  99  12.838  -6.194   5.306
  798   HD11  LEU  99          1HD1      LEU  99  12.798  -7.663   3.369
  799   HD12  LEU  99          2HD1      LEU  99  14.558  -7.608   3.274
  800   HD13  LEU  99          3HD1      LEU  99  13.615  -6.146   2.985
  801   HD21  LEU  99          3HD2      LEU  99  13.804  -7.739   6.926
  802   HD22  LEU  99          1HD2      LEU  99  14.713  -8.534   5.641
  803   HD23  LEU  99          2HD2      LEU  99  12.952  -8.615   5.654
  804    H    GLU 100           HN       GLU 100  15.893  -3.199   5.789
  805    HA   GLU 100           HA       GLU 100  17.808  -1.989   5.683
  806    HB2  GLU 100           2HB      GLU 100  17.200  -1.706   8.100
  807    HB3  GLU 100           1HB      GLU 100  18.280  -3.036   8.483
  808    HG2  GLU 100           2HG      GLU 100  20.187  -1.805   7.795
  809    HG3  GLU 100           1HG      GLU 100  19.191  -0.538   7.084
  810    H    HIS 101           HN       HIS 101  17.922  -4.516   4.535
  811    HA   HIS 101           HA       HIS 101  20.298  -5.906   5.345
  812    HB2  HIS 101           2HB      HIS 101  18.430  -6.159   3.002
  813    HB3  HIS 101           1HB      HIS 101  19.952  -7.041   3.035
  814    HD1  HIS 101           1HD      HIS 101  18.714  -9.304   3.120
  815    HD2  HIS 101           2HD      HIS 101  17.903  -6.787   6.339
  816    HE1  HIS 101           1HE      HIS 101  17.519 -10.729   4.822
  817    HE2  HIS 101           2HE      HIS 101  17.146  -9.220   6.806
  818    H    HIS 102           HN       HIS 102  22.017  -4.570   5.281
  819    HA   HIS 102           HA       HIS 102  22.764  -3.477   2.659
  820    HB2  HIS 102           2HB      HIS 102  23.755  -2.857   5.449
  821    HB3  HIS 102           1HB      HIS 102  24.571  -2.284   3.997
  822    HD1  HIS 102           1HD      HIS 102  22.326  -1.102   6.416
  823    HD2  HIS 102           2HD      HIS 102  22.452  -0.880   2.267
  824    HE1  HIS 102           1HE      HIS 102  20.847   0.831   5.796
  825    HE2  HIS 102           2HE      HIS 102  21.036   1.029   3.288
  826    H    HIS 103           HN       HIS 103  23.849  -4.890   1.497
  827    HA   HIS 103           HA       HIS 103  26.075  -6.314   2.757
  828    HB2  HIS 103           2HB      HIS 103  23.908  -7.722   2.594
  829    HB3  HIS 103           1HB      HIS 103  24.233  -7.756   0.865
  830    HD1  HIS 103           1HD      HIS 103  25.264  -9.224   4.082
  831    HD2  HIS 103           2HD      HIS 103  26.600  -9.187   0.142
  832    HE1  HIS 103           1HE      HIS 103  26.942 -11.097   3.914
  833    HE2  HIS 103           2HE      HIS 103  27.585 -11.171   1.479
  834    H    HIS 104           HN       HIS 104  27.849  -6.269   1.540
  835    HA   HIS 104           HA       HIS 104  27.564  -5.292  -1.224
  836    HB2  HIS 104           2HB      HIS 104  29.806  -4.951   0.775
  837    HB3  HIS 104           1HB      HIS 104  29.972  -4.547  -0.928
  838    HD1  HIS 104           1HD      HIS 104  29.960  -2.077  -1.060
  839    HD2  HIS 104           2HD      HIS 104  27.090  -3.504   1.594
  840    HE1  HIS 104           1HE      HIS 104  28.686  -0.051  -0.280
  841    HE2  HIS 104           2HE      HIS 104  26.843  -0.959   1.177
  842    H    HIS 105           HN       HIS 105  28.083  -6.627  -2.796
  843    HA   HIS 105           HA       HIS 105  28.968  -9.274  -2.314
  844    HB2  HIS 105           2HB      HIS 105  28.656  -7.665  -4.845
  845    HB3  HIS 105           1HB      HIS 105  29.215  -9.333  -4.855
  846    HD1  HIS 105           1HD      HIS 105  26.232  -7.429  -5.225
  847    HD2  HIS 105           2HD      HIS 105  27.192 -11.068  -3.456
  848    HE1  HIS 105           1HE      HIS 105  24.065  -8.693  -5.050
  849    HE2  HIS 105           2HE      HIS 105  24.651 -10.851  -3.879
  850    H    HIS 106           HN       HIS 106  30.874 -10.310  -2.960
  851    HA   HIS 106           HA       HIS 106  33.106  -8.679  -3.866
  852    HB2  HIS 106           2HB      HIS 106  32.871  -9.673  -1.168
  853    HB3  HIS 106           1HB      HIS 106  34.255 -10.409  -1.974
  854    HD1  HIS 106           1HD      HIS 106  33.947  -7.955   0.283
  855    HD2  HIS 106           2HD      HIS 106  35.354  -7.830  -3.629
  856    HE1  HIS 106           1HE      HIS 106  35.430  -5.930   0.156
  857    HE2  HIS 106           2HE      HIS 106  36.092  -5.756  -2.268
  Start of MODEL    7
    1    H1   MET   1           H1       MET   1 -15.982   3.270   5.539
    2    H2   MET   1           H2       MET   1 -14.730   2.433   6.317
    3    H3   MET   1           H3       MET   1 -15.875   1.582   5.402
    4    HA   MET   1           HA       MET   1 -15.112   2.577   3.381
    5    HB2  MET   1           2HB      MET   1 -14.429   4.743   4.341
    6    HB3  MET   1           1HB      MET   1 -13.078   3.957   5.147
    7    HG2  MET   1           2HG      MET   1 -12.207   5.004   3.220
    8    HG3  MET   1           1HG      MET   1 -12.246   3.278   2.884
    9    HE1  MET   1           2HE      MET   1 -15.298   6.298   1.201
   10    HE2  MET   1           3HE      MET   1 -13.949   6.749   2.245
   11    HE3  MET   1           1HE      MET   1 -15.281   5.791   2.891
   12    H    THR   2           HN       THR   2 -14.078   0.999   2.332
   13    HA   THR   2           HA       THR   2 -12.381  -0.793   3.875
   14    HB   THR   2           HB       THR   2 -12.413  -2.239   1.873
   15    HG1  THR   2           1HG      THR   2 -14.330  -0.570   0.662
   16   HG21  THR   2          3HG2      THR   2 -14.801  -2.787   1.892
   17   HG22  THR   2          1HG2      THR   2 -15.152  -1.240   2.663
   18   HG23  THR   2          2HG2      THR   2 -14.211  -2.459   3.523
   19    H    PHE   3           HN       PHE   3 -10.311  -1.537   2.932
   20    HA   PHE   3           HA       PHE   3  -8.650   0.676   2.350
   21    HB2  PHE   3           2HB      PHE   3  -7.798  -1.332   3.484
   22    HB3  PHE   3           1HB      PHE   3  -8.061  -2.277   2.021
   23    HD1  PHE   3           2HD      PHE   3  -6.200   0.663   3.320
   24    HD2  PHE   3           1HD      PHE   3  -6.379  -2.455   0.430
   25    HE1  PHE   3           2HE      PHE   3  -3.945   1.261   2.540
   26    HE2  PHE   3           1HE      PHE   3  -4.127  -1.859  -0.360
   27    HZ   PHE   3           HZ       PHE   3  -2.904   0.003   0.698
   28    H    SER   4           HN       SER   4 -10.140  -1.817   0.357
   29    HA   SER   4           HA       SER   4  -8.863  -1.225  -2.071
   30    HB2  SER   4           2HB      SER   4 -11.678  -2.253  -1.628
   31    HB3  SER   4           1HB      SER   4 -10.772  -2.357  -3.135
   32    HG   SER   4           HG       SER   4  -9.156  -3.451  -1.562
   33    H    GLU   5           HN       GLU   5 -11.871   0.036  -0.665
   34    HA   GLU   5           HA       GLU   5 -12.568   1.762  -2.767
   35    HB2  GLU   5           2HB      GLU   5 -13.188   1.679   0.165
   36    HB3  GLU   5           1HB      GLU   5 -13.762   3.004  -0.830
   37    HG2  GLU   5           2HG      GLU   5 -15.036   1.522  -2.188
   38    HG3  GLU   5           1HG      GLU   5 -14.328   0.113  -1.399
   39    H    CYS   6           HN       CYS   6 -10.752   2.342   0.206
   40    HA   CYS   6           HA       CYS   6 -10.418   5.113  -0.175
   41    HB2  CYS   6           2HB      CYS   6 -10.111   3.696   1.942
   42    HB3  CYS   6           1HB      CYS   6  -8.496   3.371   1.341
   43    HG   CYS   6           HG       CYS   6  -8.029   6.264   1.130
   44    H    ALA   7           HN       ALA   7  -8.342   2.349  -0.928
   45    HA   ALA   7           HA       ALA   7  -6.176   3.792  -1.987
   46    HB1  ALA   7           1HB      ALA   7  -6.068   1.397  -1.445
   47    HB2  ALA   7           2HB      ALA   7  -5.524   1.728  -3.089
   48    HB3  ALA   7           3HB      ALA   7  -7.127   1.049  -2.811
   49    H    ALA   8           HN       ALA   8  -9.108   2.531  -3.529
   50    HA   ALA   8           HA       ALA   8  -8.511   3.276  -6.164
   51    HB1  ALA   8           1HB      ALA   8 -11.216   3.090  -4.833
   52    HB2  ALA   8           2HB      ALA   8 -10.346   1.763  -5.607
   53    HB3  ALA   8           3HB      ALA   8 -10.920   3.124  -6.571
   54    H    LEU   9           HN       LEU   9  -9.974   5.073  -3.506
   55    HA   LEU   9           HA       LEU   9 -10.699   7.388  -4.908
   56    HB2  LEU   9           2HB      LEU   9  -9.764   7.099  -2.051
   57    HB3  LEU   9           1HB      LEU   9 -10.504   8.539  -2.712
   58    HG   LEU   9           HG       LEU   9 -11.868   5.854  -2.542
   59   HD11  LEU   9          1HD1      LEU   9 -12.113   8.289  -0.784
   60   HD12  LEU   9          2HD1      LEU   9 -11.450   6.722  -0.323
   61   HD13  LEU   9          3HD1      LEU   9 -13.163   6.875  -0.718
   62   HD21  LEU   9          3HD2      LEU   9 -12.928   8.600  -3.202
   63   HD22  LEU   9          1HD2      LEU   9 -13.890   7.131  -3.039
   64   HD23  LEU   9          2HD2      LEU   9 -12.708   7.271  -4.341
   65    H    TYR  10           HN       TYR  10  -7.690   6.605  -3.184
   66    HA   TYR  10           HA       TYR  10  -6.318   8.984  -3.680
   67    HB2  TYR  10           2HB      TYR  10  -5.451   7.356  -2.095
   68    HB3  TYR  10           1HB      TYR  10  -5.251   6.167  -3.375
   69    HD1  TYR  10           2HD      TYR  10  -3.914   9.280  -1.938
   70    HD2  TYR  10           1HD      TYR  10  -3.371   6.254  -4.877
   71    HE1  TYR  10           2HE      TYR  10  -1.634  10.099  -2.361
   72    HE2  TYR  10           1HE      TYR  10  -1.093   7.062  -5.302
   73    HH   TYR  10           HH       TYR  10   0.568   9.030  -3.286
   74    H    ILE  11           HN       ILE  11  -6.358   5.964  -5.515
   75    HA   ILE  11           HA       ILE  11  -4.517   6.812  -7.485
   76    HB   ILE  11           HB       ILE  11  -6.602   4.632  -7.654
   77   HG12  ILE  11          2HG1      ILE  11  -3.660   4.482  -6.937
   78   HG13  ILE  11          1HG1      ILE  11  -4.982   4.409  -5.778
   79   HG21  ILE  11          1HG2      ILE  11  -5.815   5.283  -9.865
   80   HG22  ILE  11          2HG2      ILE  11  -5.186   3.694  -9.432
   81   HG23  ILE  11          3HG2      ILE  11  -4.141   5.113  -9.338
   82   HD11  ILE  11          3HD1      ILE  11  -4.111   2.198  -6.278
   83   HD12  ILE  11          1HD1      ILE  11  -4.476   2.434  -7.987
   84   HD13  ILE  11          2HD1      ILE  11  -5.787   2.356  -6.809
   85    H    LYS  12           HN       LYS  12  -8.081   6.635  -7.519
   86    HA   LYS  12           HA       LYS  12  -8.366   7.472 -10.195
   87    HB2  LYS  12           2HB      LYS  12 -10.153   6.320  -9.022
   88    HB3  LYS  12           1HB      LYS  12 -10.308   7.655  -7.887
   89    HG2  LYS  12           2HG      LYS  12 -11.170   9.090  -9.568
   90    HG3  LYS  12           1HG      LYS  12 -10.771   7.940 -10.844
   91    HD2  LYS  12           2HD      LYS  12 -13.170   7.938 -10.299
   92    HD3  LYS  12           1HD      LYS  12 -12.412   6.377  -9.991
   93    HE2  LYS  12           2HE      LYS  12 -12.287   6.889  -7.611
   94    HE3  LYS  12           1HE      LYS  12 -12.990   8.479  -7.908
   95    HZ1  LYS  12           3HZ      LYS  12 -14.576   6.750  -7.096
   96    HZ2  LYS  12           1HZ      LYS  12 -14.376   5.940  -8.573
   97    HZ3  LYS  12           2HZ      LYS  12 -15.035   7.504  -8.546
   98    H    ALA  13           HN       ALA  13  -8.112   9.275  -7.189
   99    HA   ALA  13           HA       ALA  13  -8.874  11.786  -8.299
  100    HB1  ALA  13           1HB      ALA  13  -9.016  11.325  -5.899
  101    HB2  ALA  13           2HB      ALA  13  -8.027  12.747  -6.229
  102    HB3  ALA  13           3HB      ALA  13  -7.256  11.215  -5.819
  103    H    HIS  14           HN       HIS  14  -6.054   9.916  -8.590
  104    HA   HIS  14           HA       HIS  14  -4.486  12.295  -9.364
  105    HB2  HIS  14           2HB      HIS  14  -3.622   9.685  -8.140
  106    HB3  HIS  14           1HB      HIS  14  -2.485  10.725  -8.987
  107    HD1  HIS  14           1HD      HIS  14  -4.358  10.375  -5.804
  108    HD2  HIS  14           2HD      HIS  14  -1.894  13.155  -7.671
  109    HE1  HIS  14           1HE      HIS  14  -3.689  12.008  -4.006
  110    HE2  HIS  14           2HE      HIS  14  -2.045  13.570  -5.123
  111    H    ARG  15           HN       ARG  15  -6.200   9.843 -10.679
  112    HA   ARG  15           HA       ARG  15  -4.295   8.687 -12.436
  113    HB2  ARG  15           2HB      ARG  15  -6.092   7.508 -13.440
  114    HB3  ARG  15           1HB      ARG  15  -6.449   7.593 -11.724
  115    HG2  ARG  15           2HG      ARG  15  -8.058   9.353 -12.115
  116    HG3  ARG  15           1HG      ARG  15  -7.642   9.383 -13.829
  117    HD2  ARG  15           2HD      ARG  15  -8.365   7.002 -13.979
  118    HD3  ARG  15           1HD      ARG  15  -8.922   7.115 -12.309
  119    HE   ARG  15           HE       ARG  15 -10.134   9.206 -13.618
  120   HH11  ARG  15          1HH1      ARG  15 -10.105   5.705 -13.968
  121   HH12  ARG  15          2HH1      ARG  15 -11.685   5.655 -14.695
  122   HH21  ARG  15          1HH2      ARG  15 -12.213   9.107 -14.554
  123   HH22  ARG  15          2HH2      ARG  15 -12.874   7.568 -15.020
  124    H    SER  16           HN       SER  16  -6.314  11.516 -12.610
  125    HA   SER  16           HA       SER  16  -6.288  11.863 -15.406
  126    HB2  SER  16           2HB      SER  16  -6.613  13.880 -13.176
  127    HB3  SER  16           1HB      SER  16  -6.995  14.160 -14.869
  128    HG   SER  16           HG       SER  16  -8.878  13.368 -14.419
  129    H    SER  17           HN       SER  17  -3.958  12.481 -12.924
  130    HA   SER  17           HA       SER  17  -2.379  14.304 -14.511
  131    HB2  SER  17           2HB      SER  17  -2.441  14.360 -12.002
  132    HB3  SER  17           1HB      SER  17  -1.597  12.815 -11.992
  133    HG   SER  17           HG       SER  17  -0.169  14.327 -13.552
  134    H    TRP  18           HN       TRP  18  -2.845  10.967 -14.374
  135    HA   TRP  18           HA       TRP  18  -0.224  10.428 -15.601
  136    HB2  TRP  18           2HB      TRP  18  -2.069   8.454 -14.235
  137    HB3  TRP  18           1HB      TRP  18  -0.459   8.125 -14.857
  138    HD1  TRP  18           1HD      TRP  18   1.045  10.627 -13.512
  139    HE1  TRP  18           1HE      TRP  18   1.458  10.592 -10.958
  140    HE3  TRP  18           3HE      TRP  18  -2.542   7.247 -12.158
  141    HZ2  TRP  18           2HZ      TRP  18   0.403   9.293  -8.694
  142    HZ3  TRP  18           3HZ      TRP  18  -2.774   6.657  -9.780
  143    HH2  TRP  18           2HH      TRP  18  -1.329   7.660  -8.083
  144    H    LYS  19           HN       LYS  19  -2.146  11.486 -17.267
  145    HA   LYS  19           HA       LYS  19  -3.140  11.159 -19.196
  146    HB2  LYS  19           2HB      LYS  19  -1.883   8.474 -18.999
  147    HB3  LYS  19           1HB      LYS  19  -2.953   8.900 -20.332
  148    HG2  LYS  19           2HG      LYS  19  -1.506  10.928 -20.696
  149    HG3  LYS  19           1HG      LYS  19  -0.365  10.213 -19.557
  150    HD2  LYS  19           2HD      LYS  19  -0.186   8.240 -20.976
  151    HD3  LYS  19           1HD      LYS  19  -1.335   8.949 -22.113
  152    HE2  LYS  19           2HE      LYS  19   1.354  10.097 -21.370
  153    HE3  LYS  19           1HE      LYS  19   0.983   9.232 -22.861
  154    HZ1  LYS  19           3HZ      LYS  19  -0.605  10.966 -23.428
  155    HZ2  LYS  19           1HZ      LYS  19   0.943  11.617 -23.197
  156    HZ3  LYS  19           2HZ      LYS  19  -0.243  11.801 -21.997
  157    H    ASN  20           HN       ASN  20  -5.966   9.503 -19.509
  158    HA   ASN  20           HA       ASN  20  -5.397   7.140 -18.290
  159    HB2  ASN  20           2HB      ASN  20  -7.165   7.750 -19.994
  160    HB3  ASN  20           1HB      ASN  20  -5.967   7.331 -21.211
  161   HD21  ASN  20          1HD2      ASN  20  -8.521   6.117 -20.647
  162   HD22  ASN  20          2HD2      ASN  20  -8.212   4.447 -20.282
  163    H    THR  21           HN       THR  21  -3.241   6.884 -17.847
  164    HA   THR  21           HA       THR  21  -1.945   5.332 -20.012
  165    HB   THR  21           HB       THR  21  -0.082   4.947 -18.372
  166    HG1  THR  21           1HG      THR  21  -1.343   7.031 -16.889
  167   HG21  THR  21          3HG2      THR  21   0.181   6.623 -20.096
  168   HG22  THR  21          1HG2      THR  21   0.961   7.147 -18.603
  169   HG23  THR  21          2HG2      THR  21  -0.597   7.828 -19.071
  170    H    LYS  22           HN       LYS  22  -0.873   3.233 -18.891
  171    HA   LYS  22           HA       LYS  22  -3.006   1.885 -17.439
  172    HB2  LYS  22           2HB      LYS  22  -0.487   0.951 -18.774
  173    HB3  LYS  22           1HB      LYS  22  -1.328  -0.081 -17.625
  174    HG2  LYS  22           2HG      LYS  22  -3.378   0.172 -19.015
  175    HG3  LYS  22           1HG      LYS  22  -2.395   1.016 -20.211
  176    HD2  LYS  22           2HD      LYS  22  -2.660  -1.347 -20.781
  177    HD3  LYS  22           1HD      LYS  22  -0.973  -0.951 -20.453
  178    HE2  LYS  22           2HE      LYS  22  -1.482  -3.051 -19.411
  179    HE3  LYS  22           1HE      LYS  22  -1.266  -1.841 -18.151
  180    HZ1  LYS  22           3HZ      LYS  22  -3.194  -3.368 -17.840
  181    HZ2  LYS  22           1HZ      LYS  22  -3.926  -2.655 -19.191
  182    HZ3  LYS  22           2HZ      LYS  22  -3.603  -1.727 -17.810
  183    H    HIS  23           HN       HIS  23  -0.725   3.937 -16.502
  184    HA   HIS  23           HA       HIS  23   0.642   2.535 -14.438
  185    HB2  HIS  23           2HB      HIS  23   0.113   5.468 -14.924
  186    HB3  HIS  23           1HB      HIS  23   0.926   4.914 -13.466
  187    HD1  HIS  23           1HD      HIS  23   3.368   4.965 -13.639
  188    HD2  HIS  23           2HD      HIS  23   1.580   4.381 -17.347
  189    HE1  HIS  23           1HE      HIS  23   5.253   4.914 -15.301
  190    HE2  HIS  23           2HE      HIS  23   4.122   4.796 -17.555
  191    H    ALA  24           HN       ALA  24  -2.170   4.730 -14.330
  192    HA   ALA  24           HA       ALA  24  -2.787   4.322 -11.621
  193    HB1  ALA  24           1HB      ALA  24  -3.751   6.149 -12.918
  194    HB2  ALA  24           2HB      ALA  24  -5.022   5.166 -12.192
  195    HB3  ALA  24           3HB      ALA  24  -4.642   4.994 -13.907
  196    H    ASP  25           HN       ASP  25  -3.627   2.579 -14.523
  197    HA   ASP  25           HA       ASP  25  -5.499   0.783 -13.433
  198    HB2  ASP  25           2HB      ASP  25  -5.189   1.173 -15.854
  199    HB3  ASP  25           1HB      ASP  25  -3.607   0.403 -15.767
  200    H    GLN  26           HN       GLN  26  -2.009   0.436 -14.053
  201    HA   GLN  26           HA       GLN  26  -1.705  -2.110 -12.937
  202    HB2  GLN  26           2HB      GLN  26   0.177   0.167 -13.467
  203    HB3  GLN  26           1HB      GLN  26   0.740  -1.329 -12.754
  204    HG2  GLN  26           2HG      GLN  26  -0.655  -1.063 -15.401
  205    HG3  GLN  26           1HG      GLN  26   1.075  -1.280 -15.167
  206   HE21  GLN  26          1HE2      GLN  26   1.860  -3.291 -14.587
  207   HE22  GLN  26          2HE2      GLN  26   0.891  -4.720 -14.646
  208    H    TRP  27           HN       TRP  27  -1.402   1.109 -11.475
  209    HA   TRP  27           HA       TRP  27  -0.600   0.392  -8.910
  210    HB2  TRP  27           2HB      TRP  27  -2.183   2.621 -10.076
  211    HB3  TRP  27           1HB      TRP  27  -2.329   2.379  -8.342
  212    HD1  TRP  27           1HD      TRP  27   0.631   2.697 -10.866
  213    HE1  TRP  27           1HE      TRP  27   2.437   4.158  -9.755
  214    HE3  TRP  27           3HE      TRP  27  -1.634   3.506  -6.354
  215    HZ2  TRP  27           2HZ      TRP  27   2.846   5.478  -7.291
  216    HZ3  TRP  27           3HZ      TRP  27  -0.469   4.876  -4.675
  217    HH2  TRP  27           2HH      TRP  27   1.727   5.842  -5.132
  218    H    THR  28           HN       THR  28  -3.851   0.540 -10.293
  219    HA   THR  28           HA       THR  28  -5.201  -0.288  -7.946
  220    HB   THR  28           HB       THR  28  -6.171  -0.586 -10.792
  221    HG1  THR  28           1HG      THR  28  -5.421   1.601 -10.143
  222   HG21  THR  28          3HG2      THR  28  -7.661  -0.232  -8.190
  223   HG22  THR  28          1HG2      THR  28  -7.534  -1.730  -9.112
  224   HG23  THR  28          2HG2      THR  28  -8.388  -0.346  -9.793
  225    H    ASN  29           HN       ASN  29  -4.260  -2.045 -10.908
  226    HA   ASN  29           HA       ASN  29  -5.367  -4.506 -10.315
  227    HB2  ASN  29           2HB      ASN  29  -2.883  -3.794 -11.873
  228    HB3  ASN  29           1HB      ASN  29  -3.575  -5.401 -11.831
  229   HD21  ASN  29          1HD2      ASN  29  -3.173  -3.624 -14.084
  230   HD22  ASN  29          2HD2      ASN  29  -4.729  -3.350 -14.788
  231    H    THR  30           HN       THR  30  -2.133  -3.267  -9.506
  232    HA   THR  30           HA       THR  30  -1.143  -5.685  -8.454
  233    HB   THR  30           HB       THR  30  -0.269  -2.891  -7.707
  234    HG1  THR  30           1HG      THR  30  -0.099  -3.050  -9.920
  235   HG21  THR  30          3HG2      THR  30   1.893  -3.934  -7.261
  236   HG22  THR  30          1HG2      THR  30   1.233  -5.511  -7.685
  237   HG23  THR  30          2HG2      THR  30   0.635  -4.659  -6.259
  238    H    ILE  31           HN       ILE  31  -2.476  -2.821  -6.776
  239    HA   ILE  31           HA       ILE  31  -2.235  -3.920  -4.183
  240    HB   ILE  31           HB       ILE  31  -4.123  -1.761  -5.149
  241   HG12  ILE  31          2HG1      ILE  31  -1.398  -1.549  -3.841
  242   HG13  ILE  31          1HG1      ILE  31  -1.734  -1.259  -5.545
  243   HG21  ILE  31          1HG2      ILE  31  -4.816  -2.749  -3.008
  244   HG22  ILE  31          2HG2      ILE  31  -4.278  -1.081  -2.817
  245   HG23  ILE  31          3HG2      ILE  31  -3.219  -2.408  -2.341
  246   HD11  ILE  31          3HD1      ILE  31  -1.522   0.822  -4.308
  247   HD12  ILE  31          1HD1      ILE  31  -2.838   0.331  -3.240
  248   HD13  ILE  31          2HD1      ILE  31  -3.153   0.630  -4.949
  249    H    LYS  32           HN       LYS  32  -4.871  -3.827  -6.507
  250    HA   LYS  32           HA       LYS  32  -6.910  -4.952  -4.963
  251    HB2  LYS  32           2HB      LYS  32  -7.199  -3.880  -7.181
  252    HB3  LYS  32           1HB      LYS  32  -6.411  -5.255  -7.932
  253    HG2  LYS  32           2HG      LYS  32  -8.221  -6.709  -7.177
  254    HG3  LYS  32           1HG      LYS  32  -9.020  -5.325  -6.428
  255    HD2  LYS  32           2HD      LYS  32 -10.002  -5.816  -8.605
  256    HD3  LYS  32           1HD      LYS  32  -9.198  -4.246  -8.621
  257    HE2  LYS  32           2HE      LYS  32  -7.265  -5.223  -9.725
  258    HE3  LYS  32           1HE      LYS  32  -8.013  -6.819  -9.661
  259    HZ1  LYS  32           3HZ      LYS  32  -9.026  -4.465 -11.175
  260    HZ2  LYS  32           1HZ      LYS  32  -9.801  -5.972 -11.077
  261    HZ3  LYS  32           2HZ      LYS  32  -8.290  -5.844 -11.836
  262    H    THR  33           HN       THR  33  -4.270  -6.427  -6.732
  263    HA   THR  33           HA       THR  33  -5.360  -9.086  -6.534
  264    HB   THR  33           HB       THR  33  -2.611  -8.160  -7.404
  265    HG1  THR  33           1HG      THR  33  -4.139  -7.422  -8.844
  266   HG21  THR  33          3HG2      THR  33  -2.608 -10.513  -6.695
  267   HG22  THR  33          1HG2      THR  33  -2.407 -10.369  -8.442
  268   HG23  THR  33          2HG2      THR  33  -3.968 -10.838  -7.769
  269    H    TYR  34           HN       TYR  34  -2.562  -7.416  -5.069
  270    HA   TYR  34           HA       TYR  34  -1.893  -9.744  -3.525
  271    HB2  TYR  34           2HB      TYR  34  -0.750  -6.964  -3.643
  272    HB3  TYR  34           1HB      TYR  34  -0.160  -8.176  -2.511
  273    HD1  TYR  34           2HD      TYR  34   0.947 -10.223  -3.366
  274    HD2  TYR  34           1HD      TYR  34  -0.180  -7.052  -5.963
  275    HE1  TYR  34           2HE      TYR  34   2.432 -11.127  -5.102
  276    HE2  TYR  34           1HE      TYR  34   1.303  -7.948  -7.707
  277    HH   TYR  34           HH       TYR  34   2.719 -11.060  -7.494
  278    H    CYS  35           HN       CYS  35  -3.312  -6.576  -2.768
  279    HA   CYS  35           HA       CYS  35  -3.320  -7.311   0.061
  280    HB2  CYS  35           2HB      CYS  35  -4.004  -4.673  -1.248
  281    HB3  CYS  35           1HB      CYS  35  -3.834  -4.962   0.482
  282    HG   CYS  35           HG       CYS  35  -1.124  -5.911  -1.172
  283    H    GLY  36           HN       GLY  36  -5.381  -7.338  -2.585
  284    HA2  GLY  36           2HA      GLY  36  -7.866  -6.583  -1.637
  285    HA3  GLY  36           1HA      GLY  36  -7.601  -7.826  -2.846
  286    HA   PRO  37           HA       PRO  37  -8.921 -11.139  -0.331
  287    HB2  PRO  37           2HB      PRO  37  -6.702 -12.707   0.218
  288    HB3  PRO  37           1HB      PRO  37  -7.659 -12.774  -1.265
  289    HG2  PRO  37           2HG      PRO  37  -5.084 -11.357  -0.728
  290    HG3  PRO  37           1HG      PRO  37  -5.601 -12.245  -2.174
  291    HD2  PRO  37           2HD      PRO  37  -5.629  -9.569  -2.112
  292    HD3  PRO  37           1HD      PRO  37  -6.906 -10.484  -2.942
  293    H    VAL  38           HN       VAL  38  -6.172  -9.420   0.995
  294    HA   VAL  38           HA       VAL  38  -6.653 -10.577   3.637
  295    HB   VAL  38           HB       VAL  38  -4.453  -8.673   2.834
  296   HG11  VAL  38          1HG1      VAL  38  -4.895  -8.700   5.227
  297   HG12  VAL  38          2HG1      VAL  38  -3.359  -9.492   4.880
  298   HG13  VAL  38          3HG1      VAL  38  -4.788 -10.461   5.244
  299   HG21  VAL  38          3HG2      VAL  38  -4.436 -11.688   2.983
  300   HG22  VAL  38          1HG2      VAL  38  -3.008 -10.674   2.778
  301   HG23  VAL  38          2HG2      VAL  38  -4.253 -10.704   1.530
  302    H    ILE  39           HN       ILE  39  -5.874  -7.253   2.552
  303    HA   ILE  39           HA       ILE  39  -7.489  -6.310   4.819
  304    HB   ILE  39           HB       ILE  39  -6.177  -4.204   4.641
  305   HG12  ILE  39          2HG1      ILE  39  -4.524  -5.806   2.673
  306   HG13  ILE  39          1HG1      ILE  39  -5.513  -4.404   2.284
  307   HG21  ILE  39          1HG2      ILE  39  -4.116  -5.142   5.620
  308   HG22  ILE  39          2HG2      ILE  39  -4.619  -6.746   5.082
  309   HG23  ILE  39          3HG2      ILE  39  -5.580  -5.874   6.277
  310   HD11  ILE  39          3HD1      ILE  39  -3.133  -4.378   4.124
  311   HD12  ILE  39          1HD1      ILE  39  -4.085  -2.984   3.614
  312   HD13  ILE  39          2HD1      ILE  39  -3.123  -3.875   2.433
  313    H    GLY  40           HN       GLY  40  -7.954  -6.808   1.705
  314    HA2  GLY  40           2HA      GLY  40  -8.674  -4.401   0.519
  315    HA3  GLY  40           1HA      GLY  40  -9.356  -5.965   0.110
  316    HA   PRO  41           HA       PRO  41 -13.190  -4.762   1.874
  317    HB2  PRO  41           2HB      PRO  41 -14.116  -6.881   3.236
  318    HB3  PRO  41           1HB      PRO  41 -13.884  -6.929   1.483
  319    HG2  PRO  41           2HG      PRO  41 -12.120  -7.994   3.655
  320    HG3  PRO  41           1HG      PRO  41 -12.584  -8.753   2.121
  321    HD2  PRO  41           2HD      PRO  41 -10.198  -7.471   2.522
  322    HD3  PRO  41           1HD      PRO  41 -10.983  -7.612   0.937
  323    H    LEU  42           HN       LEU  42 -10.630  -5.108   3.956
  324    HA   LEU  42           HA       LEU  42 -12.088  -4.645   6.415
  325    HB2  LEU  42           2HB      LEU  42  -9.119  -4.539   5.853
  326    HB3  LEU  42           1HB      LEU  42  -9.858  -4.455   7.440
  327    HG   LEU  42           HG       LEU  42  -9.890  -6.831   5.578
  328   HD11  LEU  42          1HD1      LEU  42  -8.554  -6.377   8.242
  329   HD12  LEU  42          2HD1      LEU  42  -7.747  -6.464   6.675
  330   HD13  LEU  42          3HD1      LEU  42  -8.555  -7.888   7.333
  331   HD21  LEU  42          3HD2      LEU  42 -11.081  -6.524   8.333
  332   HD22  LEU  42          1HD2      LEU  42 -11.023  -8.011   7.384
  333   HD23  LEU  42          2HD2      LEU  42 -11.991  -6.645   6.826
  334    H    SER  43           HN       SER  43 -11.695  -2.700   7.724
  335    HA   SER  43           HA       SER  43 -12.033  -0.332   6.229
  336    HB2  SER  43           2HB      SER  43 -12.957  -0.546   8.480
  337    HB3  SER  43           1HB      SER  43 -11.336  -0.680   9.155
  338    HG   SER  43           HG       SER  43 -12.714   1.555   8.234
  339    H    VAL  44           HN       VAL  44 -10.641   1.291   5.696
  340    HA   VAL  44           HA       VAL  44  -7.885   0.725   5.467
  341    HB   VAL  44           HB       VAL  44  -9.058   2.249   3.945
  342   HG11  VAL  44          1HG1      VAL  44 -10.570   3.359   5.427
  343   HG12  VAL  44          2HG1      VAL  44  -9.539   4.577   4.674
  344   HG13  VAL  44          3HG1      VAL  44  -9.236   4.070   6.335
  345   HG21  VAL  44          3HG2      VAL  44  -6.646   2.415   4.083
  346   HG22  VAL  44          1HG2      VAL  44  -6.777   3.548   5.429
  347   HG23  VAL  44          2HG2      VAL  44  -7.346   4.015   3.827
  348    H    GLN  45           HN       GLN  45  -9.790   2.005   8.021
  349    HA   GLN  45           HA       GLN  45  -7.547   3.146   9.464
  350    HB2  GLN  45           2HB      GLN  45  -9.791   4.104   9.732
  351    HB3  GLN  45           1HB      GLN  45 -10.376   2.568  10.360
  352    HG2  GLN  45           2HG      GLN  45  -8.899   2.762  12.273
  353    HG3  GLN  45           1HG      GLN  45  -8.248   4.271  11.636
  354   HE21  GLN  45          1HE2      GLN  45  -8.870   5.422  13.433
  355   HE22  GLN  45          2HE2      GLN  45 -10.520   5.844  13.730
  356    H    ASP  46           HN       ASP  46  -9.238   0.137   9.196
  357    HA   ASP  46           HA       ASP  46  -8.335  -0.934  11.704
  358    HB2  ASP  46           2HB      ASP  46 -10.468  -1.594  10.482
  359    HB3  ASP  46           1HB      ASP  46  -9.445  -2.496   9.369
  360    H    VAL  47           HN       VAL  47  -7.108  -0.757   8.489
  361    HA   VAL  47           HA       VAL  47  -5.391  -2.957   8.406
  362    HB   VAL  47           HB       VAL  47  -4.919  -0.222   7.198
  363   HG11  VAL  47          1HG1      VAL  47  -3.470  -1.405   5.610
  364   HG12  VAL  47          2HG1      VAL  47  -3.722  -2.903   6.505
  365   HG13  VAL  47          3HG1      VAL  47  -2.878  -1.554   7.265
  366   HG21  VAL  47          3HG2      VAL  47  -7.051  -1.202   6.502
  367   HG22  VAL  47          1HG2      VAL  47  -6.216  -2.679   6.020
  368   HG23  VAL  47          2HG2      VAL  47  -5.897  -1.167   5.169
  369    H    ASP  48           HN       ASP  48  -4.091  -3.459  10.028
  370    HA   ASP  48           HA       ASP  48  -2.538  -1.348  11.348
  371    HB2  ASP  48           2HB      ASP  48  -3.991  -2.610  12.829
  372    HB3  ASP  48           1HB      ASP  48  -3.290  -4.125  12.287
  373    H    THR  49           HN       THR  49  -0.402  -2.085  12.173
  374    HA   THR  49           HA       THR  49   1.293  -2.727  10.045
  375    HB   THR  49           HB       THR  49   1.928  -2.993  12.990
  376    HG1  THR  49           1HG      THR  49   2.504  -0.698  11.476
  377   HG21  THR  49          3HG2      THR  49   3.683  -2.440  10.592
  378   HG22  THR  49          1HG2      THR  49   3.648  -3.936  11.526
  379   HG23  THR  49          2HG2      THR  49   4.221  -2.442  12.271
  380    H    LYS  50           HN       LYS  50  -0.100  -4.741  12.582
  381    HA   LYS  50           HA       LYS  50   1.425  -7.065  12.161
  382    HB2  LYS  50           2HB      LYS  50  -0.148  -6.544  14.090
  383    HB3  LYS  50           1HB      LYS  50  -1.466  -6.984  13.019
  384    HG2  LYS  50           2HG      LYS  50  -0.466  -9.223  12.764
  385    HG3  LYS  50           1HG      LYS  50   0.769  -8.773  13.939
  386    HD2  LYS  50           2HD      LYS  50  -1.063  -8.302  15.569
  387    HD3  LYS  50           1HD      LYS  50  -2.205  -8.960  14.399
  388    HE2  LYS  50           2HE      LYS  50  -0.882 -11.081  14.422
  389    HE3  LYS  50           1HE      LYS  50   0.067 -10.406  15.747
  390    HZ1  LYS  50           3HZ      LYS  50  -2.819 -11.079  15.726
  391    HZ2  LYS  50           1HZ      LYS  50  -2.119 -10.118  16.934
  392    HZ3  LYS  50           2HZ      LYS  50  -1.609 -11.714  16.725
  393    H    LEU  51           HN       LEU  51  -1.625  -5.958  10.764
  394    HA   LEU  51           HA       LEU  51  -2.068  -8.219   9.120
  395    HB2  LEU  51           2HB      LEU  51  -3.041  -5.376   8.835
  396    HB3  LEU  51           1HB      LEU  51  -3.668  -6.750   7.952
  397    HG   LEU  51           HG       LEU  51  -3.839  -6.349  10.932
  398   HD11  LEU  51          1HD1      LEU  51  -5.300  -4.840   9.715
  399   HD12  LEU  51          2HD1      LEU  51  -6.243  -6.090  10.524
  400   HD13  LEU  51          3HD1      LEU  51  -5.951  -6.193   8.788
  401   HD21  LEU  51          3HD2      LEU  51  -5.278  -8.328  10.918
  402   HD22  LEU  51          1HD2      LEU  51  -3.653  -8.711  10.349
  403   HD23  LEU  51          2HD2      LEU  51  -4.974  -8.537   9.192
  404    H    ILE  52           HN       ILE  52  -0.461  -5.125   8.656
  405    HA   ILE  52           HA       ILE  52   0.107  -5.270   5.933
  406    HB   ILE  52           HB       ILE  52   1.578  -3.985   8.223
  407   HG12  ILE  52          2HG1      ILE  52  -0.098  -2.859   5.973
  408   HG13  ILE  52          1HG1      ILE  52  -0.632  -3.088   7.636
  409   HG21  ILE  52          1HG2      ILE  52   2.217  -3.741   5.290
  410   HG22  ILE  52          2HG2      ILE  52   3.247  -4.445   6.539
  411   HG23  ILE  52          3HG2      ILE  52   2.877  -2.720   6.567
  412   HD11  ILE  52          3HD1      ILE  52   1.552  -1.230   6.715
  413   HD12  ILE  52          1HD1      ILE  52   1.038  -1.468   8.385
  414   HD13  ILE  52          2HD1      ILE  52  -0.077  -0.771   7.211
  415    H    MET  53           HN       MET  53   1.852  -6.612   8.701
  416    HA   MET  53           HA       MET  53   4.072  -7.623   7.296
  417    HB2  MET  53           2HB      MET  53   2.755  -8.610   9.830
  418    HB3  MET  53           1HB      MET  53   4.311  -9.175   9.238
  419    HG2  MET  53           2HG      MET  53   5.224  -6.925   9.469
  420    HG3  MET  53           1HG      MET  53   3.659  -6.344  10.038
  421    HE1  MET  53           3HE      MET  53   6.347  -5.852  11.631
  422    HE2  MET  53           1HE      MET  53   5.857  -6.233  13.282
  423    HE3  MET  53           2HE      MET  53   4.777  -5.319  12.230
  424    H    LYS  54           HN       LYS  54   0.940  -9.045   8.102
  425    HA   LYS  54           HA       LYS  54   1.414 -11.632   7.142
  426    HB2  LYS  54           2HB      LYS  54  -1.183 -10.088   7.279
  427    HB3  LYS  54           1HB      LYS  54  -1.058 -11.822   7.018
  428    HG2  LYS  54           2HG      LYS  54  -0.013 -12.078   9.216
  429    HG3  LYS  54           1HG      LYS  54  -0.134 -10.337   9.473
  430    HD2  LYS  54           2HD      LYS  54  -1.952 -11.462  10.613
  431    HD3  LYS  54           1HD      LYS  54  -2.586 -10.500   9.278
  432    HE2  LYS  54           2HE      LYS  54  -3.677 -12.676   9.383
  433    HE3  LYS  54           1HE      LYS  54  -2.745 -12.511   7.896
  434    HZ1  LYS  54           3HZ      LYS  54  -1.869 -13.969  10.337
  435    HZ2  LYS  54           1HZ      LYS  54  -0.978 -13.820   8.898
  436    HZ3  LYS  54           2HZ      LYS  54  -2.435 -14.684   8.907
  437    H    VAL  55           HN       VAL  55   0.307  -8.718   5.506
  438    HA   VAL  55           HA       VAL  55  -0.362  -9.948   3.044
  439    HB   VAL  55           HB       VAL  55   0.486  -7.083   3.528
  440   HG11  VAL  55          1HG1      VAL  55   0.577  -7.672   1.176
  441   HG12  VAL  55          2HG1      VAL  55  -0.795  -6.606   1.480
  442   HG13  VAL  55          3HG1      VAL  55  -1.055  -8.335   1.256
  443   HG21  VAL  55          3HG2      VAL  55  -1.404  -7.681   4.931
  444   HG22  VAL  55          1HG2      VAL  55  -2.263  -8.323   3.532
  445   HG23  VAL  55          2HG2      VAL  55  -1.915  -6.597   3.638
  446    H    LEU  56           HN       LEU  56   2.622  -8.518   4.286
  447    HA   LEU  56           HA       LEU  56   3.945  -8.562   1.745
  448    HB2  LEU  56           2HB      LEU  56   4.862  -8.028   4.552
  449    HB3  LEU  56           1HB      LEU  56   6.005  -8.137   3.229
  450    HG   LEU  56           HG       LEU  56   3.750  -6.143   3.459
  451   HD11  LEU  56          1HD1      LEU  56   5.566  -5.685   5.003
  452   HD12  LEU  56          2HD1      LEU  56   5.563  -4.508   3.690
  453   HD13  LEU  56          3HD1      LEU  56   6.738  -5.823   3.691
  454   HD21  LEU  56          3HD2      LEU  56   5.885  -6.451   1.346
  455   HD22  LEU  56          1HD2      LEU  56   4.737  -5.117   1.463
  456   HD23  LEU  56          2HD2      LEU  56   4.160  -6.749   1.133
  457    H    ASP  57           HN       ASP  57   3.521 -10.835   4.287
  458    HA   ASP  57           HA       ASP  57   5.857 -12.265   4.322
  459    HB2  ASP  57           2HB      ASP  57   3.697 -12.577   5.696
  460    HB3  ASP  57           1HB      ASP  57   3.212 -13.679   4.421
  461    HA   PRO  58           HA       PRO  58   4.556 -15.059   0.644
  462    HB2  PRO  58           2HB      PRO  58   2.390 -14.440  -0.836
  463    HB3  PRO  58           1HB      PRO  58   2.278 -15.405   0.641
  464    HG2  PRO  58           2HG      PRO  58   1.709 -12.492   0.237
  465    HG3  PRO  58           1HG      PRO  58   0.793 -13.695   1.165
  466    HD2  PRO  58           2HD      PRO  58   2.515 -11.918   2.303
  467    HD3  PRO  58           1HD      PRO  58   2.171 -13.516   2.988
  468    H    ILE  59           HN       ILE  59   4.305 -11.606   0.449
  469    HA   ILE  59           HA       ILE  59   4.713 -11.464  -2.398
  470    HB   ILE  59           HB       ILE  59   4.920  -9.223  -0.381
  471   HG12  ILE  59          2HG1      ILE  59   2.590 -10.128  -2.092
  472   HG13  ILE  59          1HG1      ILE  59   2.707 -10.300  -0.344
  473   HG21  ILE  59          1HG2      ILE  59   4.536  -9.182  -3.377
  474   HG22  ILE  59          2HG2      ILE  59   6.009  -8.733  -2.519
  475   HG23  ILE  59          3HG2      ILE  59   4.546  -7.768  -2.320
  476   HD11  ILE  59          3HD1      ILE  59   2.610  -7.700  -1.853
  477   HD12  ILE  59          1HD1      ILE  59   2.715  -7.874  -0.100
  478   HD13  ILE  59          2HD1      ILE  59   1.280  -8.435  -0.960
  479    H    TRP  60           HN       TRP  60   6.727 -11.030   0.488
  480    HA   TRP  60           HA       TRP  60   9.049 -10.103  -0.797
  481    HB2  TRP  60           2HB      TRP  60   8.647 -11.668   1.745
  482    HB3  TRP  60           1HB      TRP  60  10.249 -11.197   1.195
  483    HD1  TRP  60           1HD      TRP  60   7.518 -10.022   3.323
  484    HE1  TRP  60           1HE      TRP  60   7.801  -7.533   3.906
  485    HE3  TRP  60           3HE      TRP  60  11.110  -8.784  -0.094
  486    HZ2  TRP  60           2HZ      TRP  60   9.336  -5.338   3.037
  487    HZ3  TRP  60           3HZ      TRP  60  11.935  -6.469  -0.148
  488    HH2  TRP  60           2HH      TRP  60  11.065  -4.780   1.387
  489    H    GLU  61           HN       GLU  61   7.686 -13.277  -0.567
  490    HA   GLU  61           HA       GLU  61  10.055 -14.693  -1.279
  491    HB2  GLU  61           2HB      GLU  61   7.142 -15.463  -1.186
  492    HB3  GLU  61           1HB      GLU  61   8.460 -16.577  -1.447
  493    HG2  GLU  61           2HG      GLU  61   8.163 -14.879   1.011
  494    HG3  GLU  61           1HG      GLU  61   7.588 -16.540   0.878
  495    H    GLN  62           HN       GLN  62   7.409 -13.208  -2.961
  496    HA   GLN  62           HA       GLN  62   8.115 -14.508  -5.470
  497    HB2  GLN  62           2HB      GLN  62   5.860 -12.684  -4.660
  498    HB3  GLN  62           1HB      GLN  62   6.139 -13.163  -6.326
  499    HG2  GLN  62           2HG      GLN  62   5.877 -15.515  -5.677
  500    HG3  GLN  62           1HG      GLN  62   5.553 -15.002  -4.022
  501   HE21  GLN  62          1HE2      GLN  62   3.912 -16.463  -5.991
  502   HE22  GLN  62          2HE2      GLN  62   2.434 -15.572  -6.106
  503    H    LYS  63           HN       LYS  63   7.565 -11.160  -4.349
  504    HA   LYS  63           HA       LYS  63   9.515 -10.253  -6.362
  505    HB2  LYS  63           2HB      LYS  63   6.825  -8.973  -5.829
  506    HB3  LYS  63           1HB      LYS  63   8.035  -8.400  -6.964
  507    HG2  LYS  63           2HG      LYS  63   6.721 -11.093  -7.197
  508    HG3  LYS  63           1HG      LYS  63   6.079  -9.633  -7.951
  509    HD2  LYS  63           2HD      LYS  63   8.166  -9.360  -9.195
  510    HD3  LYS  63           1HD      LYS  63   8.813 -10.815  -8.433
  511    HE2  LYS  63           2HE      LYS  63   7.094 -12.165  -9.464
  512    HE3  LYS  63           1HE      LYS  63   6.325 -10.729 -10.137
  513    HZ1  LYS  63           3HZ      LYS  63   7.695 -11.951 -11.753
  514    HZ2  LYS  63           1HZ      LYS  63   9.072 -11.638 -10.810
  515    HZ3  LYS  63           2HZ      LYS  63   8.225 -10.355 -11.525
  516    HA   PRO  64           HA       PRO  64  10.541  -8.595  -2.161
  517    HB2  PRO  64           2HB      PRO  64  13.173  -8.102  -2.881
  518    HB3  PRO  64           1HB      PRO  64  12.585  -9.579  -2.113
  519    HG2  PRO  64           2HG      PRO  64  13.149  -9.029  -4.989
  520    HG3  PRO  64           1HG      PRO  64  13.439 -10.504  -4.050
  521    HD2  PRO  64           2HD      PRO  64  11.373 -10.304  -5.753
  522    HD3  PRO  64           1HD      PRO  64  11.235 -11.199  -4.226
  523    H    GLU  65           HN       GLU  65  11.859  -7.207  -5.199
  524    HA   GLU  65           HA       GLU  65  12.087  -4.584  -4.186
  525    HB2  GLU  65           2HB      GLU  65  13.247  -5.358  -6.235
  526    HB3  GLU  65           1HB      GLU  65  11.695  -5.424  -7.058
  527    HG2  GLU  65           2HG      GLU  65  11.440  -2.977  -6.571
  528    HG3  GLU  65           1HG      GLU  65  13.111  -2.991  -6.011
  529    H    THR  66           HN       THR  66   9.500  -6.295  -5.818
  530    HA   THR  66           HA       THR  66   7.856  -4.012  -6.225
  531    HB   THR  66           HB       THR  66   6.948  -6.890  -6.134
  532    HG1  THR  66           1HG      THR  66   7.352  -6.505  -8.558
  533   HG21  THR  66          3HG2      THR  66   5.912  -4.460  -7.610
  534   HG22  THR  66          1HG2      THR  66   5.142  -5.247  -6.232
  535   HG23  THR  66          2HG2      THR  66   5.277  -6.100  -7.772
  536    H    ALA  67           HN       ALA  67   8.166  -6.414  -3.679
  537    HA   ALA  67           HA       ALA  67   5.892  -5.779  -2.174
  538    HB1  ALA  67           1HB      ALA  67   8.595  -6.652  -1.142
  539    HB2  ALA  67           2HB      ALA  67   7.325  -7.728  -1.724
  540    HB3  ALA  67           3HB      ALA  67   7.060  -6.757  -0.277
  541    H    SER  68           HN       SER  68   9.138  -4.400  -2.173
  542    HA   SER  68           HA       SER  68   8.738  -2.531  -0.109
  543    HB2  SER  68           2HB      SER  68  10.970  -3.184  -0.959
  544    HB3  SER  68           1HB      SER  68  10.621  -2.369  -2.482
  545    HG   SER  68           HG       SER  68  10.984  -1.234   0.085
  546    H    ARG  69           HN       ARG  69   8.438  -2.249  -3.642
  547    HA   ARG  69           HA       ARG  69   7.699   0.459  -3.681
  548    HB2  ARG  69           2HB      ARG  69   7.320  -1.806  -5.617
  549    HB3  ARG  69           1HB      ARG  69   6.697  -0.202  -5.947
  550    HG2  ARG  69           2HG      ARG  69   9.064   0.633  -5.556
  551    HG3  ARG  69           1HG      ARG  69   9.542  -1.062  -5.645
  552    HD2  ARG  69           2HD      ARG  69   8.720  -1.261  -7.872
  553    HD3  ARG  69           1HD      ARG  69   7.954   0.326  -7.790
  554    HE   ARG  69           HE       ARG  69  10.735  -0.255  -8.301
  555   HH11  ARG  69          1HH1      ARG  69   8.384   2.164  -7.340
  556   HH12  ARG  69          2HH1      ARG  69   9.427   3.508  -7.695
  557   HH21  ARG  69          1HH2      ARG  69  12.102   1.523  -8.801
  558   HH22  ARG  69          2HH2      ARG  69  11.531   3.148  -8.525
  559    H    LEU  70           HN       LEU  70   5.762  -2.507  -3.636
  560    HA   LEU  70           HA       LEU  70   3.241  -1.320  -3.893
  561    HB2  LEU  70           2HB      LEU  70   3.606  -3.721  -4.132
  562    HB3  LEU  70           1HB      LEU  70   4.030  -3.844  -2.436
  563    HG   LEU  70           HG       LEU  70   1.728  -3.195  -1.823
  564   HD11  LEU  70          1HD1      LEU  70   1.194  -1.876  -3.815
  565   HD12  LEU  70          2HD1      LEU  70  -0.012  -3.129  -3.521
  566   HD13  LEU  70          3HD1      LEU  70   1.196  -3.348  -4.787
  567   HD21  LEU  70          3HD2      LEU  70   0.655  -5.279  -2.499
  568   HD22  LEU  70          1HD2      LEU  70   2.326  -5.550  -2.005
  569   HD23  LEU  70          2HD2      LEU  70   1.904  -5.532  -3.717
  570    H    ARG  71           HN       ARG  71   5.201  -1.997  -1.017
  571    HA   ARG  71           HA       ARG  71   3.223  -1.141   0.827
  572    HB2  ARG  71           2HB      ARG  71   5.388  -2.531   1.241
  573    HB3  ARG  71           1HB      ARG  71   6.157  -0.958   1.422
  574    HG2  ARG  71           2HG      ARG  71   5.604  -1.432   3.592
  575    HG3  ARG  71           1HG      ARG  71   4.185  -0.515   3.080
  576    HD2  ARG  71           2HD      ARG  71   4.466  -3.504   3.356
  577    HD3  ARG  71           1HD      ARG  71   3.400  -2.434   4.261
  578    HE   ARG  71           HE       ARG  71   2.685  -2.195   1.595
  579   HH11  ARG  71          1HH1      ARG  71   2.730  -4.695   4.046
  580   HH12  ARG  71          2HH1      ARG  71   1.454  -5.612   3.323
  581   HH21  ARG  71          1HH2      ARG  71   1.006  -3.429   0.622
  582   HH22  ARG  71          2HH2      ARG  71   0.473  -4.892   1.378
  583    H    GLY  72           HN       GLY  72   5.906   0.491  -0.795
  584    HA2  GLY  72           2HA      GLY  72   5.686   2.972   0.528
  585    HA3  GLY  72           1HA      GLY  72   6.384   2.719  -1.066
  586    H    ARG  73           HN       ARG  73   4.119   1.726  -2.388
  587    HA   ARG  73           HA       ARG  73   2.743   4.090  -3.071
  588    HB2  ARG  73           2HB      ARG  73   2.038   1.196  -3.600
  589    HB3  ARG  73           1HB      ARG  73   1.227   2.568  -4.346
  590    HG2  ARG  73           2HG      ARG  73   3.322   3.246  -5.393
  591    HG3  ARG  73           1HG      ARG  73   4.147   1.889  -4.626
  592    HD2  ARG  73           2HD      ARG  73   2.701   0.330  -5.844
  593    HD3  ARG  73           1HD      ARG  73   1.884   1.692  -6.611
  594    HE   ARG  73           HE       ARG  73   4.697   1.806  -7.040
  595   HH11  ARG  73          1HH1      ARG  73   1.808   0.146  -8.128
  596   HH12  ARG  73          2HH1      ARG  73   2.443  -0.199  -9.710
  597   HH21  ARG  73          1HH2      ARG  73   5.521   1.378  -9.118
  598   HH22  ARG  73          2HH2      ARG  73   4.552   0.526 -10.283
  599    H    ILE  74           HN       ILE  74   1.917   1.360  -0.996
  600    HA   ILE  74           HA       ILE  74  -0.694   2.252  -0.349
  601    HB   ILE  74           HB       ILE  74   1.179   0.336   1.025
  602   HG12  ILE  74          2HG1      ILE  74  -1.346   0.015  -0.605
  603   HG13  ILE  74          1HG1      ILE  74   0.288  -0.410  -1.098
  604   HG21  ILE  74          1HG2      ILE  74  -1.671   0.942   1.797
  605   HG22  ILE  74          2HG2      ILE  74  -0.239   1.349   2.742
  606   HG23  ILE  74          3HG2      ILE  74  -0.665  -0.341   2.469
  607   HD11  ILE  74          3HD1      ILE  74   0.361  -2.165   0.565
  608   HD12  ILE  74          1HD1      ILE  74  -1.044  -2.362  -0.485
  609   HD13  ILE  74          2HD1      ILE  74  -1.241  -1.705   1.140
  610    H    GLU  75           HN       GLU  75   2.481   2.790   1.144
  611    HA   GLU  75           HA       GLU  75   1.703   4.137   3.446
  612    HB2  GLU  75           2HB      GLU  75   4.066   3.581   2.790
  613    HB3  GLU  75           1HB      GLU  75   4.018   4.937   1.670
  614    HG2  GLU  75           2HG      GLU  75   3.250   6.203   3.887
  615    HG3  GLU  75           1HG      GLU  75   4.196   4.911   4.620
  616    H    SER  76           HN       SER  76   2.134   5.368   0.158
  617    HA   SER  76           HA       SER  76   1.532   8.055   0.658
  618    HB2  SER  76           2HB      SER  76   2.528   7.015  -1.458
  619    HB3  SER  76           1HB      SER  76   0.873   6.609  -1.893
  620    HG   SER  76           HG       SER  76   1.749   9.243  -1.276
  621    H    VAL  77           HN       VAL  77  -0.540   5.333  -0.276
  622    HA   VAL  77           HA       VAL  77  -2.961   6.746  -0.445
  623    HB   VAL  77           HB       VAL  77  -2.517   3.848   0.316
  624   HG11  VAL  77          1HG1      VAL  77  -5.005   5.237  -0.682
  625   HG12  VAL  77          2HG1      VAL  77  -4.751   4.590   0.938
  626   HG13  VAL  77          3HG1      VAL  77  -4.826   3.497  -0.444
  627   HG21  VAL  77          3HG2      VAL  77  -2.966   3.386  -2.053
  628   HG22  VAL  77          1HG2      VAL  77  -1.540   4.402  -1.848
  629   HG23  VAL  77          2HG2      VAL  77  -3.066   5.117  -2.369
  630    H    LEU  78           HN       LEU  78  -1.489   4.983   2.268
  631    HA   LEU  78           HA       LEU  78  -3.540   5.473   4.131
  632    HB2  LEU  78           2HB      LEU  78  -0.592   5.012   4.592
  633    HB3  LEU  78           1HB      LEU  78  -1.813   4.979   5.849
  634    HG   LEU  78           HG       LEU  78  -1.624   3.066   3.519
  635   HD11  LEU  78          1HD1      LEU  78   0.111   2.708   5.194
  636   HD12  LEU  78          2HD1      LEU  78  -1.083   1.410   5.238
  637   HD13  LEU  78          3HD1      LEU  78  -1.110   2.674   6.467
  638   HD21  LEU  78          3HD2      LEU  78  -3.937   3.453   4.135
  639   HD22  LEU  78          1HD2      LEU  78  -3.556   3.167   5.833
  640   HD23  LEU  78          2HD2      LEU  78  -3.427   1.850   4.666
  641    H    ASP  79           HN       ASP  79  -0.662   7.309   3.255
  642    HA   ASP  79           HA       ASP  79  -0.781   9.248   5.298
  643    HB2  ASP  79           2HB      ASP  79   1.168   8.872   3.804
  644    HB3  ASP  79           1HB      ASP  79   0.245   9.533   2.460
  645    H    TRP  80           HN       TRP  80  -2.042   9.233   1.996
  646    HA   TRP  80           HA       TRP  80  -3.293  11.752   2.061
  647    HB2  TRP  80           2HB      TRP  80  -2.836  10.622  -0.030
  648    HB3  TRP  80           1HB      TRP  80  -3.853   9.265   0.430
  649    HD1  TRP  80           1HD      TRP  80  -4.110  12.921  -0.751
  650    HE1  TRP  80           1HE      TRP  80  -6.461  13.277  -1.741
  651    HE3  TRP  80           3HE      TRP  80  -6.197   8.420   0.484
  652    HZ2  TRP  80           2HZ      TRP  80  -8.885  11.833  -1.962
  653    HZ3  TRP  80           3HZ      TRP  80  -8.533   7.987  -0.155
  654    HH2  TRP  80           2HH      TRP  80  -9.846   9.661  -1.353
  655    H    ALA  81           HN       ALA  81  -4.502   8.503   2.762
  656    HA   ALA  81           HA       ALA  81  -7.196   9.177   3.161
  657    HB1  ALA  81           1HB      ALA  81  -6.404   6.889   2.804
  658    HB2  ALA  81           2HB      ALA  81  -7.399   7.020   4.255
  659    HB3  ALA  81           3HB      ALA  81  -5.645   6.909   4.396
  660    H    THR  82           HN       THR  82  -4.458   9.137   5.392
  661    HA   THR  82           HA       THR  82  -6.003   9.530   7.744
  662    HB   THR  82           HB       THR  82  -3.099  10.275   7.336
  663    HG1  THR  82           1HG      THR  82  -3.200   8.148   6.798
  664   HG21  THR  82          3HG2      THR  82  -4.100  11.109   9.419
  665   HG22  THR  82          1HG2      THR  82  -2.920   9.838   9.744
  666   HG23  THR  82          2HG2      THR  82  -4.647   9.479   9.811
  667    H    VAL  83           HN       VAL  83  -4.358  11.710   5.502
  668    HA   VAL  83           HA       VAL  83  -4.905  14.098   6.935
  669    HB   VAL  83           HB       VAL  83  -4.364  13.684   3.987
  670   HG11  VAL  83          1HG1      VAL  83  -5.477  15.823   4.370
  671   HG12  VAL  83          2HG1      VAL  83  -3.785  16.067   3.938
  672   HG13  VAL  83          3HG1      VAL  83  -4.297  16.224   5.619
  673   HG21  VAL  83          3HG2      VAL  83  -2.542  14.475   6.258
  674   HG22  VAL  83          1HG2      VAL  83  -2.087  14.400   4.556
  675   HG23  VAL  83          2HG2      VAL  83  -2.544  12.928   5.412
  676    H    ARG  84           HN       ARG  84  -6.593  12.416   4.294
  677    HA   ARG  84           HA       ARG  84  -8.705  14.261   4.054
  678    HB2  ARG  84           2HB      ARG  84  -8.009  11.607   3.061
  679    HB3  ARG  84           1HB      ARG  84  -9.740  11.838   3.268
  680    HG2  ARG  84           2HG      ARG  84  -8.818  12.388   0.998
  681    HG3  ARG  84           1HG      ARG  84  -9.779  13.636   1.774
  682    HD2  ARG  84           2HD      ARG  84  -6.808  13.654   2.044
  683    HD3  ARG  84           1HD      ARG  84  -7.573  14.291   0.589
  684    HE   ARG  84           HE       ARG  84  -7.785  15.389   3.301
  685   HH11  ARG  84          1HH1      ARG  84  -8.536  15.605  -0.104
  686   HH12  ARG  84          2HH1      ARG  84  -9.068  17.253  -0.022
  687   HH21  ARG  84          1HH2      ARG  84  -8.486  17.559   3.433
  688   HH22  ARG  84          2HH2      ARG  84  -9.018  18.380   1.991
  689    H    GLY  85           HN       GLY  85  -8.132  11.655   6.293
  690    HA2  GLY  85           2HA      GLY  85  -9.207  11.524   8.386
  691    HA3  GLY  85           1HA      GLY  85 -10.523  12.494   7.745
  692    H    TYR  86           HN       TYR  86  -9.490   9.887   5.763
  693    HA   TYR  86           HA       TYR  86 -11.971   8.475   6.272
  694    HB2  TYR  86           2HB      TYR  86  -9.689   7.853   4.376
  695    HB3  TYR  86           1HB      TYR  86 -11.182   6.924   4.483
  696    HD1  TYR  86           2HD      TYR  86 -13.287   8.849   4.591
  697    HD2  TYR  86           1HD      TYR  86  -9.650   9.034   2.398
  698    HE1  TYR  86           2HE      TYR  86 -14.350  10.368   2.968
  699    HE2  TYR  86           1HE      TYR  86 -10.697  10.550   0.773
  700    HH   TYR  86           HH       TYR  86 -13.594  12.143   1.335
  701    H    ARG  87           HN       ARG  87  -8.776   8.446   7.335
  702    HA   ARG  87           HA       ARG  87  -9.343   6.221   9.112
  703    HB2  ARG  87           2HB      ARG  87  -7.267   5.072   8.666
  704    HB3  ARG  87           1HB      ARG  87  -8.133   5.244   7.145
  705    HG2  ARG  87           2HG      ARG  87  -6.719   7.104   6.516
  706    HG3  ARG  87           1HG      ARG  87  -5.880   7.015   8.065
  707    HD2  ARG  87           2HD      ARG  87  -5.896   4.960   5.865
  708    HD3  ARG  87           1HD      ARG  87  -4.533   5.936   6.408
  709    HE   ARG  87           HE       ARG  87  -5.594   3.545   7.654
  710   HH11  ARG  87          1HH1      ARG  87  -3.600   6.405   8.054
  711   HH12  ARG  87          2HH1      ARG  87  -2.632   5.711   9.320
  712   HH21  ARG  87          1HH2      ARG  87  -4.344   2.641   9.351
  713   HH22  ARG  87          2HH2      ARG  87  -3.088   3.580  10.082
  714    H    GLU  88           HN       GLU  88  -8.008   6.299  11.012
  715    HA   GLU  88           HA       GLU  88  -6.490   8.795  11.298
  716    HB2  GLU  88           2HB      GLU  88  -8.475   7.613  13.244
  717    HB3  GLU  88           1HB      GLU  88  -7.357   8.906  13.656
  718    HG2  GLU  88           2HG      GLU  88  -8.363  10.319  11.932
  719    HG3  GLU  88           1HG      GLU  88  -9.490   9.025  11.534
  720    H    GLY  89           HN       GLY  89  -4.962   8.758  13.122
  721    HA2  GLY  89           2HA      GLY  89  -3.777   7.271  14.715
  722    HA3  GLY  89           1HA      GLY  89  -3.843   6.047  13.454
  723    H    ASP  90           HN       ASP  90  -1.947   5.771  12.492
  724    HA   ASP  90           HA       ASP  90  -0.418   8.118  11.651
  725    HB2  ASP  90           2HB      ASP  90   0.456   7.125  13.878
  726    HB3  ASP  90           1HB      ASP  90   1.010   5.770  12.898
  727    H    ASN  91           HN       ASN  91   1.772   6.654  10.599
  728    HA   ASN  91           HA       ASN  91   0.425   5.304   8.369
  729    HB2  ASN  91           2HB      ASN  91   2.816   7.063   8.614
  730    HB3  ASN  91           1HB      ASN  91   2.810   5.849   7.349
  731   HD21  ASN  91          1HD2      ASN  91   1.535   6.130   5.577
  732   HD22  ASN  91          2HD2      ASN  91   0.606   7.557   5.286
  733    HA   PRO  92           HA       PRO  92   2.519   1.927  10.663
  734    HB2  PRO  92           2HB      PRO  92   0.630   0.240   9.165
  735    HB3  PRO  92           1HB      PRO  92   0.876   0.382  10.908
  736    HG2  PRO  92           2HG      PRO  92  -1.321   1.363   9.715
  737    HG3  PRO  92           1HG      PRO  92  -0.571   2.173  11.103
  738    HD2  PRO  92           2HD      PRO  92  -0.371   2.828   8.189
  739    HD3  PRO  92           1HD      PRO  92  -0.574   3.921   9.575
  740    H    ALA  93           HN       ALA  93   2.163   2.520   7.316
  741    HA   ALA  93           HA       ALA  93   3.909   0.277   6.589
  742    HB1  ALA  93           1HB      ALA  93   3.301   0.749   4.278
  743    HB2  ALA  93           2HB      ALA  93   2.394   2.173   4.790
  744    HB3  ALA  93           3HB      ALA  93   1.853   0.564   5.267
  745    H    ARG  94           HN       ARG  94   4.390   3.189   7.766
  746    HA   ARG  94           HA       ARG  94   6.473   4.003   5.872
  747    HB2  ARG  94           2HB      ARG  94   4.933   5.765   6.485
  748    HB3  ARG  94           1HB      ARG  94   5.194   5.454   8.193
  749    HG2  ARG  94           2HG      ARG  94   7.419   6.294   8.086
  750    HG3  ARG  94           1HG      ARG  94   7.356   6.384   6.323
  751    HD2  ARG  94           2HD      ARG  94   5.584   7.960   8.187
  752    HD3  ARG  94           1HD      ARG  94   7.057   8.581   7.442
  753    HE   ARG  94           HE       ARG  94   5.750   7.848   5.275
  754   HH11  ARG  94          1HH1      ARG  94   4.465   9.446   8.125
  755   HH12  ARG  94          2HH1      ARG  94   3.263  10.331   7.232
  756   HH21  ARG  94          1HH2      ARG  94   4.180   8.977   4.122
  757   HH22  ARG  94          2HH2      ARG  94   3.082  10.053   4.952
  758    H    TRP  95           HN       TRP  95   5.985   3.551   9.363
  759    HA   TRP  95           HA       TRP  95   7.291   2.671  10.990
  760    HB2  TRP  95           2HB      TRP  95   8.801   1.706   8.590
  761    HB3  TRP  95           1HB      TRP  95   9.461   1.485  10.207
  762    HD1  TRP  95           1HD      TRP  95   7.645   0.200  11.961
  763    HE1  TRP  95           1HE      TRP  95   6.245  -1.898  11.458
  764    HE3  TRP  95           3HE      TRP  95   7.664   0.436   6.858
  765    HZ2  TRP  95           2HZ      TRP  95   5.265  -3.269   9.183
  766    HZ3  TRP  95           3HZ      TRP  95   6.469  -1.303   5.591
  767    HH2  TRP  95           2HH      TRP  95   5.295  -3.115   6.729
  768    H    ARG  96           HN       ARG  96   9.027   3.159  12.293
  769    HA   ARG  96           HA       ARG  96  10.751   5.363  11.420
  770    HB2  ARG  96           2HB      ARG  96   9.560   5.882  13.438
  771    HB3  ARG  96           1HB      ARG  96   9.957   4.324  14.145
  772    HG2  ARG  96           2HG      ARG  96  12.291   4.964  14.293
  773    HG3  ARG  96           1HG      ARG  96  11.919   6.506  13.527
  774    HD2  ARG  96           2HD      ARG  96  10.617   7.213  15.386
  775    HD3  ARG  96           1HD      ARG  96  10.640   5.599  16.096
  776    HE   ARG  96           HE       ARG  96  13.089   5.959  16.400
  777   HH11  ARG  96          1HH1      ARG  96  10.947   8.710  16.066
  778   HH12  ARG  96          2HH1      ARG  96  11.932   9.761  17.046
  779   HH21  ARG  96          1HH2      ARG  96  14.406   7.335  17.659
  780   HH22  ARG  96          2HH2      ARG  96  13.903   8.972  17.955
  781    H    GLY  97           HN       GLY  97  10.601   2.056  12.319
  782    HA2  GLY  97           2HA      GLY  97  13.199   1.507  11.325
  783    HA3  GLY  97           1HA      GLY  97  13.194   1.459  13.083
  784    H    TYR  98           HN       TYR  98  12.044  -0.049  10.168
  785    HA   TYR  98           HA       TYR  98  10.794  -2.197  11.705
  786    HB2  TYR  98           2HB      TYR  98   9.549  -1.321   9.780
  787    HB3  TYR  98           1HB      TYR  98  10.888  -1.735   8.715
  788    HD1  TYR  98           1HD      TYR  98   9.348  -3.731  11.466
  789    HD2  TYR  98           2HD      TYR  98  10.035  -3.362   7.286
  790    HE1  TYR  98           1HE      TYR  98   8.376  -5.961  11.115
  791    HE2  TYR  98           2HE      TYR  98   9.068  -5.593   6.925
  792    HH   TYR  98           HH       TYR  98   7.459  -7.336   9.470
  793    H    LEU  99           HN       LEU  99  12.870  -2.183   8.800
  794    HA   LEU  99           HA       LEU  99  14.067  -4.675   9.691
  795    HB2  LEU  99           2HB      LEU  99  14.367  -3.118   7.121
  796    HB3  LEU  99           1HB      LEU  99  15.151  -4.648   7.448
  797    HG   LEU  99           HG       LEU  99  12.169  -4.212   7.279
  798   HD11  LEU  99          1HD1      LEU  99  13.270  -4.035   5.112
  799   HD12  LEU  99          2HD1      LEU  99  12.322  -5.517   5.222
  800   HD13  LEU  99          3HD1      LEU  99  14.076  -5.580   5.388
  801   HD21  LEU  99          3HD2      LEU  99  13.754  -6.758   7.604
  802   HD22  LEU  99          1HD2      LEU  99  12.003  -6.636   7.417
  803   HD23  LEU  99          2HD2      LEU  99  12.784  -5.985   8.858
  804    H    GLU 100           HN       GLU 100  15.107  -1.424   8.724
  805    HA   GLU 100           HA       GLU 100  17.427  -1.691  10.470
  806    HB2  GLU 100           2HB      GLU 100  18.938  -0.799   8.750
  807    HB3  GLU 100           1HB      GLU 100  18.245  -2.335   8.247
  808    HG2  GLU 100           2HG      GLU 100  16.712  -1.233   6.777
  809    HG3  GLU 100           1HG      GLU 100  17.203   0.350   7.378
  810    H    HIS 101           HN       HIS 101  18.354   0.344  11.057
  811    HA   HIS 101           HA       HIS 101  16.540   2.613  10.771
  812    HB2  HIS 101           2HB      HIS 101  19.032   2.178  12.430
  813    HB3  HIS 101           1HB      HIS 101  18.232   3.741  12.307
  814    HD1  HIS 101           1HD      HIS 101  18.454   1.109  14.573
  815    HD2  HIS 101           2HD      HIS 101  15.243   3.230  12.978
  816    HE1  HIS 101           1HE      HIS 101  16.547   0.775  16.181
  817    HE2  HIS 101           2HE      HIS 101  14.573   1.914  15.108
  818    H    HIS 102           HN       HIS 102  16.743   3.705   8.937
  819    HA   HIS 102           HA       HIS 102  19.104   3.665   7.360
  820    HB2  HIS 102           2HB      HIS 102  16.514   5.149   7.220
  821    HB3  HIS 102           1HB      HIS 102  17.858   5.672   6.209
  822    HD1  HIS 102           1HD      HIS 102  18.392   4.286   4.166
  823    HD2  HIS 102           2HD      HIS 102  15.541   2.531   6.629
  824    HE1  HIS 102           1HE      HIS 102  17.476   2.339   2.861
  825    HE2  HIS 102           2HE      HIS 102  15.899   1.177   4.449
  826    H    HIS 103           HN       HIS 103  17.682   6.081   9.507
  827    HA   HIS 103           HA       HIS 103  18.537   7.876  10.590
  828    HB2  HIS 103           2HB      HIS 103  20.390   6.410  11.245
  829    HB3  HIS 103           1HB      HIS 103  21.223   6.767   9.736
  830    HD1  HIS 103           1HD      HIS 103  22.892   8.581   9.862
  831    HD2  HIS 103           2HD      HIS 103  20.045   8.888  12.877
  832    HE1  HIS 103           1HE      HIS 103  23.628  10.514  11.297
  833    HE2  HIS 103           2HE      HIS 103  21.822  10.761  13.042
  834    H    HIS 104           HN       HIS 104  18.597   9.975  10.012
  835    HA   HIS 104           HA       HIS 104  18.647  10.520   7.210
  836    HB2  HIS 104           2HB      HIS 104  17.967  12.727   7.722
  837    HB3  HIS 104           1HB      HIS 104  17.175  11.699   8.904
  838    HD1  HIS 104           1HD      HIS 104  19.288  14.640   8.580
  839    HD2  HIS 104           2HD      HIS 104  18.431  11.856  11.544
  840    HE1  HIS 104           1HE      HIS 104  20.060  15.684  10.734
  841    HE2  HIS 104           2HE      HIS 104  19.303  14.084  12.530
  842    H    HIS 105           HN       HIS 105  20.329  10.839   6.002
  843    HA   HIS 105           HA       HIS 105  22.408  12.672   6.686
  844    HB2  HIS 105           2HB      HIS 105  23.200  10.594   7.849
  845    HB3  HIS 105           1HB      HIS 105  23.227   9.780   6.288
  846    HD1  HIS 105           1HD      HIS 105  25.271  11.828   8.513
  847    HD2  HIS 105           2HD      HIS 105  25.179  10.963   4.442
  848    HE1  HIS 105           1HE      HIS 105  27.511  12.533   7.612
  849    HE2  HIS 105           2HE      HIS 105  27.471  11.924   5.166
  850    H    HIS 106           HN       HIS 106  22.099   9.788   4.586
  851    HA   HIS 106           HA       HIS 106  21.560  11.584   2.357
  852    HB2  HIS 106           2HB      HIS 106  23.071  10.490   0.820
  853    HB3  HIS 106           1HB      HIS 106  23.987  11.071   2.198
  854    HD1  HIS 106           1HD      HIS 106  25.487   9.424   3.296
  855    HD2  HIS 106           2HD      HIS 106  22.679   7.589   0.850
  856    HE1  HIS 106           1HE      HIS 106  26.132   6.996   3.233
  857    HE2  HIS 106           2HE      HIS 106  24.302   5.876   1.908
  Start of MODEL    8
    1    H1   MET   1           H1       MET   1 -15.384   4.795   6.448
    2    H2   MET   1           H2       MET   1 -14.029   4.006   7.092
    3    H3   MET   1           H3       MET   1 -15.338   3.099   6.519
    4    HA   MET   1           HA       MET   1 -14.923   3.912   4.271
    5    HB2  MET   1           2HB      MET   1 -13.859   6.021   4.810
    6    HB3  MET   1           1HB      MET   1 -12.541   5.195   5.630
    7    HG2  MET   1           2HG      MET   1 -11.809   5.964   3.472
    8    HG3  MET   1           1HG      MET   1 -11.859   4.204   3.495
    9    HE1  MET   1           2HE      MET   1 -13.467   7.490   2.128
   10    HE2  MET   1           3HE      MET   1 -14.802   6.832   3.076
   11    HE3  MET   1           1HE      MET   1 -14.913   6.891   1.317
   12    H    THR   2           HN       THR   2 -14.081   2.269   3.052
   13    HA   THR   2           HA       THR   2 -12.459   0.305   4.489
   14    HB   THR   2           HB       THR   2 -12.950  -1.207   2.576
   15    HG1  THR   2           1HG      THR   2 -14.839   0.715   1.674
   16   HG21  THR   2          3HG2      THR   2 -14.412  -1.178   4.550
   17   HG22  THR   2          1HG2      THR   2 -15.311  -1.546   3.077
   18   HG23  THR   2          2HG2      THR   2 -15.403   0.065   3.789
   19    H    PHE   3           HN       PHE   3 -10.649  -0.747   3.317
   20    HA   PHE   3           HA       PHE   3  -8.831   1.264   2.482
   21    HB2  PHE   3           2HB      PHE   3  -8.127  -0.809   3.652
   22    HB3  PHE   3           1HB      PHE   3  -8.546  -1.738   2.217
   23    HD1  PHE   3           2HD      PHE   3  -6.326   0.974   3.434
   24    HD2  PHE   3           1HD      PHE   3  -6.988  -2.031   0.489
   25    HE1  PHE   3           2HE      PHE   3  -4.067   1.359   2.538
   26    HE2  PHE   3           1HE      PHE   3  -4.728  -1.649  -0.412
   27    HZ   PHE   3           HZ       PHE   3  -3.265   0.048   0.610
   28    H    SER   4           HN       SER   4 -10.641  -1.231   0.755
   29    HA   SER   4           HA       SER   4  -9.557  -0.838  -1.790
   30    HB2  SER   4           2HB      SER   4 -11.027  -2.736  -1.202
   31    HB3  SER   4           1HB      SER   4 -12.392  -1.631  -1.071
   32    HG   SER   4           HG       SER   4 -11.114  -1.362  -3.451
   33    H    GLU   5           HN       GLU   5 -12.234   0.799  -0.155
   34    HA   GLU   5           HA       GLU   5 -12.965   2.431  -2.357
   35    HB2  GLU   5           2HB      GLU   5 -13.529   2.452   0.581
   36    HB3  GLU   5           1HB      GLU   5 -13.988   3.834  -0.395
   37    HG2  GLU   5           2HG      GLU   5 -15.318   2.382  -1.825
   38    HG3  GLU   5           1HG      GLU   5 -14.864   0.995  -0.837
   39    H    CYS   6           HN       CYS   6 -10.948   2.968   0.495
   40    HA   CYS   6           HA       CYS   6 -10.371   5.684   0.006
   41    HB2  CYS   6           2HB      CYS   6 -10.016   4.380   2.152
   42    HB3  CYS   6           1HB      CYS   6  -8.565   3.722   1.421
   43    HG   CYS   6           HG       CYS   6  -7.847   6.643   0.925
   44    H    ALA   7           HN       ALA   7  -8.537   2.738  -0.719
   45    HA   ALA   7           HA       ALA   7  -6.358   3.916  -2.011
   46    HB1  ALA   7           1HB      ALA   7  -5.995   1.747  -3.071
   47    HB2  ALA   7           2HB      ALA   7  -7.626   1.244  -2.624
   48    HB3  ALA   7           3HB      ALA   7  -6.424   1.552  -1.371
   49    H    ALA   8           HN       ALA   8  -9.485   2.868  -3.315
   50    HA   ALA   8           HA       ALA   8  -8.990   3.495  -6.002
   51    HB1  ALA   8           1HB      ALA   8 -10.902   2.156  -5.311
   52    HB2  ALA   8           2HB      ALA   8 -11.426   3.546  -6.261
   53    HB3  ALA   8           3HB      ALA   8 -11.615   3.555  -4.508
   54    H    LEU   9           HN       LEU   9 -10.247   5.471  -3.335
   55    HA   LEU   9           HA       LEU   9 -10.847   7.774  -4.827
   56    HB2  LEU   9           2HB      LEU   9  -9.960   7.515  -1.950
   57    HB3  LEU   9           1HB      LEU   9 -10.563   8.995  -2.666
   58    HG   LEU   9           HG       LEU   9 -12.143   6.440  -2.387
   59   HD11  LEU   9          1HD1      LEU   9 -13.385   7.644  -0.669
   60   HD12  LEU   9          2HD1      LEU   9 -12.309   9.028  -0.850
   61   HD13  LEU   9          3HD1      LEU   9 -11.683   7.499  -0.232
   62   HD21  LEU   9          3HD2      LEU   9 -14.047   7.827  -3.050
   63   HD22  LEU   9          1HD2      LEU   9 -12.823   7.770  -4.318
   64   HD23  LEU   9          2HD2      LEU   9 -12.964   9.199  -3.294
   65    H    TYR  10           HN       TYR  10  -7.858   6.745  -3.236
   66    HA   TYR  10           HA       TYR  10  -6.325   9.041  -3.740
   67    HB2  TYR  10           2HB      TYR  10  -5.568   7.281  -2.215
   68    HB3  TYR  10           1HB      TYR  10  -5.437   6.150  -3.555
   69    HD1  TYR  10           2HD      TYR  10  -3.952   9.155  -2.013
   70    HD2  TYR  10           1HD      TYR  10  -3.534   6.160  -5.008
   71    HE1  TYR  10           2HE      TYR  10  -1.620   9.846  -2.373
   72    HE2  TYR  10           1HE      TYR  10  -1.201   6.839  -5.371
   73    HH   TYR  10           HH       TYR  10   0.476   8.879  -3.257
   74    H    ILE  11           HN       ILE  11  -6.695   6.072  -5.613
   75    HA   ILE  11           HA       ILE  11  -4.956   6.806  -7.713
   76    HB   ILE  11           HB       ILE  11  -7.215   4.798  -7.681
   77   HG12  ILE  11          2HG1      ILE  11  -4.231   4.411  -7.369
   78   HG13  ILE  11          1HG1      ILE  11  -5.375   4.446  -6.032
   79   HG21  ILE  11          1HG2      ILE  11  -6.664   5.427  -9.970
   80   HG22  ILE  11          2HG2      ILE  11  -6.110   3.790  -9.623
   81   HG23  ILE  11          3HG2      ILE  11  -4.956   5.121  -9.656
   82   HD11  ILE  11          3HD1      ILE  11  -6.493   2.470  -6.965
   83   HD12  ILE  11          1HD1      ILE  11  -4.794   2.174  -6.595
   84   HD13  ILE  11          2HD1      ILE  11  -5.300   2.429  -8.266
   85    H    LYS  12           HN       LYS  12  -8.506   6.936  -7.442
   86    HA   LYS  12           HA       LYS  12  -8.963   7.926 -10.043
   87    HB2  LYS  12           2HB      LYS  12 -10.640   8.110  -7.537
   88    HB3  LYS  12           1HB      LYS  12 -11.202   8.613  -9.125
   89    HG2  LYS  12           2HG      LYS  12 -10.961   6.359  -9.966
   90    HG3  LYS  12           1HG      LYS  12 -10.275   5.834  -8.427
   91    HD2  LYS  12           2HD      LYS  12 -12.576   5.168  -8.500
   92    HD3  LYS  12           1HD      LYS  12 -12.417   6.478  -7.330
   93    HE2  LYS  12           2HE      LYS  12 -13.226   8.065  -9.019
   94    HE3  LYS  12           1HE      LYS  12 -13.388   6.743 -10.174
   95    HZ1  LYS  12           3HZ      LYS  12 -14.854   6.948  -7.598
   96    HZ2  LYS  12           1HZ      LYS  12 -15.036   5.722  -8.754
   97    HZ3  LYS  12           2HZ      LYS  12 -15.504   7.309  -9.123
   98    H    ALA  13           HN       ALA  13  -8.277   9.569  -7.007
   99    HA   ALA  13           HA       ALA  13  -8.808  12.197  -7.930
  100    HB1  ALA  13           1HB      ALA  13  -6.926  11.288  -5.751
  101    HB2  ALA  13           2HB      ALA  13  -8.634  11.684  -5.552
  102    HB3  ALA  13           3HB      ALA  13  -7.484  12.942  -6.008
  103    H    HIS  14           HN       HIS  14  -6.139  10.029  -8.352
  104    HA   HIS  14           HA       HIS  14  -4.443  12.195  -9.370
  105    HB2  HIS  14           2HB      HIS  14  -3.841   9.380  -8.489
  106    HB3  HIS  14           1HB      HIS  14  -2.690  10.305  -9.447
  107    HD1  HIS  14           1HD      HIS  14  -4.253  10.136  -6.052
  108    HD2  HIS  14           2HD      HIS  14  -1.375  12.355  -8.073
  109    HE1  HIS  14           1HE      HIS  14  -3.047  11.456  -4.282
  110    HE2  HIS  14           2HE      HIS  14  -1.452  12.941  -5.552
  111    H    ARG  15           HN       ARG  15  -6.735  10.243 -10.589
  112    HA   ARG  15           HA       ARG  15  -5.581   9.072 -12.863
  113    HB2  ARG  15           2HB      ARG  15  -8.361  10.044 -12.247
  114    HB3  ARG  15           1HB      ARG  15  -7.963   9.327 -13.800
  115    HG2  ARG  15           2HG      ARG  15  -7.406   7.929 -11.214
  116    HG3  ARG  15           1HG      ARG  15  -8.959   7.814 -12.036
  117    HD2  ARG  15           2HD      ARG  15  -6.281   7.074 -13.210
  118    HD3  ARG  15           1HD      ARG  15  -7.483   5.938 -12.601
  119    HE   ARG  15           HE       ARG  15  -8.331   7.746 -14.729
  120   HH11  ARG  15          1HH1      ARG  15  -7.265   4.542 -13.805
  121   HH12  ARG  15          2HH1      ARG  15  -7.855   3.777 -15.249
  122   HH21  ARG  15          1HH2      ARG  15  -9.089   6.772 -16.639
  123   HH22  ARG  15          2HH2      ARG  15  -8.890   5.059 -16.883
  124    H    SER  16           HN       SER  16  -6.727  12.327 -12.258
  125    HA   SER  16           HA       SER  16  -6.616  13.263 -14.913
  126    HB2  SER  16           2HB      SER  16  -6.231  14.873 -12.384
  127    HB3  SER  16           1HB      SER  16  -6.861  15.429 -13.930
  128    HG   SER  16           HG       SER  16  -8.425  13.480 -13.353
  129    H    SER  17           HN       SER  17  -4.255  12.950 -12.351
  130    HA   SER  17           HA       SER  17  -2.212  14.456 -13.692
  131    HB2  SER  17           2HB      SER  17  -1.882  12.535 -11.379
  132    HB3  SER  17           1HB      SER  17  -0.864  13.909 -11.797
  133    HG   SER  17           HG       SER  17  -2.791  15.234 -11.398
  134    H    TRP  18           HN       TRP  18  -3.199  11.135 -13.336
  135    HA   TRP  18           HA       TRP  18  -0.889  10.157 -14.828
  136    HB2  TRP  18           2HB      TRP  18  -3.173   8.685 -13.495
  137    HB3  TRP  18           1HB      TRP  18  -1.820   7.912 -14.312
  138    HD1  TRP  18           1HD      TRP  18   0.277  10.165 -12.936
  139    HE1  TRP  18           1HE      TRP  18   1.032   9.652 -10.531
  140    HE3  TRP  18           3HE      TRP  18  -3.454   6.941 -11.596
  141    HZ2  TRP  18           2HZ      TRP  18   0.156   8.078  -8.357
  142    HZ3  TRP  18           3HZ      TRP  18  -3.414   5.960  -9.345
  143    HH2  TRP  18           2HH      TRP  18  -1.650   6.525  -7.751
  144    H    LYS  19           HN       LYS  19  -2.339  11.772 -16.380
  145    HA   LYS  19           HA       LYS  19  -3.934  10.004 -18.080
  146    HB2  LYS  19           2HB      LYS  19  -5.351  11.724 -17.024
  147    HB3  LYS  19           1HB      LYS  19  -4.274  12.976 -17.626
  148    HG2  LYS  19           2HG      LYS  19  -4.859  12.360 -19.925
  149    HG3  LYS  19           1HG      LYS  19  -5.961  11.128 -19.303
  150    HD2  LYS  19           2HD      LYS  19  -7.301  12.822 -18.222
  151    HD3  LYS  19           1HD      LYS  19  -6.159  14.076 -18.706
  152    HE2  LYS  19           2HE      LYS  19  -6.640  13.580 -21.062
  153    HE3  LYS  19           1HE      LYS  19  -7.815  12.368 -20.557
  154    HZ1  LYS  19           3HZ      LYS  19  -8.773  14.563 -21.152
  155    HZ2  LYS  19           1HZ      LYS  19  -7.985  15.231 -19.810
  156    HZ3  LYS  19           2HZ      LYS  19  -9.175  14.039 -19.587
  157    H    ASN  20           HN       ASN  20  -1.821  10.504 -20.610
  158    HA   ASN  20           HA       ASN  20  -4.075   9.311 -19.177
  159    HB2  ASN  20           2HB      ASN  20  -4.706   8.256 -21.362
  160    HB3  ASN  20           1HB      ASN  20  -4.846  10.008 -21.336
  161   HD21  ASN  20          1HD2      ASN  20  -4.653  10.328 -23.493
  162   HD22  ASN  20          2HD2      ASN  20  -3.198  10.028 -24.383
  163    H    THR  21           HN       THR  21  -1.144   8.939 -18.839
  164    HA   THR  21           HA       THR  21  -0.308   6.422 -19.763
  165    HB   THR  21           HB       THR  21   1.239   6.513 -17.762
  166    HG1  THR  21           1HG      THR  21  -0.564   8.208 -16.901
  167   HG21  THR  21          3HG2      THR  21   1.113   8.950 -19.546
  168   HG22  THR  21          1HG2      THR  21   1.897   7.418 -19.931
  169   HG23  THR  21          2HG2      THR  21   2.521   8.425 -18.624
  170    H    LYS  22           HN       LYS  22  -0.796   4.384 -19.125
  171    HA   LYS  22           HA       LYS  22  -3.007   4.187 -17.248
  172    HB2  LYS  22           2HB      LYS  22  -1.915   2.351 -19.349
  173    HB3  LYS  22           1HB      LYS  22  -3.077   1.791 -18.155
  174    HG2  LYS  22           2HG      LYS  22  -4.636   3.552 -18.877
  175    HG3  LYS  22           1HG      LYS  22  -3.476   4.049 -20.107
  176    HD2  LYS  22           2HD      LYS  22  -4.648   1.279 -19.932
  177    HD3  LYS  22           1HD      LYS  22  -5.326   2.569 -20.926
  178    HE2  LYS  22           2HE      LYS  22  -3.219   2.731 -22.154
  179    HE3  LYS  22           1HE      LYS  22  -2.534   1.449 -21.154
  180    HZ1  LYS  22           3HZ      LYS  22  -4.104  -0.099 -22.023
  181    HZ2  LYS  22           1HZ      LYS  22  -3.371   0.684 -23.339
  182    HZ3  LYS  22           2HZ      LYS  22  -4.942   1.114 -22.862
  183    H    HIS  23           HN       HIS  23   0.031   4.273 -16.513
  184    HA   HIS  23           HA       HIS  23   0.442   1.970 -14.960
  185    HB2  HIS  23           2HB      HIS  23   2.005   3.247 -13.610
  186    HB3  HIS  23           1HB      HIS  23   2.251   3.579 -15.313
  187    HD1  HIS  23           1HD      HIS  23   2.533   5.261 -12.348
  188    HD2  HIS  23           2HD      HIS  23   0.515   6.140 -15.871
  189    HE1  HIS  23           1HE      HIS  23   2.277   7.756 -12.371
  190    HE2  HIS  23           2HE      HIS  23   1.318   8.273 -14.642
  191    H    ALA  24           HN       ALA  24  -1.646   4.688 -14.510
  192    HA   ALA  24           HA       ALA  24  -2.429   4.407 -11.848
  193    HB1  ALA  24           1HB      ALA  24  -4.161   5.019 -14.246
  194    HB2  ALA  24           2HB      ALA  24  -3.222   6.190 -13.324
  195    HB3  ALA  24           3HB      ALA  24  -4.572   5.345 -12.564
  196    H    ASP  25           HN       ASP  25  -3.293   2.523 -14.693
  197    HA   ASP  25           HA       ASP  25  -5.315   0.930 -13.476
  198    HB2  ASP  25           2HB      ASP  25  -5.203   1.184 -15.893
  199    HB3  ASP  25           1HB      ASP  25  -3.599   0.472 -15.924
  200    H    GLN  26           HN       GLN  26  -1.892   0.465 -14.158
  201    HA   GLN  26           HA       GLN  26  -1.548  -2.081 -13.088
  202    HB2  GLN  26           2HB      GLN  26   0.370   0.256 -13.139
  203    HB3  GLN  26           1HB      GLN  26   0.819  -1.410 -12.828
  204    HG2  GLN  26           2HG      GLN  26   0.214  -2.066 -15.042
  205    HG3  GLN  26           1HG      GLN  26  -0.484  -0.480 -15.369
  206   HE21  GLN  26          1HE2      GLN  26   0.822  -0.160 -17.135
  207   HE22  GLN  26          2HE2      GLN  26   2.516   0.197 -16.995
  208    H    TRP  27           HN       TRP  27  -1.357   1.104 -11.535
  209    HA   TRP  27           HA       TRP  27  -0.701   0.362  -8.941
  210    HB2  TRP  27           2HB      TRP  27  -2.257   2.593 -10.157
  211    HB3  TRP  27           1HB      TRP  27  -2.390   2.361  -8.419
  212    HD1  TRP  27           1HD      TRP  27   0.426   2.907 -11.061
  213    HE1  TRP  27           1HE      TRP  27   2.284   4.292  -9.917
  214    HE3  TRP  27           3HE      TRP  27  -1.522   3.166  -6.338
  215    HZ2  TRP  27           2HZ      TRP  27   2.842   5.349  -7.355
  216    HZ3  TRP  27           3HZ      TRP  27  -0.273   4.383  -4.603
  217    HH2  TRP  27           2HH      TRP  27   1.866   5.452  -5.099
  218    H    THR  28           HN       THR  28  -3.921   0.654 -10.398
  219    HA   THR  28           HA       THR  28  -5.375  -0.090  -8.117
  220    HB   THR  28           HB       THR  28  -6.221  -0.453 -10.998
  221    HG1  THR  28           1HG      THR  28  -5.547   1.695 -10.652
  222   HG21  THR  28          3HG2      THR  28  -8.484  -0.105 -10.108
  223   HG22  THR  28          1HG2      THR  28  -7.824  -0.004  -8.477
  224   HG23  THR  28          2HG2      THR  28  -7.715  -1.515  -9.380
  225    H    ASN  29           HN       ASN  29  -4.308  -1.985 -10.928
  226    HA   ASN  29           HA       ASN  29  -5.585  -4.367 -10.202
  227    HB2  ASN  29           2HB      ASN  29  -3.460  -3.588 -12.125
  228    HB3  ASN  29           1HB      ASN  29  -3.660  -5.295 -11.771
  229   HD21  ASN  29          1HD2      ASN  29  -4.176  -3.757 -14.223
  230   HD22  ASN  29          2HD2      ASN  29  -5.831  -4.059 -14.625
  231    H    THR  30           HN       THR  30  -2.252  -3.271  -9.601
  232    HA   THR  30           HA       THR  30  -1.340  -5.713  -8.540
  233    HB   THR  30           HB       THR  30   0.418  -4.263  -7.397
  234    HG1  THR  30           1HG      THR  30  -0.685  -2.207  -9.033
  235   HG21  THR  30          3HG2      THR  30   1.550  -3.767  -9.514
  236   HG22  THR  30          1HG2      THR  30   0.028  -3.990 -10.378
  237   HG23  THR  30          2HG2      THR  30   0.782  -5.353  -9.552
  238    H    ILE  31           HN       ILE  31  -2.599  -2.806  -6.910
  239    HA   ILE  31           HA       ILE  31  -2.335  -3.843  -4.297
  240    HB   ILE  31           HB       ILE  31  -4.205  -1.695  -5.307
  241   HG12  ILE  31          2HG1      ILE  31  -1.504  -1.468  -3.964
  242   HG13  ILE  31          1HG1      ILE  31  -1.784  -1.268  -5.688
  243   HG21  ILE  31          1HG2      ILE  31  -3.340  -2.337  -2.488
  244   HG22  ILE  31          2HG2      ILE  31  -4.952  -2.580  -3.161
  245   HG23  ILE  31          3HG2      ILE  31  -4.313  -0.948  -2.973
  246   HD11  ILE  31          3HD1      ILE  31  -3.196   0.666  -5.241
  247   HD12  ILE  31          1HD1      ILE  31  -1.579   0.874  -4.564
  248   HD13  ILE  31          2HD1      ILE  31  -2.931   0.459  -3.508
  249    H    LYS  32           HN       LYS  32  -5.010  -3.850  -6.611
  250    HA   LYS  32           HA       LYS  32  -6.961  -4.955  -4.914
  251    HB2  LYS  32           2HB      LYS  32  -7.145  -3.902  -7.297
  252    HB3  LYS  32           1HB      LYS  32  -6.867  -5.540  -7.858
  253    HG2  LYS  32           2HG      LYS  32  -9.098  -4.805  -5.976
  254    HG3  LYS  32           1HG      LYS  32  -9.269  -4.814  -7.731
  255    HD2  LYS  32           2HD      LYS  32  -8.658  -7.189  -7.767
  256    HD3  LYS  32           1HD      LYS  32  -8.510  -7.173  -6.008
  257    HE2  LYS  32           2HE      LYS  32 -10.648  -8.088  -6.592
  258    HE3  LYS  32           1HE      LYS  32 -10.894  -6.500  -5.869
  259    HZ1  LYS  32           3HZ      LYS  32 -11.210  -5.559  -8.050
  260    HZ2  LYS  32           1HZ      LYS  32 -12.263  -6.872  -7.853
  261    HZ3  LYS  32           2HZ      LYS  32 -10.864  -7.045  -8.790
  262    H    THR  33           HN       THR  33  -4.370  -6.408  -6.774
  263    HA   THR  33           HA       THR  33  -5.405  -9.082  -6.511
  264    HB   THR  33           HB       THR  33  -2.641  -8.185  -7.367
  265    HG1  THR  33           1HG      THR  33  -4.292  -7.378  -8.746
  266   HG21  THR  33          3HG2      THR  33  -2.519 -10.388  -8.441
  267   HG22  THR  33          1HG2      THR  33  -4.096 -10.803  -7.772
  268   HG23  THR  33          2HG2      THR  33  -2.724 -10.542  -6.695
  269    H    TYR  34           HN       TYR  34  -2.646  -7.310  -5.103
  270    HA   TYR  34           HA       TYR  34  -1.953  -9.555  -3.440
  271    HB2  TYR  34           2HB      TYR  34  -0.843  -6.757  -3.620
  272    HB3  TYR  34           1HB      TYR  34  -0.220  -7.977  -2.514
  273    HD1  TYR  34           2HD      TYR  34   0.380 -10.286  -3.677
  274    HD2  TYR  34           1HD      TYR  34   0.187  -6.541  -5.684
  275    HE1  TYR  34           2HE      TYR  34   1.831 -11.172  -5.448
  276    HE2  TYR  34           1HE      TYR  34   1.643  -7.418  -7.465
  277    HH   TYR  34           HH       TYR  34   2.376 -10.744  -7.773
  278    H    CYS  35           HN       CYS  35  -3.287  -6.308  -2.817
  279    HA   CYS  35           HA       CYS  35  -3.490  -7.000   0.022
  280    HB2  CYS  35           2HB      CYS  35  -3.985  -4.342  -1.333
  281    HB3  CYS  35           1HB      CYS  35  -3.873  -4.627   0.400
  282    HG   CYS  35           HG       CYS  35  -1.130  -5.816  -0.603
  283    H    GLY  36           HN       GLY  36  -5.389  -7.083  -2.712
  284    HA2  GLY  36           2HA      GLY  36  -7.830  -5.984  -1.997
  285    HA3  GLY  36           1HA      GLY  36  -7.632  -7.327  -3.109
  286    HA   PRO  37           HA       PRO  37  -9.648 -10.092  -0.382
  287    HB2  PRO  37           2HB      PRO  37  -7.404 -12.003  -0.295
  288    HB3  PRO  37           1HB      PRO  37  -9.030 -12.205  -0.952
  289    HG2  PRO  37           2HG      PRO  37  -6.894 -11.985  -2.555
  290    HG3  PRO  37           1HG      PRO  37  -8.467 -11.295  -2.997
  291    HD2  PRO  37           2HD      PRO  37  -6.038  -9.926  -1.897
  292    HD3  PRO  37           1HD      PRO  37  -7.146  -9.396  -3.180
  293    H    VAL  38           HN       VAL  38  -6.625  -8.872   0.591
  294    HA   VAL  38           HA       VAL  38  -6.694 -10.151   3.202
  295    HB   VAL  38           HB       VAL  38  -4.716  -8.112   2.174
  296   HG11  VAL  38          1HG1      VAL  38  -4.626 -10.005   4.524
  297   HG12  VAL  38          2HG1      VAL  38  -4.736  -8.246   4.589
  298   HG13  VAL  38          3HG1      VAL  38  -3.276  -9.017   3.970
  299   HG21  VAL  38          3HG2      VAL  38  -4.501 -11.125   2.199
  300   HG22  VAL  38          1HG2      VAL  38  -3.230 -10.000   1.721
  301   HG23  VAL  38          2HG2      VAL  38  -4.707 -10.118   0.765
  302    H    ILE  39           HN       ILE  39  -6.221  -6.742   2.202
  303    HA   ILE  39           HA       ILE  39  -7.735  -5.981   4.621
  304    HB   ILE  39           HB       ILE  39  -6.375  -3.889   4.640
  305   HG12  ILE  39          2HG1      ILE  39  -4.717  -5.351   2.570
  306   HG13  ILE  39          1HG1      ILE  39  -5.712  -3.936   2.256
  307   HG21  ILE  39          1HG2      ILE  39  -4.839  -6.471   4.850
  308   HG22  ILE  39          2HG2      ILE  39  -5.825  -5.737   6.114
  309   HG23  ILE  39          3HG2      ILE  39  -4.355  -4.931   5.561
  310   HD11  ILE  39          3HD1      ILE  39  -3.326  -4.032   4.082
  311   HD12  ILE  39          1HD1      ILE  39  -4.313  -2.613   3.740
  312   HD13  ILE  39          2HD1      ILE  39  -3.359  -3.353   2.455
  313    H    GLY  40           HN       GLY  40  -8.096  -6.130   1.416
  314    HA2  GLY  40           2HA      GLY  40  -8.748  -3.589   0.490
  315    HA3  GLY  40           1HA      GLY  40  -9.447  -5.081  -0.119
  316    HA   PRO  41           HA       PRO  41 -13.299  -3.991   1.687
  317    HB2  PRO  41           2HB      PRO  41 -13.879  -6.526   2.947
  318    HB3  PRO  41           1HB      PRO  41 -14.483  -5.897   1.413
  319    HG2  PRO  41           2HG      PRO  41 -12.770  -8.026   1.629
  320    HG3  PRO  41           1HG      PRO  41 -12.875  -6.982   0.199
  321    HD2  PRO  41           2HD      PRO  41 -10.882  -6.949   2.435
  322    HD3  PRO  41           1HD      PRO  41 -10.626  -6.719   0.690
  323    H    LEU  42           HN       LEU  42 -10.800  -4.514   3.739
  324    HA   LEU  42           HA       LEU  42 -12.305  -4.271   6.217
  325    HB2  LEU  42           2HB      LEU  42  -9.332  -4.243   5.665
  326    HB3  LEU  42           1HB      LEU  42 -10.040  -4.115   7.264
  327    HG   LEU  42           HG       LEU  42 -10.237  -6.494   5.416
  328   HD11  LEU  42          1HD1      LEU  42  -8.791  -6.098   8.033
  329   HD12  LEU  42          2HD1      LEU  42  -8.044  -6.230   6.441
  330   HD13  LEU  42          3HD1      LEU  42  -8.898  -7.608   7.131
  331   HD21  LEU  42          3HD2      LEU  42 -12.284  -6.184   6.729
  332   HD22  LEU  42          1HD2      LEU  42 -11.322  -6.115   8.205
  333   HD23  LEU  42          2HD2      LEU  42 -11.379  -7.602   7.257
  334    H    SER  43           HN       SER  43 -12.110  -2.438   7.600
  335    HA   SER  43           HA       SER  43 -12.330   0.042   6.405
  336    HB2  SER  43           2HB      SER  43 -11.403  -0.151   9.223
  337    HB3  SER  43           1HB      SER  43 -12.739   0.752   8.528
  338    HG   SER  43           HG       SER  43 -12.784  -1.640   9.723
  339    H    VAL  44           HN       VAL  44 -10.932   1.759   6.149
  340    HA   VAL  44           HA       VAL  44  -8.180   1.188   5.790
  341    HB   VAL  44           HB       VAL  44  -9.392   2.948   4.530
  342   HG11  VAL  44          1HG1      VAL  44  -9.254   4.498   7.107
  343   HG12  VAL  44          2HG1      VAL  44 -10.715   3.891   6.325
  344   HG13  VAL  44          3HG1      VAL  44  -9.747   5.144   5.543
  345   HG21  VAL  44          3HG2      VAL  44  -6.965   3.925   6.027
  346   HG22  VAL  44          1HG2      VAL  44  -7.587   4.601   4.521
  347   HG23  VAL  44          2HG2      VAL  44  -6.966   2.951   4.557
  348    H    GLN  45           HN       GLN  45 -10.039   2.218   8.479
  349    HA   GLN  45           HA       GLN  45  -7.800   3.159  10.046
  350    HB2  GLN  45           2HB      GLN  45 -10.158   4.033  10.258
  351    HB3  GLN  45           1HB      GLN  45 -10.602   2.486  10.963
  352    HG2  GLN  45           2HG      GLN  45 -10.276   3.897  12.783
  353    HG3  GLN  45           1HG      GLN  45  -8.794   2.945  12.694
  354   HE21  GLN  45          1HE2      GLN  45 -10.232   6.061  12.236
  355   HE22  GLN  45          2HE2      GLN  45  -8.753   6.960  12.158
  356    H    ASP  46           HN       ASP  46  -9.315   0.190   9.309
  357    HA   ASP  46           HA       ASP  46  -8.585  -1.189  11.735
  358    HB2  ASP  46           2HB      ASP  46 -10.102  -1.811   9.300
  359    HB3  ASP  46           1HB      ASP  46  -9.145  -3.159   9.903
  360    H    VAL  47           HN       VAL  47  -7.202  -0.585   8.629
  361    HA   VAL  47           HA       VAL  47  -5.352  -2.709   8.519
  362    HB   VAL  47           HB       VAL  47  -5.044   0.067   7.353
  363   HG11  VAL  47          1HG1      VAL  47  -3.736  -2.545   6.594
  364   HG12  VAL  47          2HG1      VAL  47  -2.950  -1.185   7.396
  365   HG13  VAL  47          3HG1      VAL  47  -3.547  -1.011   5.744
  366   HG21  VAL  47          3HG2      VAL  47  -6.273  -2.420   6.165
  367   HG22  VAL  47          1HG2      VAL  47  -5.960  -0.920   5.290
  368   HG23  VAL  47          2HG2      VAL  47  -7.124  -0.942   6.615
  369    H    ASP  48           HN       ASP  48  -3.922  -3.127  10.052
  370    HA   ASP  48           HA       ASP  48  -2.458  -0.878  11.262
  371    HB2  ASP  48           2HB      ASP  48  -2.483  -1.910  13.361
  372    HB3  ASP  48           1HB      ASP  48  -4.104  -2.202  12.749
  373    H    THR  49           HN       THR  49  -0.507  -2.097  12.563
  374    HA   THR  49           HA       THR  49   1.350  -2.653  10.542
  375    HB   THR  49           HB       THR  49   1.723  -3.401  13.436
  376    HG1  THR  49           1HG      THR  49   2.180  -1.239  13.834
  377   HG21  THR  49          3HG2      THR  49   3.522  -4.003  11.870
  378   HG22  THR  49          1HG2      THR  49   4.041  -2.752  12.999
  379   HG23  THR  49          2HG2      THR  49   3.618  -2.324  11.340
  380    H    LYS  50           HN       LYS  50  -0.470  -4.799  12.702
  381    HA   LYS  50           HA       LYS  50   1.007  -7.145  12.180
  382    HB2  LYS  50           2HB      LYS  50  -0.699  -6.642  14.061
  383    HB3  LYS  50           1HB      LYS  50  -1.919  -7.121  12.893
  384    HG2  LYS  50           2HG      LYS  50   0.381  -8.914  13.568
  385    HG3  LYS  50           1HG      LYS  50  -1.070  -8.857  14.563
  386    HD2  LYS  50           2HD      LYS  50  -1.384  -9.243  11.627
  387    HD3  LYS  50           1HD      LYS  50  -0.798 -10.597  12.591
  388    HE2  LYS  50           2HE      LYS  50  -3.171 -10.788  12.426
  389    HE3  LYS  50           1HE      LYS  50  -2.779 -10.313  14.077
  390    HZ1  LYS  50           3HZ      LYS  50  -3.369  -8.028  13.513
  391    HZ2  LYS  50           1HZ      LYS  50  -4.667  -9.085  13.236
  392    HZ3  LYS  50           2HZ      LYS  50  -3.756  -8.505  11.936
  393    H    LEU  51           HN       LEU  51  -1.973  -5.844  10.740
  394    HA   LEU  51           HA       LEU  51  -2.393  -7.945   8.921
  395    HB2  LEU  51           2HB      LEU  51  -3.168  -5.036   8.816
  396    HB3  LEU  51           1HB      LEU  51  -3.717  -6.226   7.658
  397    HG   LEU  51           HG       LEU  51  -4.302  -6.241  10.611
  398   HD11  LEU  51          1HD1      LEU  51  -6.080  -5.708   8.241
  399   HD12  LEU  51          2HD1      LEU  51  -5.498  -4.500   9.387
  400   HD13  LEU  51          3HD1      LEU  51  -6.590  -5.775   9.929
  401   HD21  LEU  51          3HD2      LEU  51  -5.808  -8.100  10.081
  402   HD22  LEU  51          1HD2      LEU  51  -4.126  -8.501   9.730
  403   HD23  LEU  51          2HD2      LEU  51  -5.227  -8.086   8.416
  404    H    ILE  52           HN       ILE  52  -0.569  -4.939   8.684
  405    HA   ILE  52           HA       ILE  52   0.085  -5.075   5.965
  406    HB   ILE  52           HB       ILE  52   1.500  -3.770   8.286
  407   HG12  ILE  52          2HG1      ILE  52  -0.172  -2.627   6.036
  408   HG13  ILE  52          1HG1      ILE  52  -0.747  -2.925   7.674
  409   HG21  ILE  52          1HG2      ILE  52   2.106  -3.435   5.351
  410   HG22  ILE  52          2HG2      ILE  52   3.137  -4.238   6.533
  411   HG23  ILE  52          3HG2      ILE  52   2.817  -2.509   6.674
  412   HD11  ILE  52          3HD1      ILE  52   0.828  -1.290   8.535
  413   HD12  ILE  52          1HD1      ILE  52  -0.211  -0.577   7.301
  414   HD13  ILE  52          2HD1      ILE  52   1.452  -1.017   6.908
  415    H    MET  53           HN       MET  53   1.744  -6.405   8.801
  416    HA   MET  53           HA       MET  53   4.042  -7.340   7.474
  417    HB2  MET  53           2HB      MET  53   2.628  -8.414   9.921
  418    HB3  MET  53           1HB      MET  53   4.201  -8.972   9.375
  419    HG2  MET  53           2HG      MET  53   5.117  -6.734   9.699
  420    HG3  MET  53           1HG      MET  53   3.535  -6.156  10.220
  421    HE1  MET  53           3HE      MET  53   4.823  -5.179  12.402
  422    HE2  MET  53           1HE      MET  53   6.339  -5.884  11.843
  423    HE3  MET  53           2HE      MET  53   5.776  -6.189  13.486
  424    H    LYS  54           HN       LYS  54   0.860  -8.799   7.939
  425    HA   LYS  54           HA       LYS  54   1.567 -11.325   6.869
  426    HB2  LYS  54           2HB      LYS  54  -1.085  -9.981   7.336
  427    HB3  LYS  54           1HB      LYS  54  -0.960 -11.585   6.630
  428    HG2  LYS  54           2HG      LYS  54   0.254 -10.885   9.292
  429    HG3  LYS  54           1HG      LYS  54  -1.396 -11.481   9.115
  430    HD2  LYS  54           2HD      LYS  54  -0.066 -13.375   9.623
  431    HD3  LYS  54           1HD      LYS  54  -0.415 -13.470   7.896
  432    HE2  LYS  54           2HE      LYS  54   1.801 -12.484   7.432
  433    HE3  LYS  54           1HE      LYS  54   2.144 -12.491   9.159
  434    HZ1  LYS  54           3HZ      LYS  54   1.997 -14.886   9.169
  435    HZ2  LYS  54           1HZ      LYS  54   3.118 -14.392   7.995
  436    HZ3  LYS  54           2HZ      LYS  54   1.574 -14.911   7.527
  437    H    VAL  55           HN       VAL  55   0.214  -8.388   5.445
  438    HA   VAL  55           HA       VAL  55  -0.344  -9.366   2.888
  439    HB   VAL  55           HB       VAL  55   0.677  -6.619   3.649
  440   HG11  VAL  55          1HG1      VAL  55  -0.723  -7.528   1.132
  441   HG12  VAL  55          2HG1      VAL  55   0.967  -7.037   1.259
  442   HG13  VAL  55          3HG1      VAL  55  -0.317  -5.859   1.540
  443   HG21  VAL  55          3HG2      VAL  55  -1.700  -5.979   3.547
  444   HG22  VAL  55          1HG2      VAL  55  -1.377  -7.170   4.805
  445   HG23  VAL  55          2HG2      VAL  55  -2.126  -7.669   3.288
  446    H    LEU  56           HN       LEU  56   2.677  -8.231   4.304
  447    HA   LEU  56           HA       LEU  56   4.149  -8.422   1.838
  448    HB2  LEU  56           2HB      LEU  56   4.923  -7.870   4.688
  449    HB3  LEU  56           1HB      LEU  56   6.120  -8.026   3.420
  450    HG   LEU  56           HG       LEU  56   3.944  -5.948   3.609
  451   HD11  LEU  56          1HD1      LEU  56   5.826  -4.394   3.773
  452   HD12  LEU  56          2HD1      LEU  56   6.951  -5.753   3.740
  453   HD13  LEU  56          3HD1      LEU  56   5.831  -5.564   5.091
  454   HD21  LEU  56          3HD2      LEU  56   5.996  -6.375   1.438
  455   HD22  LEU  56          1HD2      LEU  56   4.904  -4.998   1.569
  456   HD23  LEU  56          2HD2      LEU  56   4.255  -6.613   1.286
  457    H    ASP  57           HN       ASP  57   3.378 -10.552   4.408
  458    HA   ASP  57           HA       ASP  57   5.572 -12.102   4.824
  459    HB2  ASP  57           2HB      ASP  57   3.259 -12.268   5.878
  460    HB3  ASP  57           1HB      ASP  57   2.843 -13.327   4.554
  461    HA   PRO  58           HA       PRO  58   4.704 -15.166   1.253
  462    HB2  PRO  58           2HB      PRO  58   2.782 -14.701  -0.562
  463    HB3  PRO  58           1HB      PRO  58   2.417 -15.433   1.006
  464    HG2  PRO  58           2HG      PRO  58   2.119 -12.576   0.139
  465    HG3  PRO  58           1HG      PRO  58   0.967 -13.598   1.022
  466    HD2  PRO  58           2HD      PRO  58   2.577 -11.803   2.269
  467    HD3  PRO  58           1HD      PRO  58   2.061 -13.320   3.024
  468    H    ILE  59           HN       ILE  59   4.600 -11.751   0.626
  469    HA   ILE  59           HA       ILE  59   5.144 -11.877  -2.166
  470    HB   ILE  59           HB       ILE  59   5.697  -9.520  -0.368
  471   HG12  ILE  59          2HG1      ILE  59   3.429 -10.326   0.082
  472   HG13  ILE  59          1HG1      ILE  59   3.380  -8.814  -0.809
  473   HG21  ILE  59          1HG2      ILE  59   4.966  -9.735  -3.293
  474   HG22  ILE  59          2HG2      ILE  59   6.545  -9.305  -2.633
  475   HG23  ILE  59          3HG2      ILE  59   5.169  -8.230  -2.395
  476   HD11  ILE  59          3HD1      ILE  59   1.713 -10.336  -1.649
  477   HD12  ILE  59          1HD1      ILE  59   2.947 -11.562  -1.943
  478   HD13  ILE  59          2HD1      ILE  59   2.952 -10.065  -2.876
  479    H    TRP  60           HN       TRP  60   7.155 -11.833   0.688
  480    HA   TRP  60           HA       TRP  60   9.564 -10.976  -0.501
  481    HB2  TRP  60           2HB      TRP  60   9.104 -12.766   1.894
  482    HB3  TRP  60           1HB      TRP  60  10.673 -12.116   1.434
  483    HD1  TRP  60           1HD      TRP  60   7.820 -11.385   3.606
  484    HE1  TRP  60           1HE      TRP  60   7.903  -8.959   4.452
  485    HE3  TRP  60           3HE      TRP  60  11.338  -9.522   0.403
  486    HZ2  TRP  60           2HZ      TRP  60   9.271  -6.571   3.844
  487    HZ3  TRP  60           3HZ      TRP  60  11.978  -7.155   0.598
  488    HH2  TRP  60           2HH      TRP  60  10.964  -5.710   2.285
  489    H    GLU  61           HN       GLU  61   7.963 -14.074  -0.525
  490    HA   GLU  61           HA       GLU  61  10.288 -15.531  -1.345
  491    HB2  GLU  61           2HB      GLU  61   7.361 -16.184  -1.141
  492    HB3  GLU  61           1HB      GLU  61   8.549 -17.319  -1.727
  493    HG2  GLU  61           2HG      GLU  61   8.442 -16.080   1.003
  494    HG3  GLU  61           1HG      GLU  61   8.084 -17.756   0.587
  495    H    GLN  62           HN       GLN  62   7.784 -13.743  -2.873
  496    HA   GLN  62           HA       GLN  62   8.341 -14.968  -5.465
  497    HB2  GLN  62           2HB      GLN  62   6.111 -13.245  -4.437
  498    HB3  GLN  62           1HB      GLN  62   6.372 -13.452  -6.161
  499    HG2  GLN  62           2HG      GLN  62   5.870 -15.667  -4.184
  500    HG3  GLN  62           1HG      GLN  62   4.688 -14.995  -5.307
  501   HE21  GLN  62          1HE2      GLN  62   5.736 -17.722  -5.055
  502   HE22  GLN  62          2HE2      GLN  62   6.411 -18.114  -6.606
  503    H    LYS  63           HN       LYS  63   7.940 -11.671  -4.137
  504    HA   LYS  63           HA       LYS  63  10.016 -10.724  -5.967
  505    HB2  LYS  63           2HB      LYS  63   7.232  -9.538  -5.884
  506    HB3  LYS  63           1HB      LYS  63   8.597  -8.863  -6.758
  507    HG2  LYS  63           2HG      LYS  63   8.668 -10.832  -8.192
  508    HG3  LYS  63           1HG      LYS  63   7.319 -11.536  -7.297
  509    HD2  LYS  63           2HD      LYS  63   5.900  -9.656  -7.967
  510    HD3  LYS  63           1HD      LYS  63   7.246  -8.962  -8.871
  511    HE2  LYS  63           2HE      LYS  63   5.958 -11.637  -9.391
  512    HE3  LYS  63           1HE      LYS  63   5.696 -10.170 -10.332
  513    HZ1  LYS  63           3HZ      LYS  63   8.281 -11.610 -10.035
  514    HZ2  LYS  63           1HZ      LYS  63   8.048 -10.184 -10.924
  515    HZ3  LYS  63           2HZ      LYS  63   7.289 -11.621 -11.409
  516    HA   PRO  64           HA       PRO  64  10.416  -8.903  -1.735
  517    HB2  PRO  64           2HB      PRO  64  13.223  -8.734  -2.652
  518    HB3  PRO  64           1HB      PRO  64  12.571  -9.391  -1.150
  519    HG2  PRO  64           2HG      PRO  64  13.523 -10.987  -3.080
  520    HG3  PRO  64           1HG      PRO  64  12.129 -11.456  -2.090
  521    HD2  PRO  64           2HD      PRO  64  12.206 -10.424  -4.893
  522    HD3  PRO  64           1HD      PRO  64  11.160 -11.669  -4.176
  523    H    GLU  65           HN       GLU  65  11.844  -7.899  -4.793
  524    HA   GLU  65           HA       GLU  65  12.381  -5.219  -4.113
  525    HB2  GLU  65           2HB      GLU  65  12.949  -6.794  -6.231
  526    HB3  GLU  65           1HB      GLU  65  11.617  -5.870  -6.905
  527    HG2  GLU  65           2HG      GLU  65  14.119  -4.699  -5.715
  528    HG3  GLU  65           1HG      GLU  65  13.805  -4.912  -7.434
  529    H    THR  66           HN       THR  66   9.593  -6.814  -5.571
  530    HA   THR  66           HA       THR  66   8.123  -4.420  -6.032
  531    HB   THR  66           HB       THR  66   7.089  -7.258  -5.887
  532    HG1  THR  66           1HG      THR  66   8.622  -5.888  -7.759
  533   HG21  THR  66          3HG2      THR  66   5.319  -6.437  -7.368
  534   HG22  THR  66          1HG2      THR  66   5.998  -4.813  -7.289
  535   HG23  THR  66          2HG2      THR  66   5.322  -5.558  -5.840
  536    H    ALA  67           HN       ALA  67   8.292  -6.764  -3.422
  537    HA   ALA  67           HA       ALA  67   6.111  -5.916  -1.893
  538    HB1  ALA  67           1HB      ALA  67   8.785  -6.940  -0.927
  539    HB2  ALA  67           2HB      ALA  67   7.383  -7.922  -1.353
  540    HB3  ALA  67           3HB      ALA  67   7.311  -6.842   0.038
  541    H    SER  68           HN       SER  68   9.400  -4.676  -2.133
  542    HA   SER  68           HA       SER  68   9.170  -2.715  -0.098
  543    HB2  SER  68           2HB      SER  68  11.022  -2.781  -2.498
  544    HB3  SER  68           1HB      SER  68  11.236  -1.790  -1.054
  545    HG   SER  68           HG       SER  68  11.276  -4.632  -1.206
  546    H    ARG  69           HN       ARG  69   8.533  -2.720  -3.569
  547    HA   ARG  69           HA       ARG  69   8.074   0.056  -3.833
  548    HB2  ARG  69           2HB      ARG  69   6.979  -2.218  -5.494
  549    HB3  ARG  69           1HB      ARG  69   7.066  -0.538  -5.969
  550    HG2  ARG  69           2HG      ARG  69   9.564  -0.711  -5.726
  551    HG3  ARG  69           1HG      ARG  69   9.325  -2.452  -5.575
  552    HD2  ARG  69           2HD      ARG  69   9.818  -2.023  -7.855
  553    HD3  ARG  69           1HD      ARG  69   8.091  -2.368  -7.758
  554    HE   ARG  69           HE       ARG  69   8.855   0.433  -7.653
  555   HH11  ARG  69          1HH1      ARG  69   7.681  -2.239  -9.576
  556   HH12  ARG  69          2HH1      ARG  69   7.134  -1.234 -10.877
  557   HH21  ARG  69          1HH2      ARG  69   8.123   1.771  -9.341
  558   HH22  ARG  69          2HH2      ARG  69   7.401   1.053 -10.759
  559    H    LEU  70           HN       LEU  70   5.925  -2.720  -3.343
  560    HA   LEU  70           HA       LEU  70   3.489  -1.319  -3.386
  561    HB2  LEU  70           2HB      LEU  70   3.739  -3.785  -3.555
  562    HB3  LEU  70           1HB      LEU  70   4.168  -3.834  -1.856
  563    HG   LEU  70           HG       LEU  70   1.924  -2.956  -1.289
  564   HD11  LEU  70          1HD1      LEU  70   1.470  -1.762  -3.376
  565   HD12  LEU  70          2HD1      LEU  70   0.184  -2.907  -2.992
  566   HD13  LEU  70          3HD1      LEU  70   1.373  -3.300  -4.234
  567   HD21  LEU  70          3HD2      LEU  70   0.713  -5.015  -1.781
  568   HD22  LEU  70          1HD2      LEU  70   2.373  -5.361  -1.295
  569   HD23  LEU  70          2HD2      LEU  70   1.917  -5.442  -2.996
  570    H    ARG  71           HN       ARG  71   5.817  -1.931  -0.850
  571    HA   ARG  71           HA       ARG  71   4.405  -1.119   1.399
  572    HB2  ARG  71           2HB      ARG  71   6.682  -2.133   1.375
  573    HB3  ARG  71           1HB      ARG  71   7.323  -0.596   0.811
  574    HG2  ARG  71           2HG      ARG  71   7.725  -0.759   3.151
  575    HG3  ARG  71           1HG      ARG  71   6.470   0.451   2.901
  576    HD2  ARG  71           2HD      ARG  71   5.866  -2.419   3.574
  577    HD3  ARG  71           1HD      ARG  71   6.112  -1.187   4.808
  578    HE   ARG  71           HE       ARG  71   4.196   0.005   3.746
  579   HH11  ARG  71          1HH1      ARG  71   4.562  -3.447   3.368
  580   HH12  ARG  71          2HH1      ARG  71   2.867  -3.743   3.185
  581   HH21  ARG  71          1HH2      ARG  71   1.954  -0.375   3.509
  582   HH22  ARG  71          2HH2      ARG  71   1.378  -1.990   3.256
  583    H    GLY  72           HN       GLY  72   6.339   0.829  -0.861
  584    HA2  GLY  72           2HA      GLY  72   5.842   3.308   0.442
  585    HA3  GLY  72           1HA      GLY  72   6.474   3.099  -1.184
  586    H    ARG  73           HN       ARG  73   4.225   1.583  -2.161
  587    HA   ARG  73           HA       ARG  73   2.588   3.716  -3.005
  588    HB2  ARG  73           2HB      ARG  73   2.106   0.736  -3.192
  589    HB3  ARG  73           1HB      ARG  73   1.141   1.957  -4.012
  590    HG2  ARG  73           2HG      ARG  73   3.249   2.719  -5.147
  591    HG3  ARG  73           1HG      ARG  73   4.039   1.294  -4.468
  592    HD2  ARG  73           2HD      ARG  73   2.389  -0.135  -5.635
  593    HD3  ARG  73           1HD      ARG  73   1.667   1.309  -6.339
  594    HE   ARG  73           HE       ARG  73   4.384   1.358  -6.956
  595   HH11  ARG  73          1HH1      ARG  73   1.594  -0.649  -7.693
  596   HH12  ARG  73          2HH1      ARG  73   2.204  -1.135  -9.246
  597   HH21  ARG  73          1HH2      ARG  73   5.170   0.711  -8.977
  598   HH22  ARG  73          2HH2      ARG  73   4.228  -0.345  -9.983
  599    H    ILE  74           HN       ILE  74   2.025   1.122  -0.645
  600    HA   ILE  74           HA       ILE  74  -0.602   1.958   0.031
  601    HB   ILE  74           HB       ILE  74   1.361   0.358   1.679
  602   HG12  ILE  74          2HG1      ILE  74  -0.902  -0.510  -0.132
  603   HG13  ILE  74          1HG1      ILE  74   0.813  -0.654  -0.496
  604   HG21  ILE  74          1HG2      ILE  74  -0.395   1.323   3.075
  605   HG22  ILE  74          2HG2      ILE  74  -0.607  -0.423   2.921
  606   HG23  ILE  74          3HG2      ILE  74  -1.623   0.676   1.986
  607   HD11  ILE  74          3HD1      ILE  74   1.083  -2.200   1.369
  608   HD12  ILE  74          1HD1      ILE  74  -0.118  -2.778   0.211
  609   HD13  ILE  74          2HD1      ILE  74  -0.636  -2.055   1.734
  610    H    GLU  75           HN       GLU  75   2.587   2.721   1.375
  611    HA   GLU  75           HA       GLU  75   1.834   4.311   3.555
  612    HB2  GLU  75           2HB      GLU  75   4.170   3.647   3.004
  613    HB3  GLU  75           1HB      GLU  75   4.151   4.776   1.660
  614    HG2  GLU  75           2HG      GLU  75   3.677   6.591   3.337
  615    HG3  GLU  75           1HG      GLU  75   4.016   5.401   4.591
  616    H    SER  76           HN       SER  76   2.274   5.168   0.149
  617    HA   SER  76           HA       SER  76   1.731   7.899   0.369
  618    HB2  SER  76           2HB      SER  76   1.229   6.057  -1.960
  619    HB3  SER  76           1HB      SER  76   1.284   7.815  -2.052
  620    HG   SER  76           HG       SER  76   3.405   6.057  -1.332
  621    H    VAL  77           HN       VAL  77  -0.443   5.153  -0.181
  622    HA   VAL  77           HA       VAL  77  -2.781   6.731  -0.519
  623    HB   VAL  77           HB       VAL  77  -2.560   3.846   0.363
  624   HG11  VAL  77          1HG1      VAL  77  -4.905   5.391  -0.745
  625   HG12  VAL  77          2HG1      VAL  77  -4.745   4.757   0.895
  626   HG13  VAL  77          3HG1      VAL  77  -4.871   3.650  -0.473
  627   HG21  VAL  77          3HG2      VAL  77  -2.984   3.308  -1.988
  628   HG22  VAL  77          1HG2      VAL  77  -1.493   4.230  -1.797
  629   HG23  VAL  77          2HG2      VAL  77  -2.954   5.026  -2.387
  630    H    LEU  78           HN       LEU  78  -1.429   4.990   2.277
  631    HA   LEU  78           HA       LEU  78  -3.524   5.631   4.050
  632    HB2  LEU  78           2HB      LEU  78  -0.655   4.887   4.598
  633    HB3  LEU  78           1HB      LEU  78  -1.866   5.080   5.853
  634    HG   LEU  78           HG       LEU  78  -1.887   3.022   3.644
  635   HD11  LEU  78          1HD1      LEU  78  -0.307   2.558   5.446
  636   HD12  LEU  78          2HD1      LEU  78  -1.661   1.426   5.471
  637   HD13  LEU  78          3HD1      LEU  78  -1.599   2.754   6.632
  638   HD21  LEU  78          3HD2      LEU  78  -4.153   3.808   4.140
  639   HD22  LEU  78          1HD2      LEU  78  -3.888   3.487   5.854
  640   HD23  LEU  78          2HD2      LEU  78  -3.905   2.153   4.698
  641    H    ASP  79           HN       ASP  79  -0.495   7.293   3.302
  642    HA   ASP  79           HA       ASP  79  -0.708   9.244   5.348
  643    HB2  ASP  79           2HB      ASP  79   1.400   8.820   4.123
  644    HB3  ASP  79           1HB      ASP  79   0.676   9.489   2.663
  645    H    TRP  80           HN       TRP  80  -1.772   9.147   1.993
  646    HA   TRP  80           HA       TRP  80  -2.905  11.703   1.812
  647    HB2  TRP  80           2HB      TRP  80  -2.545  10.238  -0.122
  648    HB3  TRP  80           1HB      TRP  80  -3.739   9.106   0.494
  649    HD1  TRP  80           1HD      TRP  80  -3.486  12.591  -1.118
  650    HE1  TRP  80           1HE      TRP  80  -5.766  13.161  -2.172
  651    HE3  TRP  80           3HE      TRP  80  -6.186   8.606   0.609
  652    HZ2  TRP  80           2HZ      TRP  80  -8.366  12.050  -2.256
  653    HZ3  TRP  80           3HZ      TRP  80  -8.559   8.434  -0.005
  654    HH2  TRP  80           2HH      TRP  80  -9.625  10.122  -1.408
  655    H    ALA  81           HN       ALA  81  -4.283   8.605   2.834
  656    HA   ALA  81           HA       ALA  81  -6.866   9.531   3.454
  657    HB1  ALA  81           1HB      ALA  81  -6.331   7.162   3.213
  658    HB2  ALA  81           2HB      ALA  81  -7.080   7.487   4.776
  659    HB3  ALA  81           3HB      ALA  81  -5.340   7.233   4.672
  660    H    THR  82           HN       THR  82  -3.862   9.596   5.224
  661    HA   THR  82           HA       THR  82  -4.934  10.230   7.775
  662    HB   THR  82           HB       THR  82  -2.176  10.836   6.676
  663    HG1  THR  82           1HG      THR  82  -2.730   8.582   6.637
  664   HG21  THR  82          3HG2      THR  82  -2.694  12.094   8.711
  665   HG22  THR  82          1HG2      THR  82  -1.485  10.849   9.023
  666   HG23  THR  82          2HG2      THR  82  -3.158  10.595   9.520
  667    H    VAL  83           HN       VAL  83  -3.910  12.155   5.002
  668    HA   VAL  83           HA       VAL  83  -4.242  14.691   6.313
  669    HB   VAL  83           HB       VAL  83  -4.171  14.078   3.345
  670   HG11  VAL  83          1HG1      VAL  83  -3.778  16.666   4.851
  671   HG12  VAL  83          2HG1      VAL  83  -5.139  16.256   3.807
  672   HG13  VAL  83          3HG1      VAL  83  -3.527  16.447   3.118
  673   HG21  VAL  83          3HG2      VAL  83  -1.812  14.739   3.471
  674   HG22  VAL  83          1HG2      VAL  83  -2.146  13.314   4.453
  675   HG23  VAL  83          2HG2      VAL  83  -1.953  14.888   5.223
  676    H    ARG  84           HN       ARG  84  -6.174  12.678   4.153
  677    HA   ARG  84           HA       ARG  84  -8.342  14.503   3.910
  678    HB2  ARG  84           2HB      ARG  84  -8.091  11.545   3.410
  679    HB3  ARG  84           1HB      ARG  84  -9.590  12.422   3.142
  680    HG2  ARG  84           2HG      ARG  84  -6.961  12.991   1.791
  681    HG3  ARG  84           1HG      ARG  84  -8.327  12.129   1.077
  682    HD2  ARG  84           2HD      ARG  84  -8.202  15.014   1.928
  683    HD3  ARG  84           1HD      ARG  84  -8.409  14.379   0.296
  684    HE   ARG  84           HE       ARG  84 -10.560  13.385   1.505
  685   HH11  ARG  84          1HH1      ARG  84  -9.186  16.602   1.537
  686   HH12  ARG  84          2HH1      ARG  84 -10.709  17.389   1.854
  687   HH21  ARG  84          1HH2      ARG  84 -12.564  14.402   1.944
  688   HH22  ARG  84          2HH2      ARG  84 -12.634  16.133   2.086
  689    H    GLY  85           HN       GLY  85  -7.439  12.195   6.315
  690    HA2  GLY  85           2HA      GLY  85  -8.271  12.164   8.498
  691    HA3  GLY  85           1HA      GLY  85  -9.665  13.086   7.960
  692    H    TYR  86           HN       TYR  86  -8.587  10.152   6.367
  693    HA   TYR  86           HA       TYR  86 -11.143   8.918   7.011
  694    HB2  TYR  86           2HB      TYR  86  -8.907   8.040   5.170
  695    HB3  TYR  86           1HB      TYR  86 -10.386   7.121   5.433
  696    HD1  TYR  86           2HD      TYR  86 -12.520   8.972   5.363
  697    HD2  TYR  86           1HD      TYR  86  -8.931   9.034   3.082
  698    HE1  TYR  86           2HE      TYR  86 -13.654  10.295   3.632
  699    HE2  TYR  86           1HE      TYR  86 -10.054  10.368   1.346
  700    HH   TYR  86           HH       TYR  86 -13.126  11.818   1.846
  701    H    ARG  87           HN       ARG  87  -7.803   8.715   7.866
  702    HA   ARG  87           HA       ARG  87  -8.586   6.924  10.020
  703    HB2  ARG  87           2HB      ARG  87  -6.557   5.575   9.832
  704    HB3  ARG  87           1HB      ARG  87  -7.552   5.426   8.394
  705    HG2  ARG  87           2HG      ARG  87  -6.067   6.767   7.122
  706    HG3  ARG  87           1HG      ARG  87  -5.179   7.262   8.567
  707    HD2  ARG  87           2HD      ARG  87  -5.374   4.411   7.608
  708    HD3  ARG  87           1HD      ARG  87  -4.050   5.497   7.188
  709    HE   ARG  87           HE       ARG  87  -3.666   5.655   9.669
  710   HH11  ARG  87          1HH1      ARG  87  -5.167   2.808   8.258
  711   HH12  ARG  87          2HH1      ARG  87  -4.577   1.738   9.492
  712   HH21  ARG  87          1HH2      ARG  87  -2.920   4.240  11.291
  713   HH22  ARG  87          2HH2      ARG  87  -3.335   2.555  11.223
  714    H    GLU  88           HN       GLU  88  -6.577   6.802  11.607
  715    HA   GLU  88           HA       GLU  88  -6.279   9.506  12.456
  716    HB2  GLU  88           2HB      GLU  88  -5.015   6.991  13.550
  717    HB3  GLU  88           1HB      GLU  88  -5.070   8.550  14.362
  718    HG2  GLU  88           2HG      GLU  88  -7.369   6.727  13.718
  719    HG3  GLU  88           1HG      GLU  88  -6.766   7.200  15.306
  720    H    GLY  89           HN       GLY  89  -4.024  10.174  13.343
  721    HA2  GLY  89           2HA      GLY  89  -2.420  10.628  11.019
  722    HA3  GLY  89           1HA      GLY  89  -2.107  11.218  12.637
  723    H    ASP  90           HN       ASP  90  -2.516   7.855  12.251
  724    HA   ASP  90           HA       ASP  90   0.375   7.453  12.501
  725    HB2  ASP  90           2HB      ASP  90  -1.903   5.681  13.376
  726    HB3  ASP  90           1HB      ASP  90  -0.208   5.280  13.520
  727    H    ASN  91           HN       ASN  91   1.354   6.559  10.848
  728    HA   ASN  91           HA       ASN  91  -0.199   4.913   8.956
  729    HB2  ASN  91           2HB      ASN  91   0.679   7.032   7.950
  730    HB3  ASN  91           1HB      ASN  91   2.313   6.485   8.313
  731   HD21  ASN  91          1HD2      ASN  91   1.307   7.087   5.698
  732   HD22  ASN  91          2HD2      ASN  91   1.369   5.638   4.775
  733    HA   PRO  92           HA       PRO  92   2.681   2.031  11.077
  734    HB2  PRO  92           2HB      PRO  92   1.217  -0.190  10.435
  735    HB3  PRO  92           1HB      PRO  92   0.909   0.825  11.846
  736    HG2  PRO  92           2HG      PRO  92  -0.457   0.832   9.182
  737    HG3  PRO  92           1HG      PRO  92  -1.165   0.951  10.805
  738    HD2  PRO  92           2HD      PRO  92  -0.821   3.113   9.255
  739    HD3  PRO  92           1HD      PRO  92  -0.619   3.187  11.018
  740    H    ALA  93           HN       ALA  93   1.851   2.484   7.826
  741    HA   ALA  93           HA       ALA  93   3.252   0.153   6.830
  742    HB1  ALA  93           1HB      ALA  93   2.617   0.915   4.625
  743    HB2  ALA  93           2HB      ALA  93   2.052   2.449   5.289
  744    HB3  ALA  93           3HB      ALA  93   1.220   0.948   5.702
  745    H    ARG  94           HN       ARG  94   4.141   3.263   7.811
  746    HA   ARG  94           HA       ARG  94   6.326   3.518   5.947
  747    HB2  ARG  94           2HB      ARG  94   6.919   5.521   7.182
  748    HB3  ARG  94           1HB      ARG  94   5.213   5.521   6.803
  749    HG2  ARG  94           2HG      ARG  94   5.068   6.220   8.937
  750    HG3  ARG  94           1HG      ARG  94   5.090   4.486   9.257
  751    HD2  ARG  94           2HD      ARG  94   7.459   4.557   9.712
  752    HD3  ARG  94           1HD      ARG  94   7.527   6.259   9.251
  753    HE   ARG  94           HE       ARG  94   5.660   5.809  11.364
  754   HH11  ARG  94          1HH1      ARG  94   9.092   6.162  10.688
  755   HH12  ARG  94          2HH1      ARG  94   9.464   6.756  12.280
  756   HH21  ARG  94          1HH2      ARG  94   6.172   6.551  13.469
  757   HH22  ARG  94          2HH2      ARG  94   7.817   6.961  13.851
  758    H    TRP  95           HN       TRP  95   5.778   2.315   9.160
  759    HA   TRP  95           HA       TRP  95   6.946   0.855  10.447
  760    HB2  TRP  95           2HB      TRP  95   7.736   0.292   7.811
  761    HB3  TRP  95           1HB      TRP  95   9.214   0.298   8.771
  762    HD1  TRP  95           1HD      TRP  95   8.632  -1.112  11.306
  763    HE1  TRP  95           1HE      TRP  95   7.776  -3.533  11.434
  764    HE3  TRP  95           3HE      TRP  95   6.602  -1.476   6.643
  765    HZ2  TRP  95           2HZ      TRP  95   6.386  -5.351   9.769
  766    HZ3  TRP  95           3HZ      TRP  95   5.519  -3.580   5.986
  767    HH2  TRP  95           2HH      TRP  95   5.413  -5.480   7.516
  768    H    ARG  96           HN       ARG  96   8.672   0.749  11.899
  769    HA   ARG  96           HA       ARG  96  10.404   3.059  12.007
  770    HB2  ARG  96           2HB      ARG  96  10.157   0.622  13.771
  771    HB3  ARG  96           1HB      ARG  96  11.277   1.940  14.070
  772    HG2  ARG  96           2HG      ARG  96   9.346   3.487  14.226
  773    HG3  ARG  96           1HG      ARG  96   8.272   2.093  14.061
  774    HD2  ARG  96           2HD      ARG  96   8.607   2.755  16.413
  775    HD3  ARG  96           1HD      ARG  96   9.173   1.116  16.082
  776    HE   ARG  96           HE       ARG  96  11.272   3.010  15.787
  777   HH11  ARG  96          1HH1      ARG  96   9.435   1.262  18.232
  778   HH12  ARG  96          2HH1      ARG  96  10.720   1.346  19.407
  779   HH21  ARG  96          1HH2      ARG  96  12.923   3.081  17.297
  780   HH22  ARG  96          2HH2      ARG  96  12.707   2.374  18.873
  781    H    GLY  97           HN       GLY  97  10.554  -0.309  11.166
  782    HA2  GLY  97           2HA      GLY  97  12.462  -0.444   9.369
  783    HA3  GLY  97           1HA      GLY  97  13.454  -0.182  10.796
  784    H    TYR  98           HN       TYR  98  10.765  -2.280   9.746
  785    HA   TYR  98           HA       TYR  98  12.254  -4.559  10.858
  786    HB2  TYR  98           2HB      TYR  98  10.130  -3.786  12.128
  787    HB3  TYR  98           1HB      TYR  98   9.253  -4.485  10.774
  788    HD1  TYR  98           1HD      TYR  98  11.906  -5.370  13.245
  789    HD2  TYR  98           2HD      TYR  98   8.616  -6.716  10.904
  790    HE1  TYR  98           1HE      TYR  98  12.024  -7.559  14.351
  791    HE2  TYR  98           2HE      TYR  98   8.735  -8.919  11.997
  792    HH   TYR  98           HH       TYR  98  10.251 -10.299  13.218
  793    H    LEU  99           HN       LEU  99  12.023  -6.527   9.674
  794    HA   LEU  99           HA       LEU  99  12.028  -7.800   7.854
  795    HB2  LEU  99           2HB      LEU  99   9.945  -5.899   6.805
  796    HB3  LEU  99           1HB      LEU  99  10.369  -7.456   6.145
  797    HG   LEU  99           HG       LEU  99   9.145  -7.017   8.854
  798   HD11  LEU  99          1HD1      LEU  99   7.155  -8.062   7.881
  799   HD12  LEU  99          2HD1      LEU  99   7.946  -8.087   6.305
  800   HD13  LEU  99          3HD1      LEU  99   7.564  -6.548   7.076
  801   HD21  LEU  99          3HD2      LEU  99   9.799  -9.558   7.363
  802   HD22  LEU  99          1HD2      LEU  99   8.881  -9.464   8.867
  803   HD23  LEU  99          2HD2      LEU  99  10.574  -8.974   8.835
  804    H    GLU 100           HN       GLU 100  12.100  -4.335   7.162
  805    HA   GLU 100           HA       GLU 100  13.746  -4.643   4.827
  806    HB2  GLU 100           2HB      GLU 100  12.297  -2.699   5.033
  807    HB3  GLU 100           1HB      GLU 100  13.079  -2.234   6.535
  808    HG2  GLU 100           2HG      GLU 100  13.877  -0.813   4.802
  809    HG3  GLU 100           1HG      GLU 100  15.186  -1.894   5.269
  810    H    HIS 101           HN       HIS 101  15.919  -4.759   4.738
  811    HA   HIS 101           HA       HIS 101  17.443  -5.008   7.143
  812    HB2  HIS 101           2HB      HIS 101  18.222  -4.927   4.232
  813    HB3  HIS 101           1HB      HIS 101  19.417  -5.032   5.519
  814    HD1  HIS 101           1HD      HIS 101  17.424  -7.089   3.341
  815    HD2  HIS 101           2HD      HIS 101  18.965  -7.449   7.192
  816    HE1  HIS 101           1HE      HIS 101  17.391  -9.555   3.863
  817    HE2  HIS 101           2HE      HIS 101  18.475  -9.758   6.127
  818    H    HIS 102           HN       HIS 102  18.940  -3.619   8.024
  819    HA   HIS 102           HA       HIS 102  18.517  -0.820   7.343
  820    HB2  HIS 102           2HB      HIS 102  18.543  -1.697   9.729
  821    HB3  HIS 102           1HB      HIS 102  20.280  -1.917   9.539
  822    HD1  HIS 102           1HD      HIS 102  17.771   0.546  10.480
  823    HD2  HIS 102           2HD      HIS 102  21.672   0.630   9.028
  824    HE1  HIS 102           1HE      HIS 102  18.625   2.863  10.958
  825    HE2  HIS 102           2HE      HIS 102  20.893   2.955   9.864
  826    H    HIS 103           HN       HIS 103  21.183  -3.159   7.513
  827    HA   HIS 103           HA       HIS 103  22.574  -1.495   5.531
  828    HB2  HIS 103           2HB      HIS 103  23.562  -1.019   7.764
  829    HB3  HIS 103           1HB      HIS 103  23.984  -2.724   7.905
  830    HD1  HIS 103           1HD      HIS 103  24.746   0.293   5.757
  831    HD2  HIS 103           2HD      HIS 103  26.350  -3.422   6.717
  832    HE1  HIS 103           1HE      HIS 103  27.020   0.232   4.675
  833    HE2  HIS 103           2HE      HIS 103  27.837  -2.126   5.043
  834    H    HIS 104           HN       HIS 104  23.388  -4.507   7.273
  835    HA   HIS 104           HA       HIS 104  23.862  -5.699   4.619
  836    HB2  HIS 104           2HB      HIS 104  25.915  -5.228   5.989
  837    HB3  HIS 104           1HB      HIS 104  25.319  -6.370   7.187
  838    HD1  HIS 104           1HD      HIS 104  26.133  -6.392   3.464
  839    HD2  HIS 104           2HD      HIS 104  26.307  -8.865   6.806
  840    HE1  HIS 104           1HE      HIS 104  27.278  -8.499   2.693
  841    HE2  HIS 104           2HE      HIS 104  27.235 -10.034   4.693
  842    H    HIS 105           HN       HIS 105  24.017  -7.394   7.702
  843    HA   HIS 105           HA       HIS 105  21.859  -9.147   6.776
  844    HB2  HIS 105           2HB      HIS 105  24.148  -9.939   7.768
  845    HB3  HIS 105           1HB      HIS 105  23.410  -9.560   9.321
  846    HD1  HIS 105           1HD      HIS 105  23.724 -12.205   6.876
  847    HD2  HIS 105           2HD      HIS 105  20.931 -11.113   9.761
  848    HE1  HIS 105           1HE      HIS 105  22.313 -14.245   7.261
  849    HE2  HIS 105           2HE      HIS 105  20.492 -13.494   8.828
  850    H    HIS 106           HN       HIS 106  22.556  -6.622   8.925
  851    HA   HIS 106           HA       HIS 106  20.013  -6.940  10.353
  852    HB2  HIS 106           2HB      HIS 106  22.194  -4.874  10.780
  853    HB3  HIS 106           1HB      HIS 106  20.787  -5.136  11.803
  854    HD1  HIS 106           1HD      HIS 106  20.792  -7.356  13.259
  855    HD2  HIS 106           2HD      HIS 106  24.361  -6.471  11.314
  856    HE1  HIS 106           1HE      HIS 106  22.539  -8.799  14.351
  857    HE2  HIS 106           2HE      HIS 106  24.713  -8.107  13.284
  Start of MODEL    9
    1    H1   MET   1           H1       MET   1 -15.574   4.245   5.639
    2    H2   MET   1           H2       MET   1 -14.336   3.519   6.545
    3    H3   MET   1           H3       MET   1 -15.464   2.554   5.734
    4    HA   MET   1           HA       MET   1 -14.671   3.329   3.606
    5    HB2  MET   1           2HB      MET   1 -13.912   5.556   4.393
    6    HB3  MET   1           1HB      MET   1 -12.588   4.787   5.255
    7    HG2  MET   1           2HG      MET   1 -11.728   5.662   3.221
    8    HG3  MET   1           1HG      MET   1 -11.755   3.908   3.089
    9    HE1  MET   1           2HE      MET   1 -13.501   7.271   2.006
   10    HE2  MET   1           3HE      MET   1 -14.788   6.383   2.824
   11    HE3  MET   1           1HE      MET   1 -14.875   6.654   1.086
   12    H    THR   2           HN       THR   2 -13.659   1.626   2.713
   13    HA   THR   2           HA       THR   2 -11.927   0.032   4.464
   14    HB   THR   2           HB       THR   2 -12.150  -1.748   2.749
   15    HG1  THR   2           1HG      THR   2 -14.054   0.010   1.541
   16   HG21  THR   2          3HG2      THR   2 -14.496  -2.285   3.209
   17   HG22  THR   2          1HG2      THR   2 -14.775  -0.624   3.732
   18   HG23  THR   2          2HG2      THR   2 -13.690  -1.666   4.650
   19    H    PHE   3           HN       PHE   3 -10.006  -0.996   3.410
   20    HA   PHE   3           HA       PHE   3  -8.262   1.037   2.571
   21    HB2  PHE   3           2HB      PHE   3  -7.530  -1.016   3.737
   22    HB3  PHE   3           1HB      PHE   3  -7.909  -1.954   2.298
   23    HD1  PHE   3           1HD      PHE   3  -5.714   0.718   3.609
   24    HD2  PHE   3           2HD      PHE   3  -6.361  -2.167   0.550
   25    HE1  PHE   3           1HE      PHE   3  -3.438   1.112   2.766
   26    HE2  PHE   3           2HE      PHE   3  -4.085  -1.774  -0.301
   27    HZ   PHE   3           HZ       PHE   3  -2.621  -0.135   0.804
   28    H    SER   4           HN       SER   4  -9.965  -1.475   0.746
   29    HA   SER   4           HA       SER   4  -8.742  -0.983  -1.741
   30    HB2  SER   4           2HB      SER   4 -11.518  -2.049  -1.166
   31    HB3  SER   4           1HB      SER   4 -10.676  -2.170  -2.711
   32    HG   SER   4           HG       SER   4  -8.963  -3.218  -1.313
   33    H    GLU   5           HN       GLU   5 -11.669   0.368  -0.268
   34    HA   GLU   5           HA       GLU   5 -12.487   1.911  -2.477
   35    HB2  GLU   5           2HB      GLU   5 -12.981   2.196   0.486
   36    HB3  GLU   5           1HB      GLU   5 -13.761   3.201  -0.720
   37    HG2  GLU   5           2HG      GLU   5 -14.828   1.288  -1.700
   38    HG3  GLU   5           1HG      GLU   5 -13.954   0.210  -0.613
   39    H    CYS   6           HN       CYS   6 -10.579   2.716   0.392
   40    HA   CYS   6           HA       CYS   6 -10.171   5.439  -0.174
   41    HB2  CYS   6           2HB      CYS   6  -9.738   4.216   2.004
   42    HB3  CYS   6           1HB      CYS   6  -8.247   3.634   1.291
   43    HG   CYS   6           HG       CYS   6  -7.503   6.458   0.763
   44    H    ALA   7           HN       ALA   7  -8.187   2.591  -0.850
   45    HA   ALA   7           HA       ALA   7  -6.069   3.849  -2.165
   46    HB1  ALA   7           1HB      ALA   7  -7.210   1.116  -2.735
   47    HB2  ALA   7           2HB      ALA   7  -6.033   1.496  -1.476
   48    HB3  ALA   7           3HB      ALA   7  -5.603   1.687  -3.177
   49    H    ALA   8           HN       ALA   8  -9.103   2.555  -3.486
   50    HA   ALA   8           HA       ALA   8  -8.602   3.125  -6.183
   51    HB1  ALA   8           1HB      ALA   8 -10.405   1.649  -5.423
   52    HB2  ALA   8           2HB      ALA   8 -11.005   2.901  -6.509
   53    HB3  ALA   8           3HB      ALA   8 -11.267   3.041  -4.770
   54    H    LEU   9           HN       LEU   9 -10.100   5.074  -3.630
   55    HA   LEU   9           HA       LEU   9 -10.796   7.298  -5.195
   56    HB2  LEU   9           2HB      LEU   9 -10.008   7.098  -2.292
   57    HB3  LEU   9           1HB      LEU   9 -10.595   8.574  -3.027
   58    HG   LEU   9           HG       LEU   9 -12.152   5.998  -2.826
   59   HD11  LEU   9          1HD1      LEU   9 -13.504   7.229  -1.188
   60   HD12  LEU   9          2HD1      LEU   9 -12.374   8.579  -1.283
   61   HD13  LEU   9          3HD1      LEU   9 -11.838   7.022  -0.650
   62   HD21  LEU   9          3HD2      LEU   9 -12.745   7.342  -4.791
   63   HD22  LEU   9          1HD2      LEU   9 -13.001   8.742  -3.750
   64   HD23  LEU   9          2HD2      LEU   9 -14.041   7.325  -3.595
   65    H    TYR  10           HN       TYR  10  -7.831   6.558  -3.398
   66    HA   TYR  10           HA       TYR  10  -6.420   8.906  -3.945
   67    HB2  TYR  10           2HB      TYR  10  -5.645   7.263  -2.311
   68    HB3  TYR  10           1HB      TYR  10  -5.379   6.086  -3.589
   69    HD1  TYR  10           1HD      TYR  10  -4.199   9.310  -2.216
   70    HD2  TYR  10           2HD      TYR  10  -3.370   6.074  -4.849
   71    HE1  TYR  10           1HE      TYR  10  -1.904  10.135  -2.503
   72    HE2  TYR  10           2HE      TYR  10  -1.070   6.890  -5.134
   73    HH   TYR  10           HH       TYR  10   0.335   9.173  -3.146
   74    H    ILE  11           HN       ILE  11  -6.511   5.849  -5.711
   75    HA   ILE  11           HA       ILE  11  -4.668   6.513  -7.724
   76    HB   ILE  11           HB       ILE  11  -6.965   4.544  -7.759
   77   HG12  ILE  11          2HG1      ILE  11  -4.000   4.093  -7.357
   78   HG13  ILE  11          1HG1      ILE  11  -5.166   4.214  -6.043
   79   HG21  ILE  11          1HG2      ILE  11  -4.622   4.694  -9.657
   80   HG22  ILE  11          2HG2      ILE  11  -6.269   5.190 -10.040
   81   HG23  ILE  11          3HG2      ILE  11  -5.919   3.500  -9.672
   82   HD11  ILE  11          3HD1      ILE  11  -6.338   2.255  -6.933
   83   HD12  ILE  11          1HD1      ILE  11  -4.662   1.906  -6.514
   84   HD13  ILE  11          2HD1      ILE  11  -5.122   2.122  -8.204
   85    H    LYS  12           HN       LYS  12  -8.235   6.704  -7.724
   86    HA   LYS  12           HA       LYS  12  -8.357   7.634 -10.410
   87    HB2  LYS  12           2HB      LYS  12 -10.411   7.613  -8.202
   88    HB3  LYS  12           1HB      LYS  12 -10.755   8.140  -9.845
   89    HG2  LYS  12           2HG      LYS  12 -10.101   5.932 -10.685
   90    HG3  LYS  12           1HG      LYS  12  -9.792   5.405  -9.032
   91    HD2  LYS  12           2HD      LYS  12 -12.461   6.343 -10.083
   92    HD3  LYS  12           1HD      LYS  12 -11.983   4.656  -9.896
   93    HE2  LYS  12           2HE      LYS  12 -11.554   5.235  -7.448
   94    HE3  LYS  12           1HE      LYS  12 -12.447   6.721  -7.765
   95    HZ1  LYS  12           3HZ      LYS  12 -13.964   5.129  -6.904
   96    HZ2  LYS  12           1HZ      LYS  12 -13.445   3.938  -7.995
   97    HZ3  LYS  12           2HZ      LYS  12 -14.307   5.285  -8.557
   98    H    ALA  13           HN       ALA  13  -8.217   9.269  -7.293
   99    HA   ALA  13           HA       ALA  13  -8.882  11.837  -8.413
  100    HB1  ALA  13           1HB      ALA  13  -9.435  11.306  -6.099
  101    HB2  ALA  13           2HB      ALA  13  -8.389  12.722  -6.201
  102    HB3  ALA  13           3HB      ALA  13  -7.719  11.163  -5.716
  103    H    HIS  14           HN       HIS  14  -6.169  10.023  -8.769
  104    HA   HIS  14           HA       HIS  14  -4.559  12.442  -9.229
  105    HB2  HIS  14           2HB      HIS  14  -3.586   9.918  -7.880
  106    HB3  HIS  14           1HB      HIS  14  -2.524  11.184  -8.478
  107    HD1  HIS  14           1HD      HIS  14  -4.577  10.215  -5.607
  108    HD2  HIS  14           2HD      HIS  14  -2.780  13.685  -7.032
  109    HE1  HIS  14           1HE      HIS  14  -4.557  11.817  -3.662
  110    HE2  HIS  14           2HE      HIS  14  -3.604  13.960  -4.589
  111    H    ARG  15           HN       ARG  15  -6.100  10.160 -10.732
  112    HA   ARG  15           HA       ARG  15  -4.112   8.790 -12.231
  113    HB2  ARG  15           2HB      ARG  15  -5.911   7.959 -13.587
  114    HB3  ARG  15           1HB      ARG  15  -6.429   7.946 -11.909
  115    HG2  ARG  15           2HG      ARG  15  -7.719   9.971 -12.278
  116    HG3  ARG  15           1HG      ARG  15  -7.168  10.028 -13.955
  117    HD2  ARG  15           2HD      ARG  15  -8.232   7.821 -14.327
  118    HD3  ARG  15           1HD      ARG  15  -8.859   7.880 -12.678
  119    HE   ARG  15           HE       ARG  15  -9.525  10.133 -14.391
  120   HH11  ARG  15          1HH1      ARG  15 -10.533   7.038 -13.096
  121   HH12  ARG  15          2HH1      ARG  15 -12.219   7.336 -13.354
  122   HH21  ARG  15          1HH2      ARG  15 -11.754  10.541 -14.687
  123   HH22  ARG  15          2HH2      ARG  15 -12.921   9.333 -14.225
  124    H    SER  16           HN       SER  16  -5.442  11.907 -12.422
  125    HA   SER  16           HA       SER  16  -5.195  12.550 -15.110
  126    HB2  SER  16           2HB      SER  16  -4.406  14.491 -12.971
  127    HB3  SER  16           1HB      SER  16  -5.404  14.745 -14.399
  128    HG   SER  16           HG       SER  16  -7.086  14.349 -13.217
  129    H    SER  17           HN       SER  17  -2.800  12.304 -12.564
  130    HA   SER  17           HA       SER  17  -0.669  13.479 -14.085
  131    HB2  SER  17           2HB      SER  17  -0.743  13.531 -11.600
  132    HB3  SER  17           1HB      SER  17  -0.545  11.780 -11.578
  133    HG   SER  17           HG       SER  17   1.382  12.708 -13.095
  134    H    TRP  18           HN       TRP  18  -2.154  10.429 -13.911
  135    HA   TRP  18           HA       TRP  18   0.152   9.107 -15.160
  136    HB2  TRP  18           2HB      TRP  18  -2.314   7.812 -13.965
  137    HB3  TRP  18           1HB      TRP  18  -0.839   7.001 -14.483
  138    HD1  TRP  18           1HD      TRP  18   1.221   9.039 -13.030
  139    HE1  TRP  18           1HE      TRP  18   1.469   8.933 -10.466
  140    HE3  TRP  18           3HE      TRP  18  -3.174   6.695 -11.900
  141    HZ2  TRP  18           2HZ      TRP  18  -0.005   7.961  -8.265
  142    HZ3  TRP  18           3HZ      TRP  18  -3.676   6.205  -9.548
  143    HH2  TRP  18           2HH      TRP  18  -2.126   6.823  -7.765
  144    H    LYS  19           HN       LYS  19  -1.583  10.966 -16.475
  145    HA   LYS  19           HA       LYS  19  -2.923   9.270 -18.461
  146    HB2  LYS  19           2HB      LYS  19  -4.546  10.609 -17.189
  147    HB3  LYS  19           1HB      LYS  19  -3.614  12.061 -17.500
  148    HG2  LYS  19           2HG      LYS  19  -5.533  12.069 -18.913
  149    HG3  LYS  19           1HG      LYS  19  -4.108  11.799 -19.918
  150    HD2  LYS  19           2HD      LYS  19  -4.608   9.494 -20.161
  151    HD3  LYS  19           1HD      LYS  19  -5.830   9.554 -18.891
  152    HE2  LYS  19           2HE      LYS  19  -6.798   9.472 -21.163
  153    HE3  LYS  19           1HE      LYS  19  -7.266  10.911 -20.263
  154    HZ1  LYS  19           3HZ      LYS  19  -5.629  12.188 -21.482
  155    HZ2  LYS  19           1HZ      LYS  19  -6.682  11.418 -22.564
  156    HZ3  LYS  19           2HZ      LYS  19  -5.123  10.808 -22.321
  157    H    ASN  20           HN       ASN  20  -0.762  10.396 -20.760
  158    HA   ASN  20           HA       ASN  20  -2.950   8.751 -19.759
  159    HB2  ASN  20           2HB      ASN  20  -3.480   9.803 -21.922
  160    HB3  ASN  20           1HB      ASN  20  -2.026   9.100 -22.623
  161   HD21  ASN  20          1HD2      ASN  20  -3.087   7.940 -24.159
  162   HD22  ASN  20          2HD2      ASN  20  -4.086   6.573 -23.803
  163    H    THR  21           HN       THR  21  -1.660   7.437 -18.500
  164    HA   THR  21           HA       THR  21   0.018   5.574 -20.038
  165    HB   THR  21           HB       THR  21   1.486   5.296 -18.082
  166    HG1  THR  21           1HG      THR  21  -0.364   7.085 -16.963
  167   HG21  THR  21          3HG2      THR  21   1.242   8.166 -19.005
  168   HG22  THR  21          1HG2      THR  21   2.185   6.891 -19.778
  169   HG23  THR  21          2HG2      THR  21   2.641   7.477 -18.179
  170    H    LYS  22           HN       LYS  22   0.177   3.429 -19.056
  171    HA   LYS  22           HA       LYS  22  -2.356   2.532 -18.041
  172    HB2  LYS  22           2HB      LYS  22   0.212   1.218 -18.821
  173    HB3  LYS  22           1HB      LYS  22  -0.951   0.315 -17.861
  174    HG2  LYS  22           2HG      LYS  22  -1.815   1.690 -20.369
  175    HG3  LYS  22           1HG      LYS  22  -0.999   0.128 -20.440
  176    HD2  LYS  22           2HD      LYS  22  -3.479   0.687 -18.808
  177    HD3  LYS  22           1HD      LYS  22  -3.486  -0.042 -20.416
  178    HE2  LYS  22           2HE      LYS  22  -2.079  -1.877 -19.569
  179    HE3  LYS  22           1HE      LYS  22  -2.130  -1.158 -17.961
  180    HZ1  LYS  22           3HZ      LYS  22  -3.727  -3.016 -18.373
  181    HZ2  LYS  22           1HZ      LYS  22  -4.568  -1.993 -19.433
  182    HZ3  LYS  22           2HZ      LYS  22  -4.432  -1.597 -17.784
  183    H    HIS  23           HN       HIS  23   0.004   4.095 -16.479
  184    HA   HIS  23           HA       HIS  23   0.719   2.469 -14.308
  185    HB2  HIS  23           2HB      HIS  23   0.542   5.476 -14.536
  186    HB3  HIS  23           1HB      HIS  23   1.174   4.655 -13.115
  187    HD1  HIS  23           1HD      HIS  23   3.225   6.353 -14.137
  188    HD2  HIS  23           2HD      HIS  23   2.524   2.669 -15.948
  189    HE1  HIS  23           1HE      HIS  23   5.319   5.815 -15.418
  190    HE2  HIS  23           2HE      HIS  23   4.943   3.507 -16.365
  191    H    ALA  24           HN       ALA  24  -1.983   4.748 -14.670
  192    HA   ALA  24           HA       ALA  24  -2.991   4.590 -12.063
  193    HB1  ALA  24           1HB      ALA  24  -3.715   6.258 -13.712
  194    HB2  ALA  24           2HB      ALA  24  -5.084   5.411 -12.990
  195    HB3  ALA  24           3HB      ALA  24  -4.548   4.994 -14.618
  196    H    ASP  25           HN       ASP  25  -3.551   2.550 -14.876
  197    HA   ASP  25           HA       ASP  25  -5.578   0.938 -13.681
  198    HB2  ASP  25           2HB      ASP  25  -5.264   1.195 -16.142
  199    HB3  ASP  25           1HB      ASP  25  -3.761   0.291 -16.018
  200    H    GLN  26           HN       GLN  26  -2.098   0.570 -14.205
  201    HA   GLN  26           HA       GLN  26  -1.843  -2.008 -13.139
  202    HB2  GLN  26           2HB      GLN  26   0.172   0.233 -13.315
  203    HB3  GLN  26           1HB      GLN  26   0.561  -1.436 -12.951
  204    HG2  GLN  26           2HG      GLN  26  -0.704  -0.471 -15.498
  205    HG3  GLN  26           1HG      GLN  26   1.001  -0.860 -15.288
  206   HE21  GLN  26          1HE2      GLN  26   0.874  -2.412 -16.919
  207   HE22  GLN  26          2HE2      GLN  26   0.102  -3.946 -16.672
  208    H    TRP  27           HN       TRP  27  -1.645   1.182 -11.594
  209    HA   TRP  27           HA       TRP  27  -0.883   0.428  -9.026
  210    HB2  TRP  27           2HB      TRP  27  -2.513   2.634 -10.172
  211    HB3  TRP  27           1HB      TRP  27  -2.691   2.342  -8.448
  212    HD1  TRP  27           1HD      TRP  27   0.100   3.166 -11.004
  213    HE1  TRP  27           1HE      TRP  27   1.912   4.524  -9.781
  214    HE3  TRP  27           3HE      TRP  27  -1.806   2.957  -6.269
  215    HZ2  TRP  27           2HZ      TRP  27   2.460   5.390  -7.148
  216    HZ3  TRP  27           3HZ      TRP  27  -0.581   4.082  -4.454
  217    HH2  TRP  27           2HH      TRP  27   1.505   5.271  -4.886
  218    H    THR  28           HN       THR  28  -4.137   0.619 -10.406
  219    HA   THR  28           HA       THR  28  -5.550  -0.298  -8.173
  220    HB   THR  28           HB       THR  28  -6.329  -0.657 -11.073
  221    HG1  THR  28           1HG      THR  28  -6.038   1.496 -10.910
  222   HG21  THR  28          3HG2      THR  28  -8.620  -0.515 -10.209
  223   HG22  THR  28          1HG2      THR  28  -7.991  -0.402  -8.565
  224   HG23  THR  28          2HG2      THR  28  -7.751  -1.876  -9.501
  225    H    ASN  29           HN       ASN  29  -4.402  -2.075 -11.049
  226    HA   ASN  29           HA       ASN  29  -5.429  -4.571 -10.433
  227    HB2  ASN  29           2HB      ASN  29  -2.899  -3.833 -11.910
  228    HB3  ASN  29           1HB      ASN  29  -3.628  -5.425 -11.920
  229   HD21  ASN  29          1HD2      ASN  29  -3.106  -3.520 -14.085
  230   HD22  ASN  29          2HD2      ASN  29  -4.637  -3.231 -14.848
  231    H    THR  30           HN       THR  30  -2.289  -3.175  -9.561
  232    HA   THR  30           HA       THR  30  -1.214  -5.517  -8.420
  233    HB   THR  30           HB       THR  30  -0.493  -2.691  -7.647
  234    HG1  THR  30           1HG      THR  30  -0.412  -2.947  -9.940
  235   HG21  THR  30          3HG2      THR  30   1.109  -5.248  -7.682
  236   HG22  THR  30          1HG2      THR  30   0.499  -4.428  -6.245
  237   HG23  THR  30          2HG2      THR  30   1.728  -3.653  -7.247
  238    H    ILE  31           HN       ILE  31  -2.690  -2.658  -6.862
  239    HA   ILE  31           HA       ILE  31  -2.414  -3.640  -4.231
  240    HB   ILE  31           HB       ILE  31  -4.345  -1.573  -5.298
  241   HG12  ILE  31          2HG1      ILE  31  -1.650  -1.225  -3.959
  242   HG13  ILE  31          1HG1      ILE  31  -1.943  -1.066  -5.687
  243   HG21  ILE  31          1HG2      ILE  31  -4.428  -0.768  -2.962
  244   HG22  ILE  31          2HG2      ILE  31  -3.494  -2.181  -2.471
  245   HG23  ILE  31          3HG2      ILE  31  -5.105  -2.384  -3.160
  246   HD11  ILE  31          3HD1      ILE  31  -3.453   0.813  -5.244
  247   HD12  ILE  31          1HD1      ILE  31  -1.821   1.107  -4.645
  248   HD13  ILE  31          2HD1      ILE  31  -3.106   0.664  -3.521
  249    H    LYS  32           HN       LYS  32  -5.038  -3.774  -6.576
  250    HA   LYS  32           HA       LYS  32  -7.055  -4.842  -4.955
  251    HB2  LYS  32           2HB      LYS  32  -7.332  -3.941  -7.269
  252    HB3  LYS  32           1HB      LYS  32  -6.558  -5.386  -7.888
  253    HG2  LYS  32           2HG      LYS  32  -8.372  -6.753  -7.015
  254    HG3  LYS  32           1HG      LYS  32  -9.151  -5.309  -6.364
  255    HD2  LYS  32           2HD      LYS  32  -9.337  -4.389  -8.618
  256    HD3  LYS  32           1HD      LYS  32  -8.556  -5.828  -9.273
  257    HE2  LYS  32           2HE      LYS  32 -10.388  -7.206  -8.445
  258    HE3  LYS  32           1HE      LYS  32 -11.169  -5.775  -7.772
  259    HZ1  LYS  32           3HZ      LYS  32 -12.104  -6.425  -9.918
  260    HZ2  LYS  32           1HZ      LYS  32 -10.591  -6.209 -10.652
  261    HZ3  LYS  32           2HZ      LYS  32 -11.405  -4.880  -9.984
  262    H    THR  33           HN       THR  33  -4.354  -6.342  -6.603
  263    HA   THR  33           HA       THR  33  -5.357  -9.023  -6.242
  264    HB   THR  33           HB       THR  33  -2.659  -8.045  -7.219
  265    HG1  THR  33           1HG      THR  33  -4.090  -7.464  -8.760
  266   HG21  THR  33          3HG2      THR  33  -3.929 -10.789  -7.376
  267   HG22  THR  33          1HG2      THR  33  -2.526 -10.350  -6.402
  268   HG23  THR  33          2HG2      THR  33  -2.425 -10.308  -8.161
  269    H    TYR  34           HN       TYR  34  -2.576  -7.180  -4.945
  270    HA   TYR  34           HA       TYR  34  -1.846  -9.395  -3.253
  271    HB2  TYR  34           2HB      TYR  34  -0.697  -6.623  -3.546
  272    HB3  TYR  34           1HB      TYR  34  -0.040  -7.843  -2.459
  273    HD1  TYR  34           2HD      TYR  34   0.697 -10.071  -3.497
  274    HD2  TYR  34           1HD      TYR  34  -0.035  -6.570  -5.796
  275    HE1  TYR  34           2HE      TYR  34   2.008 -11.019  -5.345
  276    HE2  TYR  34           1HE      TYR  34   1.271  -7.515  -7.653
  277    HH   TYR  34           HH       TYR  34   2.091 -10.745  -7.855
  278    H    CYS  35           HN       CYS  35  -3.106  -6.113  -2.666
  279    HA   CYS  35           HA       CYS  35  -3.120  -6.644   0.196
  280    HB2  CYS  35           2HB      CYS  35  -3.954  -4.136  -1.270
  281    HB3  CYS  35           1HB      CYS  35  -3.617  -4.295   0.452
  282    HG   CYS  35           HG       CYS  35  -0.863  -5.157  -0.288
  283    H    GLY  36           HN       GLY  36  -5.256  -6.768  -2.440
  284    HA2  GLY  36           2HA      GLY  36  -7.682  -5.899  -1.448
  285    HA3  GLY  36           1HA      GLY  36  -7.494  -7.147  -2.662
  286    HA   PRO  37           HA       PRO  37  -9.067 -10.299  -0.157
  287    HB2  PRO  37           2HB      PRO  37  -6.598 -11.883   0.059
  288    HB3  PRO  37           1HB      PRO  37  -8.124 -12.285  -0.731
  289    HG2  PRO  37           2HG      PRO  37  -5.900 -11.714  -2.133
  290    HG3  PRO  37           1HG      PRO  37  -7.517 -11.271  -2.712
  291    HD2  PRO  37           2HD      PRO  37  -5.423  -9.567  -1.434
  292    HD3  PRO  37           1HD      PRO  37  -6.536  -9.183  -2.763
  293    H    VAL  38           HN       VAL  38  -6.164  -8.888   1.100
  294    HA   VAL  38           HA       VAL  38  -6.496 -10.222   3.676
  295    HB   VAL  38           HB       VAL  38  -4.300  -8.323   2.857
  296   HG11  VAL  38          1HG1      VAL  38  -3.085  -9.331   4.736
  297   HG12  VAL  38          2HG1      VAL  38  -4.509 -10.291   5.131
  298   HG13  VAL  38          3HG1      VAL  38  -4.569  -8.533   5.261
  299   HG21  VAL  38          3HG2      VAL  38  -4.256 -10.229   1.376
  300   HG22  VAL  38          1HG2      VAL  38  -4.378 -11.336   2.744
  301   HG23  VAL  38          2HG2      VAL  38  -2.928 -10.355   2.531
  302    H    ILE  39           HN       ILE  39  -5.645  -6.858   2.801
  303    HA   ILE  39           HA       ILE  39  -7.149  -6.012   5.183
  304    HB   ILE  39           HB       ILE  39  -5.779  -3.943   5.103
  305   HG12  ILE  39          2HG1      ILE  39  -4.184  -5.426   2.999
  306   HG13  ILE  39          1HG1      ILE  39  -5.217  -4.035   2.690
  307   HG21  ILE  39          1HG2      ILE  39  -4.213  -6.517   5.295
  308   HG22  ILE  39          2HG2      ILE  39  -5.162  -5.776   6.580
  309   HG23  ILE  39          3HG2      ILE  39  -3.724  -4.964   5.968
  310   HD11  ILE  39          3HD1      ILE  39  -2.912  -3.354   2.792
  311   HD12  ILE  39          1HD1      ILE  39  -2.740  -4.072   4.392
  312   HD13  ILE  39          2HD1      ILE  39  -3.796  -2.680   4.160
  313    H    GLY  40           HN       GLY  40  -7.603  -6.239   2.000
  314    HA2  GLY  40           2HA      GLY  40  -8.326  -3.746   1.042
  315    HA3  GLY  40           1HA      GLY  40  -9.027  -5.261   0.504
  316    HA   PRO  41           HA       PRO  41 -12.866  -4.256   2.398
  317    HB2  PRO  41           2HB      PRO  41 -13.695  -6.439   3.727
  318    HB3  PRO  41           1HB      PRO  41 -13.516  -6.430   1.968
  319    HG2  PRO  41           2HG      PRO  41 -11.642  -7.487   4.053
  320    HG3  PRO  41           1HG      PRO  41 -12.157  -8.241   2.531
  321    HD2  PRO  41           2HD      PRO  41  -9.791  -6.933   2.809
  322    HD3  PRO  41           1HD      PRO  41 -10.682  -7.001   1.276
  323    H    LEU  42           HN       LEU  42 -10.259  -4.423   4.364
  324    HA   LEU  42           HA       LEU  42 -11.692  -4.128   6.876
  325    HB2  LEU  42           2HB      LEU  42  -8.743  -3.960   6.249
  326    HB3  LEU  42           1HB      LEU  42  -9.436  -3.872   7.856
  327    HG   LEU  42           HG       LEU  42  -9.525  -6.260   6.016
  328   HD11  LEU  42          1HD1      LEU  42  -8.084  -7.305   7.677
  329   HD12  LEU  42          2HD1      LEU  42  -8.055  -5.806   8.608
  330   HD13  LEU  42          3HD1      LEU  42  -7.327  -5.860   7.002
  331   HD21  LEU  42          3HD2      LEU  42 -10.597  -5.916   8.812
  332   HD22  LEU  42          1HD2      LEU  42 -10.531  -7.433   7.915
  333   HD23  LEU  42          2HD2      LEU  42 -11.555  -6.115   7.346
  334    H    SER  43           HN       SER  43 -11.537  -2.208   8.162
  335    HA   SER  43           HA       SER  43 -11.914   0.178   6.774
  336    HB2  SER  43           2HB      SER  43 -11.144  -0.231   9.666
  337    HB3  SER  43           1HB      SER  43 -11.995   1.133   8.982
  338    HG   SER  43           HG       SER  43 -13.383  -0.393  10.023
  339    H    VAL  44           HN       VAL  44 -10.557   1.941   6.444
  340    HA   VAL  44           HA       VAL  44  -7.831   1.303   5.990
  341    HB   VAL  44           HB       VAL  44  -9.054   2.894   4.582
  342   HG11  VAL  44          1HG1      VAL  44  -9.472   5.184   5.333
  343   HG12  VAL  44          2HG1      VAL  44  -8.955   4.741   6.961
  344   HG13  VAL  44          3HG1      VAL  44 -10.399   4.007   6.263
  345   HG21  VAL  44          3HG2      VAL  44  -7.309   4.584   4.369
  346   HG22  VAL  44          1HG2      VAL  44  -6.632   2.972   4.601
  347   HG23  VAL  44          2HG2      VAL  44  -6.661   4.117   5.943
  348    H    GLN  45           HN       GLN  45  -9.506   2.812   8.650
  349    HA   GLN  45           HA       GLN  45  -7.088   3.739   9.929
  350    HB2  GLN  45           2HB      GLN  45  -9.319   4.807  10.291
  351    HB3  GLN  45           1HB      GLN  45  -9.830   3.355  11.141
  352    HG2  GLN  45           2HG      GLN  45  -8.140   3.702  12.830
  353    HG3  GLN  45           1HG      GLN  45  -7.515   5.098  11.954
  354   HE21  GLN  45          1HE2      GLN  45  -7.860   6.485  13.651
  355   HE22  GLN  45          2HE2      GLN  45  -9.442   6.990  14.135
  356    H    ASP  46           HN       ASP  46  -8.816   0.805   9.676
  357    HA   ASP  46           HA       ASP  46  -7.815  -0.309  12.161
  358    HB2  ASP  46           2HB      ASP  46  -9.713  -1.221  10.053
  359    HB3  ASP  46           1HB      ASP  46  -8.930  -2.438  11.051
  360    H    VAL  47           HN       VAL  47  -6.399   0.266   9.311
  361    HA   VAL  47           HA       VAL  47  -5.038  -2.218   8.898
  362    HB   VAL  47           HB       VAL  47  -4.258   0.554   7.974
  363   HG11  VAL  47          1HG1      VAL  47  -3.338  -2.154   7.010
  364   HG12  VAL  47          2HG1      VAL  47  -2.380  -1.016   7.956
  365   HG13  VAL  47          3HG1      VAL  47  -2.879  -0.598   6.317
  366   HG21  VAL  47          3HG2      VAL  47  -5.752  -1.615   6.506
  367   HG22  VAL  47          1HG2      VAL  47  -5.275  -0.049   5.852
  368   HG23  VAL  47          2HG2      VAL  47  -6.464  -0.136   7.153
  369    H    ASP  48           HN       ASP  48  -3.877  -2.980  10.548
  370    HA   ASP  48           HA       ASP  48  -2.099  -1.173  12.019
  371    HB2  ASP  48           2HB      ASP  48  -3.132  -3.939  12.619
  372    HB3  ASP  48           1HB      ASP  48  -1.755  -3.267  13.479
  373    H    THR  49           HN       THR  49   0.023  -2.242  12.680
  374    HA   THR  49           HA       THR  49   1.527  -2.750  10.343
  375    HB   THR  49           HB       THR  49   3.045  -3.618  12.532
  376    HG1  THR  49           1HG      THR  49   2.486  -1.464  13.786
  377   HG21  THR  49          3HG2      THR  49   2.822  -0.867  11.299
  378   HG22  THR  49          1HG2      THR  49   3.833  -2.187  10.714
  379   HG23  THR  49          2HG2      THR  49   4.170  -1.444  12.276
  380    H    LYS  50           HN       LYS  50   0.150  -4.804  12.835
  381    HA   LYS  50           HA       LYS  50   1.442  -7.215  12.213
  382    HB2  LYS  50           2HB      LYS  50  -0.165  -6.509  14.188
  383    HB3  LYS  50           1HB      LYS  50  -1.412  -7.156  13.136
  384    HG2  LYS  50           2HG      LYS  50   1.003  -8.715  14.030
  385    HG3  LYS  50           1HG      LYS  50  -0.553  -8.741  14.854
  386    HD2  LYS  50           2HD      LYS  50  -1.617  -9.616  12.848
  387    HD3  LYS  50           1HD      LYS  50  -0.079  -9.547  11.985
  388    HE2  LYS  50           2HE      LYS  50   0.866 -11.124  13.641
  389    HE3  LYS  50           1HE      LYS  50  -0.722 -11.244  14.397
  390    HZ1  LYS  50           3HZ      LYS  50  -0.369 -13.084  12.903
  391    HZ2  LYS  50           1HZ      LYS  50  -0.036 -12.030  11.614
  392    HZ3  LYS  50           2HZ      LYS  50  -1.595 -12.088  12.283
  393    H    LEU  51           HN       LEU  51  -1.515  -5.734  10.977
  394    HA   LEU  51           HA       LEU  51  -2.282  -7.880   9.305
  395    HB2  LEU  51           2HB      LEU  51  -2.966  -4.944   9.215
  396    HB3  LEU  51           1HB      LEU  51  -3.753  -6.171   8.250
  397    HG   LEU  51           HG       LEU  51  -3.803  -5.991  11.255
  398   HD11  LEU  51          1HD1      LEU  51  -6.169  -5.472  10.950
  399   HD12  LEU  51          2HD1      LEU  51  -5.954  -5.512   9.200
  400   HD13  LEU  51          3HD1      LEU  51  -5.145  -4.272  10.158
  401   HD21  LEU  51          3HD2      LEU  51  -5.427  -7.821  11.127
  402   HD22  LEU  51          1HD2      LEU  51  -3.855  -8.307  10.495
  403   HD23  LEU  51          2HD2      LEU  51  -5.171  -7.920   9.386
  404    H    ILE  52           HN       ILE  52  -0.364  -4.969   8.813
  405    HA   ILE  52           HA       ILE  52   0.020  -5.176   6.039
  406    HB   ILE  52           HB       ILE  52   1.786  -3.980   8.179
  407   HG12  ILE  52          2HG1      ILE  52  -0.105  -2.684   6.203
  408   HG13  ILE  52          1HG1      ILE  52  -0.488  -3.004   7.890
  409   HG21  ILE  52          1HG2      ILE  52   2.897  -2.755   6.367
  410   HG22  ILE  52          2HG2      ILE  52   1.976  -3.682   5.182
  411   HG23  ILE  52          3HG2      ILE  52   3.137  -4.495   6.233
  412   HD11  ILE  52          3HD1      ILE  52   1.690  -1.182   6.891
  413   HD12  ILE  52          1HD1      ILE  52   1.297  -1.498   8.581
  414   HD13  ILE  52          2HD1      ILE  52   0.129  -0.683   7.543
  415    H    MET  53           HN       MET  53   1.751  -6.602   8.764
  416    HA   MET  53           HA       MET  53   3.895  -7.735   7.350
  417    HB2  MET  53           2HB      MET  53   2.502  -8.667   9.866
  418    HB3  MET  53           1HB      MET  53   4.003  -9.355   9.263
  419    HG2  MET  53           2HG      MET  53   5.133  -7.244   9.546
  420    HG3  MET  53           1HG      MET  53   3.625  -6.467  10.032
  421    HE1  MET  53           3HE      MET  53   6.311  -6.278  11.721
  422    HE2  MET  53           1HE      MET  53   5.704  -6.532  13.359
  423    HE3  MET  53           2HE      MET  53   4.802  -5.522  12.229
  424    H    LYS  54           HN       LYS  54   0.623  -8.908   7.972
  425    HA   LYS  54           HA       LYS  54   0.928 -11.517   6.989
  426    HB2  LYS  54           2HB      LYS  54  -1.522  -9.744   6.953
  427    HB3  LYS  54           1HB      LYS  54  -1.532 -11.474   6.646
  428    HG2  LYS  54           2HG      LYS  54  -0.622 -11.815   8.942
  429    HG3  LYS  54           1HG      LYS  54  -0.830 -10.085   9.221
  430    HD2  LYS  54           2HD      LYS  54  -2.733 -11.290  10.113
  431    HD3  LYS  54           1HD      LYS  54  -3.239 -10.324   8.724
  432    HE2  LYS  54           2HE      LYS  54  -3.086 -12.327   7.303
  433    HE3  LYS  54           1HE      LYS  54  -2.631 -13.279   8.713
  434    HZ1  LYS  54           3HZ      LYS  54  -4.773 -12.824   9.698
  435    HZ2  LYS  54           1HZ      LYS  54  -4.985 -13.491   8.156
  436    HZ3  LYS  54           2HZ      LYS  54  -5.208 -11.828   8.395
  437    H    VAL  55           HN       VAL  55   0.265  -8.473   5.365
  438    HA   VAL  55           HA       VAL  55  -0.335  -9.620   2.822
  439    HB   VAL  55           HB       VAL  55   0.596  -6.808   3.408
  440   HG11  VAL  55          1HG1      VAL  55  -0.639  -6.243   1.356
  441   HG12  VAL  55          2HG1      VAL  55  -0.970  -7.957   1.102
  442   HG13  VAL  55          3HG1      VAL  55   0.690  -7.363   1.056
  443   HG21  VAL  55          3HG2      VAL  55  -1.327  -7.353   4.788
  444   HG22  VAL  55          1HG2      VAL  55  -2.211  -7.899   3.363
  445   HG23  VAL  55          2HG2      VAL  55  -1.763  -6.201   3.526
  446    H    LEU  56           HN       LEU  56   2.556  -8.186   4.275
  447    HA   LEU  56           HA       LEU  56   4.022  -8.167   1.821
  448    HB2  LEU  56           2HB      LEU  56   4.890  -7.744   4.673
  449    HB3  LEU  56           1HB      LEU  56   5.950  -7.550   3.293
  450    HG   LEU  56           HG       LEU  56   3.473  -5.927   3.873
  451   HD11  LEU  56          1HD1      LEU  56   6.404  -5.232   3.961
  452   HD12  LEU  56          2HD1      LEU  56   5.311  -5.363   5.338
  453   HD13  LEU  56          3HD1      LEU  56   5.080  -4.083   4.146
  454   HD21  LEU  56          3HD2      LEU  56   4.133  -4.578   1.944
  455   HD22  LEU  56          1HD2      LEU  56   3.785  -6.240   1.471
  456   HD23  LEU  56          2HD2      LEU  56   5.457  -5.695   1.611
  457    H    ASP  57           HN       ASP  57   3.823 -10.362   4.548
  458    HA   ASP  57           HA       ASP  57   6.219 -11.689   4.427
  459    HB2  ASP  57           2HB      ASP  57   4.331 -12.037   6.082
  460    HB3  ASP  57           1HB      ASP  57   3.614 -13.120   4.910
  461    HA   PRO  58           HA       PRO  58   4.551 -14.968   1.299
  462    HB2  PRO  58           2HB      PRO  58   2.401 -14.221  -0.232
  463    HB3  PRO  58           1HB      PRO  58   2.284 -15.180   1.245
  464    HG2  PRO  58           2HG      PRO  58   1.797 -12.271   0.827
  465    HG3  PRO  58           1HG      PRO  58   0.932 -13.418   1.864
  466    HD2  PRO  58           2HD      PRO  58   2.744 -11.635   2.812
  467    HD3  PRO  58           1HD      PRO  58   2.464 -13.213   3.573
  468    H    ILE  59           HN       ILE  59   4.583 -11.559   0.631
  469    HA   ILE  59           HA       ILE  59   5.088 -11.861  -2.190
  470    HB   ILE  59           HB       ILE  59   5.469  -9.381  -0.502
  471   HG12  ILE  59          2HG1      ILE  59   3.030 -10.280  -2.056
  472   HG13  ILE  59          1HG1      ILE  59   3.173 -10.279  -0.301
  473   HG21  ILE  59          1HG2      ILE  59   6.556  -9.245  -2.660
  474   HG22  ILE  59          2HG2      ILE  59   5.120  -8.220  -2.658
  475   HG23  ILE  59          3HG2      ILE  59   5.083  -9.787  -3.466
  476   HD11  ILE  59          3HD1      ILE  59   3.370  -7.859  -0.304
  477   HD12  ILE  59          1HD1      ILE  59   1.900  -8.365  -1.135
  478   HD13  ILE  59          2HD1      ILE  59   3.305  -7.842  -2.066
  479    H    TRP  60           HN       TRP  60   6.971 -11.602   0.732
  480    HA   TRP  60           HA       TRP  60   9.441 -10.800  -0.326
  481    HB2  TRP  60           2HB      TRP  60   8.837 -12.593   2.034
  482    HB3  TRP  60           1HB      TRP  60  10.448 -12.012   1.640
  483    HD1  TRP  60           1HD      TRP  60   7.588 -11.191   3.741
  484    HE1  TRP  60           1HE      TRP  60   7.741  -8.779   4.618
  485    HE3  TRP  60           3HE      TRP  60  11.239  -9.424   0.633
  486    HZ2  TRP  60           2HZ      TRP  60   9.207  -6.439   4.069
  487    HZ3  TRP  60           3HZ      TRP  60  11.961  -7.084   0.878
  488    HH2  TRP  60           2HH      TRP  60  10.964  -5.625   2.561
  489    H    GLU  61           HN       GLU  61   7.823 -13.884  -0.389
  490    HA   GLU  61           HA       GLU  61  10.106 -15.464  -0.977
  491    HB2  GLU  61           2HB      GLU  61   7.147 -15.851  -0.969
  492    HB3  GLU  61           1HB      GLU  61   8.164 -17.045  -1.747
  493    HG2  GLU  61           2HG      GLU  61   8.409 -16.146   1.106
  494    HG3  GLU  61           1HG      GLU  61   7.643 -17.638   0.565
  495    H    GLN  62           HN       GLN  62   8.094 -13.431  -2.843
  496    HA   GLN  62           HA       GLN  62   8.967 -14.740  -5.320
  497    HB2  GLN  62           2HB      GLN  62   6.529 -13.138  -4.631
  498    HB3  GLN  62           1HB      GLN  62   7.065 -13.276  -6.298
  499    HG2  GLN  62           2HG      GLN  62   6.448 -15.605  -4.501
  500    HG3  GLN  62           1HG      GLN  62   5.331 -14.918  -5.680
  501   HE21  GLN  62          1HE2      GLN  62   6.546 -17.601  -5.483
  502   HE22  GLN  62          2HE2      GLN  62   7.332 -17.857  -7.011
  503    H    LYS  63           HN       LYS  63   8.297 -11.493  -3.994
  504    HA   LYS  63           HA       LYS  63  10.501 -10.470  -5.631
  505    HB2  LYS  63           2HB      LYS  63   7.841  -9.057  -5.530
  506    HB3  LYS  63           1HB      LYS  63   9.216  -8.692  -6.559
  507    HG2  LYS  63           2HG      LYS  63   8.869 -10.858  -7.711
  508    HG3  LYS  63           1HG      LYS  63   7.415 -11.099  -6.743
  509    HD2  LYS  63           2HD      LYS  63   6.610  -8.876  -7.651
  510    HD3  LYS  63           1HD      LYS  63   7.952  -8.967  -8.794
  511    HE2  LYS  63           2HE      LYS  63   5.653 -10.892  -8.512
  512    HE3  LYS  63           1HE      LYS  63   5.981  -9.814  -9.863
  513    HZ1  LYS  63           3HZ      LYS  63   7.476 -12.241  -9.071
  514    HZ2  LYS  63           1HZ      LYS  63   8.120 -11.097 -10.142
  515    HZ3  LYS  63           2HZ      LYS  63   6.693 -11.925 -10.536
  516    HA   PRO  64           HA       PRO  64  10.751  -8.980  -1.268
  517    HB2  PRO  64           2HB      PRO  64  13.476  -8.552  -1.447
  518    HB3  PRO  64           1HB      PRO  64  12.726 -10.057  -0.906
  519    HG2  PRO  64           2HG      PRO  64  13.819  -9.343  -3.593
  520    HG3  PRO  64           1HG      PRO  64  13.942 -10.870  -2.700
  521    HD2  PRO  64           2HD      PRO  64  12.207 -10.567  -4.727
  522    HD3  PRO  64           1HD      PRO  64  11.798 -11.532  -3.292
  523    H    GLU  65           HN       GLU  65  12.547  -7.603  -4.023
  524    HA   GLU  65           HA       GLU  65  12.746  -5.007  -3.036
  525    HB2  GLU  65           2HB      GLU  65  12.760  -6.173  -5.799
  526    HB3  GLU  65           1HB      GLU  65  12.978  -4.464  -5.514
  527    HG2  GLU  65           2HG      GLU  65  14.727  -6.660  -4.453
  528    HG3  GLU  65           1HG      GLU  65  15.111  -5.586  -5.798
  529    H    THR  66           HN       THR  66  10.287  -6.593  -4.999
  530    HA   THR  66           HA       THR  66   8.826  -4.216  -5.547
  531    HB   THR  66           HB       THR  66   7.721  -7.021  -5.664
  532    HG1  THR  66           1HG      THR  66   8.623  -6.454  -8.023
  533   HG21  THR  66          3HG2      THR  66   6.461  -6.099  -7.580
  534   HG22  THR  66          1HG2      THR  66   7.186  -4.519  -7.277
  535   HG23  THR  66          2HG2      THR  66   6.112  -5.240  -6.079
  536    H    ALA  67           HN       ALA  67   8.649  -6.719  -3.081
  537    HA   ALA  67           HA       ALA  67   6.210  -5.999  -1.902
  538    HB1  ALA  67           1HB      ALA  67   7.015  -7.128   0.090
  539    HB2  ALA  67           2HB      ALA  67   8.669  -7.067  -0.517
  540    HB3  ALA  67           3HB      ALA  67   7.463  -8.053  -1.344
  541    H    SER  68           HN       SER  68   9.497  -4.830  -1.366
  542    HA   SER  68           HA       SER  68   8.853  -3.035   0.730
  543    HB2  SER  68           2HB      SER  68  11.191  -2.944  -1.191
  544    HB3  SER  68           1HB      SER  68  11.098  -2.143   0.377
  545    HG   SER  68           HG       SER  68  11.234  -4.918  -0.183
  546    H    ARG  69           HN       ARG  69   9.031  -2.710  -2.780
  547    HA   ARG  69           HA       ARG  69   8.671   0.110  -2.787
  548    HB2  ARG  69           2HB      ARG  69   8.373  -1.950  -4.972
  549    HB3  ARG  69           1HB      ARG  69   8.336  -0.217  -5.223
  550    HG2  ARG  69           2HG      ARG  69  10.634  -0.160  -4.143
  551    HG3  ARG  69           1HG      ARG  69  10.632  -1.912  -4.343
  552    HD2  ARG  69           2HD      ARG  69  11.759  -0.982  -6.221
  553    HD3  ARG  69           1HD      ARG  69  10.182  -1.544  -6.777
  554    HE   ARG  69           HE       ARG  69  10.002   1.168  -6.028
  555   HH11  ARG  69          1HH1      ARG  69  11.414  -0.851  -8.530
  556   HH12  ARG  69          2HH1      ARG  69  11.347   0.396  -9.746
  557   HH21  ARG  69          1HH2      ARG  69   9.969   2.816  -7.600
  558   HH22  ARG  69          2HH2      ARG  69  10.515   2.485  -9.218
  559    H    LEU  70           HN       LEU  70   6.500  -2.662  -3.219
  560    HA   LEU  70           HA       LEU  70   4.163  -1.180  -3.791
  561    HB2  LEU  70           2HB      LEU  70   4.318  -3.589  -4.174
  562    HB3  LEU  70           1HB      LEU  70   4.485  -3.872  -2.453
  563    HG   LEU  70           HG       LEU  70   2.191  -2.993  -2.111
  564   HD11  LEU  70          1HD1      LEU  70   2.116  -2.930  -5.122
  565   HD12  LEU  70          2HD1      LEU  70   2.036  -1.536  -4.043
  566   HD13  LEU  70          3HD1      LEU  70   0.727  -2.720  -4.056
  567   HD21  LEU  70          3HD2      LEU  70   2.399  -5.257  -4.090
  568   HD22  LEU  70          1HD2      LEU  70   1.031  -4.930  -3.028
  569   HD23  LEU  70          2HD2      LEU  70   2.590  -5.391  -2.343
  570    H    ARG  71           HN       ARG  71   5.742  -2.142  -0.835
  571    HA   ARG  71           HA       ARG  71   3.893  -1.413   1.092
  572    HB2  ARG  71           2HB      ARG  71   6.318  -2.434   1.193
  573    HB3  ARG  71           1HB      ARG  71   6.803  -0.761   1.407
  574    HG2  ARG  71           2HG      ARG  71   4.836  -2.196   3.166
  575    HG3  ARG  71           1HG      ARG  71   6.558  -2.039   3.507
  576    HD2  ARG  71           2HD      ARG  71   6.211   0.467   3.343
  577    HD3  ARG  71           1HD      ARG  71   4.481   0.123   3.365
  578    HE   ARG  71           HE       ARG  71   6.385  -0.297   5.551
  579   HH11  ARG  71          1HH1      ARG  71   3.093  -0.380   4.357
  580   HH12  ARG  71          2HH1      ARG  71   2.391  -0.565   5.929
  581   HH21  ARG  71          1HH2      ARG  71   5.473  -0.536   7.613
  582   HH22  ARG  71          2HH2      ARG  71   3.751  -0.610   7.803
  583    H    GLY  72           HN       GLY  72   6.147   0.575  -0.757
  584    HA2  GLY  72           2HA      GLY  72   5.696   3.025   0.570
  585    HA3  GLY  72           1HA      GLY  72   6.313   2.841  -1.064
  586    H    ARG  73           HN       ARG  73   3.918   1.383  -1.974
  587    HA   ARG  73           HA       ARG  73   2.350   3.617  -2.758
  588    HB2  ARG  73           2HB      ARG  73   1.646   0.679  -2.949
  589    HB3  ARG  73           1HB      ARG  73   0.855   1.988  -3.815
  590    HG2  ARG  73           2HG      ARG  73   3.093   2.464  -4.887
  591    HG3  ARG  73           1HG      ARG  73   3.650   0.941  -4.190
  592    HD2  ARG  73           2HD      ARG  73   1.725  -0.183  -5.356
  593    HD3  ARG  73           1HD      ARG  73   1.414   1.348  -6.171
  594    HE   ARG  73           HE       ARG  73   4.092   0.686  -6.592
  595   HH11  ARG  73          1HH1      ARG  73   0.914  -0.494  -7.445
  596   HH12  ARG  73          2HH1      ARG  73   1.446  -1.260  -8.908
  597   HH21  ARG  73          1HH2      ARG  73   4.804  -0.324  -8.534
  598   HH22  ARG  73          2HH2      ARG  73   3.639  -1.158  -9.533
  599    H    ILE  74           HN       ILE  74   2.068   1.173  -0.263
  600    HA   ILE  74           HA       ILE  74  -0.572   1.739   0.554
  601    HB   ILE  74           HB       ILE  74   1.717   0.690   2.234
  602   HG12  ILE  74          2HG1      ILE  74  -0.386  -0.822   0.664
  603   HG13  ILE  74          1HG1      ILE  74   1.302  -0.648   0.191
  604   HG21  ILE  74          1HG2      ILE  74  -1.267   0.475   2.635
  605   HG22  ILE  74          2HG2      ILE  74  -0.170   1.492   3.568
  606   HG23  ILE  74          3HG2      ILE  74  -0.030  -0.264   3.653
  607   HD11  ILE  74          3HD1      ILE  74   1.992  -1.881   2.168
  608   HD12  ILE  74          1HD1      ILE  74   0.855  -2.818   1.199
  609   HD13  ILE  74          2HD1      ILE  74   0.308  -2.025   2.676
  610    H    GLU  75           HN       GLU  75   2.583   2.955   1.597
  611    HA   GLU  75           HA       GLU  75   1.792   4.761   3.568
  612    HB2  GLU  75           2HB      GLU  75   4.108   4.335   3.263
  613    HB3  GLU  75           1HB      GLU  75   4.054   4.782   1.575
  614    HG2  GLU  75           2HG      GLU  75   5.197   6.450   2.947
  615    HG3  GLU  75           1HG      GLU  75   3.773   7.103   2.144
  616    H    SER  76           HN       SER  76   2.060   5.149   0.091
  617    HA   SER  76           HA       SER  76   1.467   7.862  -0.097
  618    HB2  SER  76           2HB      SER  76   0.783   5.704  -2.087
  619    HB3  SER  76           1HB      SER  76   0.943   7.423  -2.435
  620    HG   SER  76           HG       SER  76   3.007   5.704  -1.488
  621    H    VAL  77           HN       VAL  77  -0.697   5.063  -0.093
  622    HA   VAL  77           HA       VAL  77  -3.083   6.586  -0.438
  623    HB   VAL  77           HB       VAL  77  -2.729   3.786   0.640
  624   HG11  VAL  77          1HG1      VAL  77  -4.874   4.714   1.299
  625   HG12  VAL  77          2HG1      VAL  77  -5.094   3.481   0.055
  626   HG13  VAL  77          3HG1      VAL  77  -5.199   5.189  -0.370
  627   HG21  VAL  77          3HG2      VAL  77  -3.390   4.754  -2.139
  628   HG22  VAL  77          1HG2      VAL  77  -3.332   3.068  -1.625
  629   HG23  VAL  77          2HG2      VAL  77  -1.860   4.041  -1.627
  630    H    LEU  78           HN       LEU  78  -1.512   5.107   2.397
  631    HA   LEU  78           HA       LEU  78  -3.553   5.732   4.231
  632    HB2  LEU  78           2HB      LEU  78  -0.639   5.112   4.602
  633    HB3  LEU  78           1HB      LEU  78  -1.720   5.380   5.955
  634    HG   LEU  78           HG       LEU  78  -1.953   3.182   3.899
  635   HD11  LEU  78          1HD1      LEU  78  -0.131   2.797   5.432
  636   HD12  LEU  78          2HD1      LEU  78  -1.469   1.717   5.824
  637   HD13  LEU  78          3HD1      LEU  78  -1.172   3.148   6.811
  638   HD21  LEU  78          3HD2      LEU  78  -4.146   3.967   4.677
  639   HD22  LEU  78          1HD2      LEU  78  -3.637   3.718   6.346
  640   HD23  LEU  78          2HD2      LEU  78  -3.786   2.340   5.254
  641    H    ASP  79           HN       ASP  79  -0.523   7.439   3.472
  642    HA   ASP  79           HA       ASP  79  -0.794   9.493   5.371
  643    HB2  ASP  79           2HB      ASP  79   1.270   9.014   4.061
  644    HB3  ASP  79           1HB      ASP  79   0.485   9.685   2.636
  645    H    TRP  80           HN       TRP  80  -2.026   9.147   2.103
  646    HA   TRP  80           HA       TRP  80  -3.216  11.700   1.862
  647    HB2  TRP  80           2HB      TRP  80  -2.802  10.237  -0.058
  648    HB3  TRP  80           1HB      TRP  80  -3.934   9.052   0.576
  649    HD1  TRP  80           1HD      TRP  80  -3.936  12.647  -0.853
  650    HE1  TRP  80           1HE      TRP  80  -6.216  13.048  -1.989
  651    HE3  TRP  80           3HE      TRP  80  -6.245   8.269   0.417
  652    HZ2  TRP  80           2HZ      TRP  80  -8.674  11.681  -2.291
  653    HZ3  TRP  80           3HZ      TRP  80  -8.559   7.896  -0.328
  654    HH2  TRP  80           2HH      TRP  80  -9.745   9.565  -1.652
  655    H    ALA  81           HN       ALA  81  -4.334   8.600   3.111
  656    HA   ALA  81           HA       ALA  81  -7.006   9.326   3.617
  657    HB1  ALA  81           1HB      ALA  81  -6.250   7.010   3.561
  658    HB2  ALA  81           2HB      ALA  81  -7.069   7.373   5.079
  659    HB3  ALA  81           3HB      ALA  81  -5.309   7.270   5.028
  660    H    THR  82           HN       THR  82  -4.055   9.680   5.517
  661    HA   THR  82           HA       THR  82  -5.175  10.555   7.926
  662    HB   THR  82           HB       THR  82  -2.583  11.446   6.648
  663    HG1  THR  82           1HG      THR  82  -1.725   9.749   8.030
  664   HG21  THR  82          3HG2      THR  82  -3.415  11.456   9.551
  665   HG22  THR  82          1HG2      THR  82  -3.288  12.881   8.518
  666   HG23  THR  82          2HG2      THR  82  -1.845  11.944   8.912
  667    H    VAL  83           HN       VAL  83  -4.233  12.376   5.022
  668    HA   VAL  83           HA       VAL  83  -4.994  14.926   5.981
  669    HB   VAL  83           HB       VAL  83  -4.887  13.954   3.119
  670   HG11  VAL  83          1HG1      VAL  83  -4.760  16.742   4.261
  671   HG12  VAL  83          2HG1      VAL  83  -6.095  16.056   3.334
  672   HG13  VAL  83          3HG1      VAL  83  -4.527  16.320   2.566
  673   HG21  VAL  83          3HG2      VAL  83  -2.620  14.862   3.080
  674   HG22  VAL  83          1HG2      VAL  83  -2.767  13.570   4.270
  675   HG23  VAL  83          2HG2      VAL  83  -2.740  15.255   4.794
  676    H    ARG  84           HN       ARG  84  -6.700  12.402   4.222
  677    HA   ARG  84           HA       ARG  84  -9.081  13.838   3.711
  678    HB2  ARG  84           2HB      ARG  84  -8.489  10.890   3.912
  679    HB3  ARG  84           1HB      ARG  84 -10.068  11.516   3.463
  680    HG2  ARG  84           2HG      ARG  84  -7.586  12.290   1.977
  681    HG3  ARG  84           1HG      ARG  84  -8.488  10.821   1.596
  682    HD2  ARG  84           2HD      ARG  84  -9.735  13.560   1.683
  683    HD3  ARG  84           1HD      ARG  84  -9.066  12.841   0.219
  684    HE   ARG  84           HE       ARG  84 -10.783  10.946   1.099
  685   HH11  ARG  84          1HH1      ARG  84 -11.142  14.378   0.559
  686   HH12  ARG  84          2HH1      ARG  84 -12.785  14.256   0.015
  687   HH21  ARG  84          1HH2      ARG  84 -12.955  10.768   0.415
  688   HH22  ARG  84          2HH2      ARG  84 -13.834  12.199  -0.040
  689    H    GLY  85           HN       GLY  85  -7.862  12.284   6.542
  690    HA2  GLY  85           2HA      GLY  85  -8.715  12.773   8.697
  691    HA3  GLY  85           1HA      GLY  85 -10.276  13.126   7.971
  692    H    TYR  86           HN       TYR  86  -8.631  10.262   6.973
  693    HA   TYR  86           HA       TYR  86 -10.695   8.642   8.231
  694    HB2  TYR  86           2HB      TYR  86  -8.429   7.810   6.400
  695    HB3  TYR  86           1HB      TYR  86  -9.771   6.792   6.911
  696    HD1  TYR  86           1HD      TYR  86 -12.030   8.724   6.638
  697    HD2  TYR  86           2HD      TYR  86  -8.730   7.927   4.078
  698    HE1  TYR  86           1HE      TYR  86 -13.348   9.492   4.709
  699    HE2  TYR  86           2HE      TYR  86 -10.034   8.704   2.146
  700    HH   TYR  86           HH       TYR  86 -12.989  10.398   2.498
  701    H    ARG  87           HN       ARG  87  -7.435   9.546   8.676
  702    HA   ARG  87           HA       ARG  87  -7.365   8.350  11.273
  703    HB2  ARG  87           2HB      ARG  87  -5.311   7.038  10.952
  704    HB3  ARG  87           1HB      ARG  87  -6.618   6.410   9.956
  705    HG2  ARG  87           2HG      ARG  87  -5.660   7.204   7.983
  706    HG3  ARG  87           1HG      ARG  87  -4.613   8.338   8.840
  707    HD2  ARG  87           2HD      ARG  87  -3.340   6.447   7.992
  708    HD3  ARG  87           1HD      ARG  87  -3.328   6.474   9.752
  709    HE   ARG  87           HE       ARG  87  -5.053   4.671   8.170
  710   HH11  ARG  87          1HH1      ARG  87  -3.033   5.344  10.950
  711   HH12  ARG  87          2HH1      ARG  87  -3.098   3.715  11.546
  712   HH21  ARG  87          1HH2      ARG  87  -5.136   2.518   8.950
  713   HH22  ARG  87          2HH2      ARG  87  -4.286   2.100  10.408
  714    H    GLU  88           HN       GLU  88  -5.097   8.845  12.273
  715    HA   GLU  88           HA       GLU  88  -3.473  10.794  10.977
  716    HB2  GLU  88           2HB      GLU  88  -3.809  12.655  12.488
  717    HB3  GLU  88           1HB      GLU  88  -5.334  12.251  11.716
  718    HG2  GLU  88           2HG      GLU  88  -6.149  11.208  13.698
  719    HG3  GLU  88           1HG      GLU  88  -4.567  11.319  14.470
  720    H    GLY  89           HN       GLY  89  -1.962  11.789  12.874
  721    HA2  GLY  89           2HA      GLY  89  -0.370  11.368  14.458
  722    HA3  GLY  89           1HA      GLY  89  -1.475  10.203  15.151
  723    H    ASP  90           HN       ASP  90   1.230  10.720  13.139
  724    HA   ASP  90           HA       ASP  90   2.784   9.386  12.159
  725    HB2  ASP  90           2HB      ASP  90   2.923   8.692  14.577
  726    HB3  ASP  90           1HB      ASP  90   1.866   7.345  14.192
  727    H    ASN  91           HN       ASN  91   2.847   6.607  11.620
  728    HA   ASN  91           HA       ASN  91   0.312   5.807  10.498
  729    HB2  ASN  91           2HB      ASN  91   1.448   7.471   8.851
  730    HB3  ASN  91           1HB      ASN  91   2.583   6.163   8.541
  731   HD21  ASN  91          1HD2      ASN  91   1.965   5.930   6.397
  732   HD22  ASN  91          2HD2      ASN  91   0.433   5.267   5.958
  733    HA   PRO  92           HA       PRO  92   2.310   1.912  11.375
  734    HB2  PRO  92           2HB      PRO  92   0.637   0.260   9.996
  735    HB3  PRO  92           1HB      PRO  92   0.234   0.968  11.565
  736    HG2  PRO  92           2HG      PRO  92  -0.573   1.850   8.823
  737    HG3  PRO  92           1HG      PRO  92  -1.549   1.751  10.300
  738    HD2  PRO  92           2HD      PRO  92  -0.538   4.084   9.395
  739    HD3  PRO  92           1HD      PRO  92  -0.722   3.745  11.128
  740    H    ALA  93           HN       ALA  93   2.440   3.465   8.482
  741    HA   ALA  93           HA       ALA  93   3.685   1.287   7.002
  742    HB1  ALA  93           1HB      ALA  93   3.366   4.185   6.219
  743    HB2  ALA  93           2HB      ALA  93   2.251   2.884   5.801
  744    HB3  ALA  93           3HB      ALA  93   3.898   2.868   5.173
  745    H    ARG  94           HN       ARG  94   4.602   3.294   9.423
  746    HA   ARG  94           HA       ARG  94   7.330   3.733   8.550
  747    HB2  ARG  94           2HB      ARG  94   5.772   4.324  11.018
  748    HB3  ARG  94           1HB      ARG  94   7.510   4.158  11.182
  749    HG2  ARG  94           2HG      ARG  94   6.985   6.464  10.923
  750    HG3  ARG  94           1HG      ARG  94   7.788   5.913   9.455
  751    HD2  ARG  94           2HD      ARG  94   5.647   5.745   8.322
  752    HD3  ARG  94           1HD      ARG  94   4.808   6.223   9.800
  753    HE   ARG  94           HE       ARG  94   6.394   8.308   9.486
  754   HH11  ARG  94          1HH1      ARG  94   4.514   6.591   7.099
  755   HH12  ARG  94          2HH1      ARG  94   4.291   7.973   6.078
  756   HH21  ARG  94          1HH2      ARG  94   6.148  10.128   8.136
  757   HH22  ARG  94          2HH2      ARG  94   5.213   9.996   6.673
  758    H    TRP  95           HN       TRP  95   9.136   2.663   9.339
  759    HA   TRP  95           HA       TRP  95   8.710   0.372  11.103
  760    HB2  TRP  95           2HB      TRP  95   9.169   0.097   8.324
  761    HB3  TRP  95           1HB      TRP  95  10.664  -0.360   9.140
  762    HD1  TRP  95           1HD      TRP  95   9.995  -2.029  11.464
  763    HE1  TRP  95           1HE      TRP  95   8.579  -4.181  11.365
  764    HE3  TRP  95           3HE      TRP  95   7.507  -1.146   7.100
  765    HZ2  TRP  95           2HZ      TRP  95   6.644  -5.340   9.654
  766    HZ3  TRP  95           3HZ      TRP  95   5.882  -2.807   6.302
  767    HH2  TRP  95           2HH      TRP  95   5.464  -4.871   7.551
  768    H    ARG  96           HN       ARG  96   9.848   0.971  12.786
  769    HA   ARG  96           HA       ARG  96  12.214   2.592  12.579
  770    HB2  ARG  96           2HB      ARG  96  10.544   1.480  14.755
  771    HB3  ARG  96           1HB      ARG  96  12.231   1.779  15.151
  772    HG2  ARG  96           2HG      ARG  96  12.008   4.102  14.562
  773    HG3  ARG  96           1HG      ARG  96  10.353   3.832  13.999
  774    HD2  ARG  96           2HD      ARG  96   9.534   3.537  16.140
  775    HD3  ARG  96           1HD      ARG  96  11.108   3.094  16.794
  776    HE   ARG  96           HE       ARG  96  10.433   5.860  15.997
  777   HH11  ARG  96          1HH1      ARG  96  11.813   3.517  18.203
  778   HH12  ARG  96          2HH1      ARG  96  12.375   4.709  19.340
  779   HH21  ARG  96          1HH2      ARG  96  11.164   7.455  17.505
  780   HH22  ARG  96          2HH2      ARG  96  12.006   6.943  18.937
  781    H    GLY  97           HN       GLY  97  11.532  -0.757  12.644
  782    HA2  GLY  97           2HA      GLY  97  14.414  -1.330  12.952
  783    HA3  GLY  97           1HA      GLY  97  13.158  -2.413  13.543
  784    H    TYR  98           HN       TYR  98  12.717  -4.078  12.276
  785    HA   TYR  98           HA       TYR  98  12.663  -3.696   9.403
  786    HB2  TYR  98           2HB      TYR  98  13.744  -6.040   9.248
  787    HB3  TYR  98           1HB      TYR  98  14.784  -4.650   9.486
  788    HD1  TYR  98           2HD      TYR  98  15.671  -4.209  11.821
  789    HD2  TYR  98           1HD      TYR  98  13.710  -7.838  10.767
  790    HE1  TYR  98           2HE      TYR  98  16.665  -5.308  13.782
  791    HE2  TYR  98           1HE      TYR  98  14.709  -8.949  12.722
  792    HH   TYR  98           HH       TYR  98  16.780  -8.606  14.188
  793    H    LEU  99           HN       LEU  99  12.055  -6.016  12.035
  794    HA   LEU  99           HA       LEU  99   9.342  -6.312  11.010
  795    HB2  LEU  99           2HB      LEU  99  11.252  -8.529  11.712
  796    HB3  LEU  99           1HB      LEU  99   9.522  -8.759  11.672
  797    HG   LEU  99           HG       LEU  99  11.195  -7.905   9.313
  798   HD11  LEU  99          1HD1      LEU  99   9.992 -10.589   9.972
  799   HD12  LEU  99          2HD1      LEU  99  11.710 -10.189   9.971
  800   HD13  LEU  99          3HD1      LEU  99  10.797 -10.166   8.462
  801   HD21  LEU  99          3HD2      LEU  99   8.897  -7.092   9.204
  802   HD22  LEU  99          1HD2      LEU  99   8.299  -8.727   9.488
  803   HD23  LEU  99          2HD2      LEU  99   9.181  -8.356   8.007
  804    H    GLU 100           HN       GLU 100  11.180  -7.882  13.609
  805    HA   GLU 100           HA       GLU 100   9.196  -7.007  15.550
  806    HB2  GLU 100           2HB      GLU 100  10.096  -9.341  15.534
  807    HB3  GLU 100           1HB      GLU 100  11.680  -8.696  15.940
  808    HG2  GLU 100           2HG      GLU 100  10.699  -7.782  18.033
  809    HG3  GLU 100           1HG      GLU 100   9.193  -8.608  17.632
  810    H    HIS 101           HN       HIS 101   9.893  -5.973  17.591
  811    HA   HIS 101           HA       HIS 101  11.915  -3.942  17.084
  812    HB2  HIS 101           2HB      HIS 101  10.065  -4.326  19.453
  813    HB3  HIS 101           1HB      HIS 101  11.159  -2.965  19.235
  814    HD1  HIS 101           1HD      HIS 101   7.780  -4.093  18.486
  815    HD2  HIS 101           2HD      HIS 101  10.445  -1.310  16.924
  816    HE1  HIS 101           1HE      HIS 101   6.389  -2.547  17.073
  817    HE2  HIS 101           2HE      HIS 101   7.992  -0.768  16.291
  818    H    HIS 102           HN       HIS 102  13.550  -5.698  17.031
  819    HA   HIS 102           HA       HIS 102  14.234  -7.023  19.477
  820    HB2  HIS 102           2HB      HIS 102  14.689  -7.990  17.229
  821    HB3  HIS 102           1HB      HIS 102  15.873  -6.718  16.950
  822    HD1  HIS 102           1HD      HIS 102  18.207  -7.232  17.635
  823    HD2  HIS 102           2HD      HIS 102  15.433  -9.715  19.494
  824    HE1  HIS 102           1HE      HIS 102  19.557  -8.933  18.908
  825    HE2  HIS 102           2HE      HIS 102  17.857 -10.540  19.853
  826    H    HIS 103           HN       HIS 103  15.333  -6.222  21.098
  827    HA   HIS 103           HA       HIS 103  17.136  -3.939  20.606
  828    HB2  HIS 103           2HB      HIS 103  16.437  -2.906  22.645
  829    HB3  HIS 103           1HB      HIS 103  14.970  -3.333  21.777
  830    HD1  HIS 103           1HD      HIS 103  13.542  -5.315  22.779
  831    HD2  HIS 103           2HD      HIS 103  16.777  -4.116  25.100
  832    HE1  HIS 103           1HE      HIS 103  13.171  -6.343  25.039
  833    HE2  HIS 103           2HE      HIS 103  15.188  -5.684  26.404
  834    H    HIS 104           HN       HIS 104  19.067  -3.906  21.802
  835    HA   HIS 104           HA       HIS 104  19.634  -5.693  23.914
  836    HB2  HIS 104           2HB      HIS 104  19.609  -7.304  21.963
  837    HB3  HIS 104           1HB      HIS 104  20.998  -6.436  21.317
  838    HD1  HIS 104           1HD      HIS 104  23.166  -7.486  21.908
  839    HD2  HIS 104           2HD      HIS 104  20.231  -8.247  24.760
  840    HE1  HIS 104           1HE      HIS 104  24.264  -8.944  23.643
  841    HE2  HIS 104           2HE      HIS 104  22.419  -9.527  25.265
  842    H    HIS 105           HN       HIS 105  21.245  -4.845  25.057
  843    HA   HIS 105           HA       HIS 105  23.280  -3.246  23.652
  844    HB2  HIS 105           2HB      HIS 105  21.812  -2.623  26.207
  845    HB3  HIS 105           1HB      HIS 105  23.396  -1.936  25.879
  846    HD1  HIS 105           1HD      HIS 105  19.966  -1.104  25.575
  847    HD2  HIS 105           2HD      HIS 105  23.314  -0.589  23.155
  848    HE1  HIS 105           1HE      HIS 105  19.399   0.792  24.020
  849    HE2  HIS 105           2HE      HIS 105  21.400   1.025  22.503
  850    H    HIS 106           HN       HIS 106  25.159  -2.844  25.397
  851    HA   HIS 106           HA       HIS 106  25.673  -5.205  26.995
  852    HB2  HIS 106           2HB      HIS 106  27.717  -5.830  25.927
  853    HB3  HIS 106           1HB      HIS 106  26.494  -5.739  24.668
  854    HD1  HIS 106           1HD      HIS 106  26.600  -3.471  23.170
  855    HD2  HIS 106           2HD      HIS 106  29.954  -4.385  25.450
  856    HE1  HIS 106           1HE      HIS 106  28.481  -2.137  22.172
  857    HE2  HIS 106           2HE      HIS 106  30.538  -2.911  23.407
  Start of MODEL   10
    1    H1   MET   1           H1       MET   1 -16.118   3.977   4.483
    2    H2   MET   1           H2       MET   1 -15.096   3.426   5.717
    3    H3   MET   1           H3       MET   1 -15.899   2.311   4.723
    4    HA   MET   1           HA       MET   1 -14.666   3.104   2.809
    5    HB2  MET   1           2HB      MET   1 -14.241   5.372   3.533
    6    HB3  MET   1           1HB      MET   1 -13.282   4.797   4.890
    7    HG2  MET   1           2HG      MET   1 -11.626   3.889   3.344
    8    HG3  MET   1           1HG      MET   1 -12.577   4.468   1.978
    9    HE1  MET   1           2HE      MET   1 -13.054   7.083   1.534
   10    HE2  MET   1           3HE      MET   1 -12.418   8.364   2.566
   11    HE3  MET   1           1HE      MET   1 -13.633   7.255   3.190
   12    H    THR   2           HN       THR   2 -13.933   1.108   2.549
   13    HA   THR   2           HA       THR   2 -12.079  -0.117   4.399
   14    HB   THR   2           HB       THR   2 -11.963  -1.915   2.655
   15    HG1  THR   2           1HG      THR   2 -14.097  -1.159   1.210
   16   HG21  THR   2          3HG2      THR   2 -14.271  -2.699   2.936
   17   HG22  THR   2          1HG2      THR   2 -14.752  -1.092   3.476
   18   HG23  THR   2          2HG2      THR   2 -13.629  -2.045   4.443
   19    H    PHE   3           HN       PHE   3 -10.031  -1.129   3.245
   20    HA   PHE   3           HA       PHE   3  -8.375   1.024   2.485
   21    HB2  PHE   3           2HB      PHE   3  -7.510  -1.044   3.532
   22    HB3  PHE   3           1HB      PHE   3  -7.896  -1.934   2.063
   23    HD1  PHE   3           1HD      PHE   3  -5.861   0.899   3.333
   24    HD2  PHE   3           2HD      PHE   3  -6.342  -2.078   0.330
   25    HE1  PHE   3           1HE      PHE   3  -3.648   1.467   2.416
   26    HE2  PHE   3           2HE      PHE   3  -4.130  -1.517  -0.589
   27    HZ   PHE   3           HZ       PHE   3  -2.781   0.259   0.453
   28    H    SER   4           HN       SER   4 -10.084  -1.453   0.651
   29    HA   SER   4           HA       SER   4  -9.101  -0.880  -1.898
   30    HB2  SER   4           2HB      SER   4 -11.888  -1.791  -1.137
   31    HB3  SER   4           1HB      SER   4 -11.145  -1.951  -2.727
   32    HG   SER   4           HG       SER   4 -11.047  -3.849  -1.305
   33    H    GLU   5           HN       GLU   5 -11.874   0.507  -0.151
   34    HA   GLU   5           HA       GLU   5 -12.777   2.189  -2.208
   35    HB2  GLU   5           2HB      GLU   5 -13.025   2.409   0.791
   36    HB3  GLU   5           1HB      GLU   5 -13.864   3.454  -0.339
   37    HG2  GLU   5           2HG      GLU   5 -15.006   1.520  -1.291
   38    HG3  GLU   5           1HG      GLU   5 -14.167   0.473  -0.149
   39    H    CYS   6           HN       CYS   6 -10.548   2.760   0.478
   40    HA   CYS   6           HA       CYS   6 -10.117   5.513  -0.008
   41    HB2  CYS   6           2HB      CYS   6  -9.595   4.316   2.114
   42    HB3  CYS   6           1HB      CYS   6  -8.256   3.529   1.312
   43    HG   CYS   6           HG       CYS   6  -7.462   6.429   0.647
   44    H    ALA   7           HN       ALA   7  -8.261   2.631  -0.870
   45    HA   ALA   7           HA       ALA   7  -6.177   3.860  -2.262
   46    HB1  ALA   7           1HB      ALA   7  -7.430   1.191  -2.894
   47    HB2  ALA   7           2HB      ALA   7  -6.211   1.474  -1.650
   48    HB3  ALA   7           3HB      ALA   7  -5.812   1.727  -3.351
   49    H    ALA   8           HN       ALA   8  -9.334   2.753  -3.452
   50    HA   ALA   8           HA       ALA   8  -8.965   3.408  -6.155
   51    HB1  ALA   8           1HB      ALA   8 -10.809   2.008  -5.348
   52    HB2  ALA   8           2HB      ALA   8 -11.392   3.342  -6.339
   53    HB3  ALA   8           3HB      ALA   8 -11.539   3.418  -4.584
   54    H    LEU   9           HN       LEU   9 -10.224   5.311  -3.447
   55    HA   LEU   9           HA       LEU   9 -10.911   7.617  -4.897
   56    HB2  LEU   9           2HB      LEU   9 -10.011   7.325  -2.032
   57    HB3  LEU   9           1HB      LEU   9 -10.655   8.801  -2.709
   58    HG   LEU   9           HG       LEU   9 -12.148   6.195  -2.466
   59   HD11  LEU   9          1HD1      LEU   9 -11.792   7.275  -0.315
   60   HD12  LEU   9          2HD1      LEU   9 -13.485   7.378  -0.804
   61   HD13  LEU   9          3HD1      LEU   9 -12.434   8.787  -0.959
   62   HD21  LEU   9          3HD2      LEU   9 -12.858   7.452  -4.422
   63   HD22  LEU   9          1HD2      LEU   9 -13.059   8.901  -3.435
   64   HD23  LEU   9          2HD2      LEU   9 -14.097   7.500  -3.170
   65    H    TYR  10           HN       TYR  10  -7.883   6.647  -3.359
   66    HA   TYR  10           HA       TYR  10  -6.436   9.005  -3.687
   67    HB2  TYR  10           2HB      TYR  10  -5.645   7.093  -2.364
   68    HB3  TYR  10           1HB      TYR  10  -5.448   6.148  -3.833
   69    HD1  TYR  10           1HD      TYR  10  -4.201   9.140  -2.041
   70    HD2  TYR  10           2HD      TYR  10  -3.452   6.268  -5.083
   71    HE1  TYR  10           1HE      TYR  10  -1.893   9.959  -2.239
   72    HE2  TYR  10           2HE      TYR  10  -1.141   7.083  -5.296
   73    HH   TYR  10           HH       TYR  10   0.158   9.082  -4.825
   74    H    ILE  11           HN       ILE  11  -6.770   6.241  -5.855
   75    HA   ILE  11           HA       ILE  11  -5.078   7.293  -7.892
   76    HB   ILE  11           HB       ILE  11  -7.153   5.095  -7.977
   77   HG12  ILE  11          2HG1      ILE  11  -4.138   4.932  -7.764
   78   HG13  ILE  11          1HG1      ILE  11  -5.233   4.822  -6.391
   79   HG21  ILE  11          1HG2      ILE  11  -6.749   5.916 -10.222
   80   HG22  ILE  11          2HG2      ILE  11  -6.005   4.330 -10.016
   81   HG23  ILE  11          3HG2      ILE  11  -5.008   5.783  -9.983
   82   HD11  ILE  11          3HD1      ILE  11  -6.241   2.822  -7.359
   83   HD12  ILE  11          1HD1      ILE  11  -4.509   2.626  -7.100
   84   HD13  ILE  11          2HD1      ILE  11  -5.130   2.929  -8.723
   85    H    LYS  12           HN       LYS  12  -8.631   7.039  -7.570
   86    HA   LYS  12           HA       LYS  12  -9.123   8.119 -10.162
   87    HB2  LYS  12           2HB      LYS  12 -10.968   7.623  -7.828
   88    HB3  LYS  12           1HB      LYS  12 -11.510   8.169  -9.411
   89    HG2  LYS  12           2HG      LYS  12 -10.636   6.145 -10.435
   90    HG3  LYS  12           1HG      LYS  12 -10.042   5.594  -8.866
   91    HD2  LYS  12           2HD      LYS  12 -12.357   5.561  -8.026
   92    HD3  LYS  12           1HD      LYS  12 -12.927   6.070  -9.617
   93    HE2  LYS  12           2HE      LYS  12 -12.048   4.047 -10.618
   94    HE3  LYS  12           1HE      LYS  12 -11.367   3.547  -9.072
   95    HZ1  LYS  12           3HZ      LYS  12 -13.380   2.369  -9.422
   96    HZ2  LYS  12           1HZ      LYS  12 -14.244   3.787  -9.763
   97    HZ3  LYS  12           2HZ      LYS  12 -13.674   3.500  -8.193
   98    H    ALA  13           HN       ALA  13  -9.044   9.567  -6.934
   99    HA   ALA  13           HA       ALA  13 -10.303  11.995  -7.788
  100    HB1  ALA  13           1HB      ALA  13  -9.706  12.869  -5.606
  101    HB2  ALA  13           2HB      ALA  13  -8.632  11.499  -5.332
  102    HB3  ALA  13           3HB      ALA  13 -10.372  11.243  -5.453
  103    H    HIS  14           HN       HIS  14  -7.226  10.741  -8.304
  104    HA   HIS  14           HA       HIS  14  -6.150  13.450  -8.722
  105    HB2  HIS  14           2HB      HIS  14  -4.727  10.871  -8.081
  106    HB3  HIS  14           1HB      HIS  14  -3.888  12.309  -8.647
  107    HD1  HIS  14           1HD      HIS  14  -5.044  10.664  -5.633
  108    HD2  HIS  14           2HD      HIS  14  -4.211  14.570  -6.793
  109    HE1  HIS  14           1HE      HIS  14  -4.760  11.962  -3.493
  110    HE2  HIS  14           2HE      HIS  14  -4.097  14.287  -4.218
  111    H    ARG  15           HN       ARG  15  -7.503  10.980 -10.387
  112    HA   ARG  15           HA       ARG  15  -5.623  10.234 -12.311
  113    HB2  ARG  15           2HB      ARG  15  -7.451   9.356 -13.605
  114    HB3  ARG  15           1HB      ARG  15  -7.715   9.026 -11.902
  115    HG2  ARG  15           2HG      ARG  15  -9.431  10.586 -11.735
  116    HG3  ARG  15           1HG      ARG  15  -8.977  11.381 -13.242
  117    HD2  ARG  15           2HD      ARG  15 -10.050   8.570 -13.024
  118    HD3  ARG  15           1HD      ARG  15 -11.009   9.984 -13.462
  119    HE   ARG  15           HE       ARG  15  -9.391  10.202 -15.394
  120   HH11  ARG  15          1HH1      ARG  15 -10.145   7.094 -13.948
  121   HH12  ARG  15          2HH1      ARG  15  -9.789   6.204 -15.393
  122   HH21  ARG  15          1HH2      ARG  15  -8.938   9.030 -17.278
  123   HH22  ARG  15          2HH2      ARG  15  -9.095   7.297 -17.283
  124    H    SER  16           HN       SER  16  -7.387  13.176 -12.060
  125    HA   SER  16           HA       SER  16  -7.380  13.989 -14.742
  126    HB2  SER  16           2HB      SER  16  -7.059  15.841 -12.379
  127    HB3  SER  16           1HB      SER  16  -7.899  16.139 -13.896
  128    HG   SER  16           HG       SER  16  -8.903  15.193 -11.635
  129    H    SER  17           HN       SER  17  -5.096  14.808 -12.129
  130    HA   SER  17           HA       SER  17  -3.110  15.807 -13.933
  131    HB2  SER  17           2HB      SER  17  -2.532  14.807 -11.154
  132    HB3  SER  17           1HB      SER  17  -1.842  16.190 -12.000
  133    HG   SER  17           HG       SER  17  -3.379  17.395 -11.252
  134    H    TRP  18           HN       TRP  18  -4.140  12.821 -12.729
  135    HA   TRP  18           HA       TRP  18  -1.667  11.386 -13.235
  136    HB2  TRP  18           2HB      TRP  18  -4.082  11.025 -11.666
  137    HB3  TRP  18           1HB      TRP  18  -3.647   9.575 -12.557
  138    HD1  TRP  18           1HD      TRP  18  -1.059  11.939 -10.936
  139    HE1  TRP  18           1HE      TRP  18   0.156  10.601  -9.094
  140    HE3  TRP  18           3HE      TRP  18  -3.811   7.673 -11.156
  141    HZ2  TRP  18           2HZ      TRP  18  -0.052   8.025  -7.893
  142    HZ3  TRP  18           3HZ      TRP  18  -3.249   5.806  -9.649
  143    HH2  TRP  18           2HH      TRP  18  -1.425   5.989  -8.047
  144    H    LYS  19           HN       LYS  19  -2.855  12.375 -15.642
  145    HA   LYS  19           HA       LYS  19  -4.153  10.509 -17.168
  146    HB2  LYS  19           2HB      LYS  19  -1.655  12.048 -17.960
  147    HB3  LYS  19           1HB      LYS  19  -2.762  11.262 -19.081
  148    HG2  LYS  19           2HG      LYS  19  -3.425  13.570 -17.253
  149    HG3  LYS  19           1HG      LYS  19  -3.189  13.649 -19.000
  150    HD2  LYS  19           2HD      LYS  19  -5.138  12.353 -19.410
  151    HD3  LYS  19           1HD      LYS  19  -5.289  11.927 -17.705
  152    HE2  LYS  19           2HE      LYS  19  -6.932  13.604 -18.280
  153    HE3  LYS  19           1HE      LYS  19  -5.739  14.288 -17.178
  154    HZ1  LYS  19           3HZ      LYS  19  -5.705  14.646 -20.126
  155    HZ2  LYS  19           1HZ      LYS  19  -4.686  15.403 -19.002
  156    HZ3  LYS  19           2HZ      LYS  19  -6.336  15.773 -19.030
  157    H    ASN  20           HN       ASN  20  -2.686   7.894 -16.013
  158    HA   ASN  20           HA       ASN  20  -4.615   7.188 -16.959
  159    HB2  ASN  20           2HB      ASN  20  -5.367   9.585 -17.222
  160    HB3  ASN  20           1HB      ASN  20  -4.574   9.607 -18.793
  161   HD21  ASN  20          1HD2      ASN  20  -6.496   9.981 -19.894
  162   HD22  ASN  20          2HD2      ASN  20  -7.710   8.763 -20.080
  163    H    THR  21           HN       THR  21  -1.690   7.350 -17.950
  164    HA   THR  21           HA       THR  21  -2.022   5.668 -20.285
  165    HB   THR  21           HB       THR  21   0.399   5.124 -19.833
  166    HG1  THR  21           1HG      THR  21   1.046   7.083 -18.190
  167   HG21  THR  21          3HG2      THR  21  -0.230   8.075 -19.968
  168   HG22  THR  21          1HG2      THR  21  -0.214   6.968 -21.342
  169   HG23  THR  21          2HG2      THR  21   1.277   7.311 -20.467
  170    H    LYS  22           HN       LYS  22  -0.402   3.475 -19.519
  171    HA   LYS  22           HA       LYS  22  -2.273   1.986 -17.957
  172    HB2  LYS  22           2HB      LYS  22   0.441   1.266 -19.044
  173    HB3  LYS  22           1HB      LYS  22  -0.551   0.146 -18.123
  174    HG2  LYS  22           2HG      LYS  22  -2.366   0.658 -19.879
  175    HG3  LYS  22           1HG      LYS  22  -1.026   1.277 -20.848
  176    HD2  LYS  22           2HD      LYS  22  -1.452  -1.060 -21.384
  177    HD3  LYS  22           1HD      LYS  22   0.126  -0.880 -20.612
  178    HE2  LYS  22           2HE      LYS  22  -0.897  -1.518 -18.455
  179    HE3  LYS  22           1HE      LYS  22  -2.427  -1.785 -19.285
  180    HZ1  LYS  22           3HZ      LYS  22  -1.453  -3.554 -20.541
  181    HZ2  LYS  22           1HZ      LYS  22  -1.129  -3.827 -18.898
  182    HZ3  LYS  22           2HZ      LYS  22   0.089  -3.228 -19.914
  183    H    HIS  23           HN       HIS  23   0.082   4.122 -16.965
  184    HA   HIS  23           HA       HIS  23   1.188   2.672 -14.799
  185    HB2  HIS  23           2HB      HIS  23   2.372   4.548 -14.271
  186    HB3  HIS  23           1HB      HIS  23   1.942   4.943 -15.927
  187    HD1  HIS  23           1HD      HIS  23   1.547   6.047 -12.438
  188    HD2  HIS  23           2HD      HIS  23  -0.046   6.983 -16.159
  189    HE1  HIS  23           1HE      HIS  23   0.404   8.267 -12.142
  190    HE2  HIS  23           2HE      HIS  23  -0.269   8.945 -14.472
  191    H    ALA  24           HN       ALA  24  -1.768   4.481 -15.156
  192    HA   ALA  24           HA       ALA  24  -2.447   4.588 -12.380
  193    HB1  ALA  24           1HB      ALA  24  -3.518   6.051 -14.012
  194    HB2  ALA  24           2HB      ALA  24  -4.719   5.060 -13.184
  195    HB3  ALA  24           3HB      ALA  24  -4.222   4.655 -14.826
  196    H    ASP  25           HN       ASP  25  -3.044   2.314 -15.013
  197    HA   ASP  25           HA       ASP  25  -4.649   0.461 -13.643
  198    HB2  ASP  25           2HB      ASP  25  -4.304   0.382 -16.075
  199    HB3  ASP  25           1HB      ASP  25  -2.617  -0.041 -15.834
  200    H    GLN  26           HN       GLN  26  -1.145   0.694 -14.016
  201    HA   GLN  26           HA       GLN  26  -0.440  -1.651 -12.706
  202    HB2  GLN  26           2HB      GLN  26   1.038   0.965 -12.975
  203    HB3  GLN  26           1HB      GLN  26   1.756  -0.498 -12.329
  204    HG2  GLN  26           2HG      GLN  26   0.571  -0.270 -15.080
  205    HG3  GLN  26           1HG      GLN  26   2.283  -0.075 -14.710
  206   HE21  GLN  26          1HE2      GLN  26   2.867  -1.792 -16.000
  207   HE22  GLN  26          2HE2      GLN  26   2.565  -3.441 -15.552
  208    H    TRP  27           HN       TRP  27  -1.316   1.478 -11.378
  209    HA   TRP  27           HA       TRP  27  -0.510   0.835  -8.708
  210    HB2  TRP  27           2HB      TRP  27  -2.159   2.995  -9.958
  211    HB3  TRP  27           1HB      TRP  27  -2.227   2.761  -8.217
  212    HD1  TRP  27           1HD      TRP  27   0.450   3.439 -10.954
  213    HE1  TRP  27           1HE      TRP  27   2.309   4.868  -9.887
  214    HE3  TRP  27           3HE      TRP  27  -1.270   3.556  -6.136
  215    HZ2  TRP  27           2HZ      TRP  27   2.961   5.905  -7.338
  216    HZ3  TRP  27           3HZ      TRP  27   0.026   4.785  -4.446
  217    HH2  TRP  27           2HH      TRP  27   2.098   5.938  -5.032
  218    H    THR  28           HN       THR  28  -3.623   0.915 -10.396
  219    HA   THR  28           HA       THR  28  -5.175   0.104  -8.184
  220    HB   THR  28           HB       THR  28  -5.904  -0.325 -11.084
  221    HG1  THR  28           1HG      THR  28  -5.302   1.820 -10.978
  222   HG21  THR  28          3HG2      THR  28  -7.446  -1.280  -9.451
  223   HG22  THR  28          1HG2      THR  28  -8.187   0.096 -10.266
  224   HG23  THR  28          2HG2      THR  28  -7.561   0.274  -8.627
  225    H    ASN  29           HN       ASN  29  -3.795  -1.656 -10.913
  226    HA   ASN  29           HA       ASN  29  -5.167  -4.076 -10.457
  227    HB2  ASN  29           2HB      ASN  29  -4.143  -3.289 -12.617
  228    HB3  ASN  29           1HB      ASN  29  -2.569  -3.690 -11.948
  229   HD21  ASN  29          1HD2      ASN  29  -2.294  -5.126 -13.695
  230   HD22  ASN  29          2HD2      ASN  29  -3.039  -6.684 -13.686
  231    H    THR  30           HN       THR  30  -1.838  -3.073  -9.637
  232    HA   THR  30           HA       THR  30  -1.002  -5.598  -8.714
  233    HB   THR  30           HB       THR  30   0.787  -4.323  -7.485
  234    HG1  THR  30           1HG      THR  30   0.025  -1.996  -8.831
  235   HG21  THR  30          3HG2      THR  30   1.134  -5.104  -9.766
  236   HG22  THR  30          1HG2      THR  30   1.897  -3.531  -9.526
  237   HG23  THR  30          2HG2      THR  30   0.366  -3.646 -10.396
  238    H    ILE  31           HN       ILE  31  -2.099  -2.748  -6.889
  239    HA   ILE  31           HA       ILE  31  -1.907  -3.917  -4.350
  240    HB   ILE  31           HB       ILE  31  -3.765  -1.704  -5.244
  241   HG12  ILE  31          2HG1      ILE  31  -1.025  -1.580  -3.960
  242   HG13  ILE  31          1HG1      ILE  31  -1.371  -1.242  -5.653
  243   HG21  ILE  31          1HG2      ILE  31  -2.866  -2.479  -2.470
  244   HG22  ILE  31          2HG2      ILE  31  -4.483  -2.692  -3.135
  245   HG23  ILE  31          3HG2      ILE  31  -3.841  -1.071  -2.882
  246   HD11  ILE  31          3HD1      ILE  31  -1.099   0.797  -4.347
  247   HD12  ILE  31          1HD1      ILE  31  -2.436   0.311  -3.304
  248   HD13  ILE  31          2HD1      ILE  31  -2.729   0.663  -5.008
  249    H    LYS  32           HN       LYS  32  -4.634  -3.697  -6.595
  250    HA   LYS  32           HA       LYS  32  -6.597  -4.829  -4.958
  251    HB2  LYS  32           2HB      LYS  32  -6.942  -3.675  -7.175
  252    HB3  LYS  32           1HB      LYS  32  -6.382  -5.146  -7.955
  253    HG2  LYS  32           2HG      LYS  32  -8.225  -6.384  -6.865
  254    HG3  LYS  32           1HG      LYS  32  -8.823  -4.853  -6.221
  255    HD2  LYS  32           2HD      LYS  32  -9.113  -4.008  -8.499
  256    HD3  LYS  32           1HD      LYS  32  -8.499  -5.535  -9.144
  257    HE2  LYS  32           2HE      LYS  32 -10.994  -5.165  -7.488
  258    HE3  LYS  32           1HE      LYS  32 -10.930  -5.495  -9.218
  259    HZ1  LYS  32           3HZ      LYS  32  -9.903  -7.633  -8.742
  260    HZ2  LYS  32           1HZ      LYS  32 -11.395  -7.500  -7.940
  261    HZ3  LYS  32           2HZ      LYS  32  -9.949  -7.313  -7.078
  262    H    THR  33           HN       THR  33  -4.096  -6.299  -6.913
  263    HA   THR  33           HA       THR  33  -5.261  -8.936  -6.755
  264    HB   THR  33           HB       THR  33  -2.514  -8.155  -7.751
  265    HG1  THR  33           1HG      THR  33  -3.982  -7.100  -9.042
  266   HG21  THR  33          3HG2      THR  33  -2.675 -10.256  -9.033
  267   HG22  THR  33          1HG2      THR  33  -4.210 -10.610  -8.242
  268   HG23  THR  33          2HG2      THR  33  -2.726 -10.545  -7.293
  269    H    TYR  34           HN       TYR  34  -2.347  -7.364  -5.444
  270    HA   TYR  34           HA       TYR  34  -1.571  -9.743  -4.033
  271    HB2  TYR  34           2HB      TYR  34  -0.462  -6.940  -4.047
  272    HB3  TYR  34           1HB      TYR  34   0.211  -8.232  -3.059
  273    HD1  TYR  34           1HD      TYR  34   1.280 -10.188  -4.146
  274    HD2  TYR  34           2HD      TYR  34  -0.033  -6.827  -6.402
  275    HE1  TYR  34           1HE      TYR  34   2.679 -10.912  -6.036
  276    HE2  TYR  34           2HE      TYR  34   1.360  -7.546  -8.295
  277    HH   TYR  34           HH       TYR  34   2.763 -10.627  -8.483
  278    H    CYS  35           HN       CYS  35  -2.849  -6.560  -3.033
  279    HA   CYS  35           HA       CYS  35  -2.923  -7.567  -0.272
  280    HB2  CYS  35           2HB      CYS  35  -3.095  -4.723  -1.281
  281    HB3  CYS  35           1HB      CYS  35  -3.058  -5.216   0.411
  282    HG   CYS  35           HG       CYS  35  -0.493  -6.242  -1.529
  283    H    GLY  36           HN       GLY  36  -4.918  -6.728  -2.886
  284    HA2  GLY  36           2HA      GLY  36  -7.193  -5.635  -1.830
  285    HA3  GLY  36           1HA      GLY  36  -7.188  -6.756  -3.178
  286    HA   PRO  37           HA       PRO  37  -9.285  -9.954  -1.045
  287    HB2  PRO  37           2HB      PRO  37  -6.874 -11.681  -0.854
  288    HB3  PRO  37           1HB      PRO  37  -8.461 -12.032  -1.547
  289    HG2  PRO  37           2HG      PRO  37  -6.366 -11.568  -3.120
  290    HG3  PRO  37           1HG      PRO  37  -7.973 -10.943  -3.541
  291    HD2  PRO  37           2HD      PRO  37  -5.618  -9.508  -2.389
  292    HD3  PRO  37           1HD      PRO  37  -6.799  -8.954  -3.594
  293    H    VAL  38           HN       VAL  38  -6.269  -8.961   0.409
  294    HA   VAL  38           HA       VAL  38  -6.934 -10.325   2.906
  295    HB   VAL  38           HB       VAL  38  -4.420  -8.768   2.310
  296   HG11  VAL  38          1HG1      VAL  38  -4.938  -9.134   4.686
  297   HG12  VAL  38          2HG1      VAL  38  -3.494 -10.010   4.177
  298   HG13  VAL  38          3HG1      VAL  38  -5.019 -10.871   4.389
  299   HG21  VAL  38          3HG2      VAL  38  -3.360 -10.932   1.854
  300   HG22  VAL  38          1HG2      VAL  38  -4.643 -10.581   0.698
  301   HG23  VAL  38          2HG2      VAL  38  -4.926 -11.726   2.006
  302    H    ILE  39           HN       ILE  39  -5.523  -7.095   2.219
  303    HA   ILE  39           HA       ILE  39  -6.848  -6.152   4.651
  304    HB   ILE  39           HB       ILE  39  -5.377  -4.169   4.471
  305   HG12  ILE  39          2HG1      ILE  39  -4.106  -5.677   2.174
  306   HG13  ILE  39          1HG1      ILE  39  -5.069  -4.212   2.017
  307   HG21  ILE  39          1HG2      ILE  39  -4.716  -6.043   5.845
  308   HG22  ILE  39          2HG2      ILE  39  -3.296  -5.339   5.068
  309   HG23  ILE  39          3HG2      ILE  39  -3.985  -6.842   4.453
  310   HD11  ILE  39          3HD1      ILE  39  -3.410  -2.977   3.306
  311   HD12  ILE  39          1HD1      ILE  39  -2.691  -3.733   1.884
  312   HD13  ILE  39          2HD1      ILE  39  -2.449  -4.447   3.479
  313    H    GLY  40           HN       GLY  40  -7.490  -6.209   1.445
  314    HA2  GLY  40           2HA      GLY  40  -8.366  -3.675   0.746
  315    HA3  GLY  40           1HA      GLY  40  -9.052  -5.175   0.143
  316    HA   PRO  41           HA       PRO  41 -12.780  -4.530   2.378
  317    HB2  PRO  41           2HB      PRO  41 -13.300  -6.795   3.770
  318    HB3  PRO  41           1HB      PRO  41 -13.374  -6.720   2.005
  319    HG2  PRO  41           2HG      PRO  41 -11.172  -7.736   3.765
  320    HG3  PRO  41           1HG      PRO  41 -11.841  -8.454   2.287
  321    HD2  PRO  41           2HD      PRO  41  -9.534  -7.035   2.317
  322    HD3  PRO  41           1HD      PRO  41 -10.624  -7.064   0.917
  323    H    LEU  42           HN       LEU  42  -9.972  -4.638   4.114
  324    HA   LEU  42           HA       LEU  42 -11.156  -4.409   6.747
  325    HB2  LEU  42           2HB      LEU  42  -8.314  -3.914   5.851
  326    HB3  LEU  42           1HB      LEU  42  -8.867  -3.989   7.510
  327    HG   LEU  42           HG       LEU  42  -8.815  -6.279   5.541
  328   HD11  LEU  42          1HD1      LEU  42  -7.223  -5.752   8.047
  329   HD12  LEU  42          2HD1      LEU  42  -6.617  -5.675   6.393
  330   HD13  LEU  42          3HD1      LEU  42  -7.146  -7.214   7.067
  331   HD21  LEU  42          3HD2      LEU  42  -9.538  -7.671   7.413
  332   HD22  LEU  42          1HD2      LEU  42 -10.749  -6.449   7.018
  333   HD23  LEU  42          2HD2      LEU  42  -9.703  -6.233   8.421
  334    H    SER  43           HN       SER  43 -11.048  -2.484   8.020
  335    HA   SER  43           HA       SER  43 -11.744  -0.142   6.571
  336    HB2  SER  43           2HB      SER  43 -12.651  -0.636   8.811
  337    HB3  SER  43           1HB      SER  43 -11.040  -0.459   9.499
  338    HG   SER  43           HG       SER  43 -12.865   1.451   8.779
  339    H    VAL  44           HN       VAL  44 -10.609   1.799   6.320
  340    HA   VAL  44           HA       VAL  44  -7.798   1.620   6.071
  341    HB   VAL  44           HB       VAL  44  -9.160   3.165   4.718
  342   HG11  VAL  44          1HG1      VAL  44 -10.755   3.913   6.367
  343   HG12  VAL  44          2HG1      VAL  44  -9.912   5.301   5.670
  344   HG13  VAL  44          3HG1      VAL  44  -9.475   4.718   7.279
  345   HG21  VAL  44          3HG2      VAL  44  -6.773   3.574   4.903
  346   HG22  VAL  44          1HG2      VAL  44  -7.031   4.531   6.363
  347   HG23  VAL  44          2HG2      VAL  44  -7.650   5.102   4.815
  348    H    GLN  45           HN       GLN  45  -9.889   2.446   8.690
  349    HA   GLN  45           HA       GLN  45  -7.842   3.627  10.336
  350    HB2  GLN  45           2HB      GLN  45 -10.683   2.730  10.783
  351    HB3  GLN  45           1HB      GLN  45  -9.664   3.253  12.107
  352    HG2  GLN  45           2HG      GLN  45 -10.130   4.982   9.710
  353    HG3  GLN  45           1HG      GLN  45 -11.248   4.955  11.073
  354   HE21  GLN  45          1HE2      GLN  45 -10.852   7.082  11.595
  355   HE22  GLN  45          2HE2      GLN  45  -9.379   7.596  12.338
  356    H    ASP  46           HN       ASP  46  -9.023   0.490   9.579
  357    HA   ASP  46           HA       ASP  46  -8.108  -0.734  12.042
  358    HB2  ASP  46           2HB      ASP  46 -10.203  -1.471  10.990
  359    HB3  ASP  46           1HB      ASP  46  -9.310  -1.961   9.554
  360    H    VAL  47           HN       VAL  47  -7.012  -0.322   8.768
  361    HA   VAL  47           HA       VAL  47  -5.156  -2.369   8.517
  362    HB   VAL  47           HB       VAL  47  -4.933   0.459   7.461
  363   HG11  VAL  47          1HG1      VAL  47  -3.387  -0.459   5.810
  364   HG12  VAL  47          2HG1      VAL  47  -3.489  -2.040   6.583
  365   HG13  VAL  47          3HG1      VAL  47  -2.767  -0.682   7.446
  366   HG21  VAL  47          3HG2      VAL  47  -5.806  -0.508   5.378
  367   HG22  VAL  47          1HG2      VAL  47  -6.951  -0.670   6.710
  368   HG23  VAL  47          2HG2      VAL  47  -6.000  -2.061   6.191
  369    H    ASP  48           HN       ASP  48  -3.562  -2.918   9.798
  370    HA   ASP  48           HA       ASP  48  -1.904  -0.825  11.030
  371    HB2  ASP  48           2HB      ASP  48  -3.286  -1.779  12.771
  372    HB3  ASP  48           1HB      ASP  48  -2.858  -3.413  12.291
  373    H    THR  49           HN       THR  49   0.238  -1.780  11.759
  374    HA   THR  49           HA       THR  49   1.619  -2.638   9.478
  375    HB   THR  49           HB       THR  49   2.585  -2.842  12.338
  376    HG1  THR  49           1HG      THR  49   3.010  -0.641  10.600
  377   HG21  THR  49          3HG2      THR  49   4.026  -3.955  10.697
  378   HG22  THR  49          1HG2      THR  49   4.799  -2.496  11.323
  379   HG23  THR  49          2HG2      THR  49   4.059  -2.487   9.721
  380    H    LYS  50           HN       LYS  50   0.359  -4.449  12.240
  381    HA   LYS  50           HA       LYS  50   1.645  -6.887  11.749
  382    HB2  LYS  50           2HB      LYS  50  -0.626  -5.909  13.334
  383    HB3  LYS  50           1HB      LYS  50  -0.739  -7.592  12.870
  384    HG2  LYS  50           2HG      LYS  50   1.672  -6.421  14.223
  385    HG3  LYS  50           1HG      LYS  50   0.322  -7.150  15.098
  386    HD2  LYS  50           2HD      LYS  50   1.909  -8.577  12.969
  387    HD3  LYS  50           1HD      LYS  50   2.262  -8.686  14.695
  388    HE2  LYS  50           2HE      LYS  50   0.057  -9.613  15.113
  389    HE3  LYS  50           1HE      LYS  50  -0.367  -9.427  13.414
  390    HZ1  LYS  50           3HZ      LYS  50   0.300 -11.712  14.066
  391    HZ2  LYS  50           1HZ      LYS  50   1.865 -11.132  14.372
  392    HZ3  LYS  50           2HZ      LYS  50   1.230 -11.059  12.804
  393    H    LEU  51           HN       LEU  51  -1.438  -5.599  10.589
  394    HA   LEU  51           HA       LEU  51  -2.242  -7.904   9.164
  395    HB2  LEU  51           2HB      LEU  51  -2.950  -5.020   8.615
  396    HB3  LEU  51           1HB      LEU  51  -3.856  -6.429   8.112
  397    HG   LEU  51           HG       LEU  51  -3.487  -5.482  10.945
  398   HD11  LEU  51          1HD1      LEU  51  -5.896  -5.483   9.139
  399   HD12  LEU  51          2HD1      LEU  51  -4.993  -4.070   9.683
  400   HD13  LEU  51          3HD1      LEU  51  -5.896  -5.040  10.847
  401   HD21  LEU  51          3HD2      LEU  51  -3.595  -7.909  10.842
  402   HD22  LEU  51          1HD2      LEU  51  -5.060  -7.814   9.863
  403   HD23  LEU  51          2HD2      LEU  51  -5.076  -7.247  11.533
  404    H    ILE  52           HN       ILE  52  -0.392  -5.052   8.373
  405    HA   ILE  52           HA       ILE  52  -0.111  -5.445   5.614
  406    HB   ILE  52           HB       ILE  52   1.431  -3.931   7.681
  407   HG12  ILE  52          2HG1      ILE  52  -0.153  -3.141   5.233
  408   HG13  ILE  52          1HG1      ILE  52  -0.699  -3.047   6.902
  409   HG21  ILE  52          1HG2      ILE  52   2.214  -4.095   4.779
  410   HG22  ILE  52          2HG2      ILE  52   3.140  -4.716   6.143
  411   HG23  ILE  52          3HG2      ILE  52   2.879  -2.981   5.971
  412   HD11  ILE  52          3HD1      ILE  52   0.999  -1.368   7.369
  413   HD12  ILE  52          1HD1      ILE  52  -0.054  -0.868   6.047
  414   HD13  ILE  52          2HD1      ILE  52   1.566  -1.471   5.703
  415    H    MET  53           HN       MET  53   1.700  -6.725   8.342
  416    HA   MET  53           HA       MET  53   3.836  -7.853   6.867
  417    HB2  MET  53           2HB      MET  53   2.668  -8.636   9.541
  418    HB3  MET  53           1HB      MET  53   4.161  -9.286   8.885
  419    HG2  MET  53           2HG      MET  53   5.161  -7.073   8.910
  420    HG3  MET  53           1HG      MET  53   3.655  -6.387   9.518
  421    HE1  MET  53           3HE      MET  53   6.494  -5.942  10.894
  422    HE2  MET  53           1HE      MET  53   6.084  -6.141  12.598
  423    HE3  MET  53           2HE      MET  53   5.002  -5.251  11.531
  424    H    LYS  54           HN       LYS  54   0.699  -9.094   7.890
  425    HA   LYS  54           HA       LYS  54   1.027 -11.781   7.250
  426    HB2  LYS  54           2HB      LYS  54  -1.465 -10.075   7.140
  427    HB3  LYS  54           1HB      LYS  54  -1.460 -11.829   7.033
  428    HG2  LYS  54           2HG      LYS  54  -0.500 -11.985   9.260
  429    HG3  LYS  54           1HG      LYS  54  -0.451 -10.226   9.369
  430    HD2  LYS  54           2HD      LYS  54  -2.377 -11.168  10.564
  431    HD3  LYS  54           1HD      LYS  54  -2.873 -10.122   9.233
  432    HE2  LYS  54           2HE      LYS  54  -3.415 -12.000   7.866
  433    HE3  LYS  54           1HE      LYS  54  -2.679 -13.122   9.010
  434    HZ1  LYS  54           3HZ      LYS  54  -5.167 -12.972   9.066
  435    HZ2  LYS  54           1HZ      LYS  54  -5.002 -11.410   9.695
  436    HZ3  LYS  54           2HZ      LYS  54  -4.396 -12.740  10.557
  437    H    VAL  55           HN       VAL  55   0.108  -9.074   5.197
  438    HA   VAL  55           HA       VAL  55  -0.557 -10.639   2.917
  439    HB   VAL  55           HB       VAL  55   0.364  -7.765   2.909
  440   HG11  VAL  55          1HG1      VAL  55  -1.091  -7.613   0.916
  441   HG12  VAL  55          2HG1      VAL  55  -1.370  -9.351   1.021
  442   HG13  VAL  55          3HG1      VAL  55   0.253  -8.736   0.706
  443   HG21  VAL  55          3HG2      VAL  55  -1.997  -7.146   3.115
  444   HG22  VAL  55          1HG2      VAL  55  -1.413  -8.008   4.541
  445   HG23  VAL  55          2HG2      VAL  55  -2.413  -8.845   3.353
  446    H    LEU  56           HN       LEU  56   2.406  -9.127   4.069
  447    HA   LEU  56           HA       LEU  56   3.784  -9.479   1.564
  448    HB2  LEU  56           2HB      LEU  56   4.705  -8.561   4.279
  449    HB3  LEU  56           1HB      LEU  56   5.786  -8.717   2.908
  450    HG   LEU  56           HG       LEU  56   3.425  -6.853   3.135
  451   HD11  LEU  56          1HD1      LEU  56   5.136  -5.112   2.998
  452   HD12  LEU  56          2HD1      LEU  56   6.392  -6.352   2.981
  453   HD13  LEU  56          3HD1      LEU  56   5.371  -6.149   4.406
  454   HD21  LEU  56          3HD2      LEU  56   5.329  -7.292   0.834
  455   HD22  LEU  56          1HD2      LEU  56   4.133  -5.998   0.942
  456   HD23  LEU  56          2HD2      LEU  56   3.608  -7.680   0.855
  457    H    ASP  57           HN       ASP  57   3.330 -11.334   4.418
  458    HA   ASP  57           HA       ASP  57   5.617 -12.771   4.758
  459    HB2  ASP  57           2HB      ASP  57   3.390 -12.956   6.014
  460    HB3  ASP  57           1HB      ASP  57   2.941 -14.142   4.809
  461    HA   PRO  58           HA       PRO  58   4.624 -15.947   1.328
  462    HB2  PRO  58           2HB      PRO  58   2.548 -15.576  -0.343
  463    HB3  PRO  58           1HB      PRO  58   2.354 -16.354   1.232
  464    HG2  PRO  58           2HG      PRO  58   1.770 -13.528   0.432
  465    HG3  PRO  58           1HG      PRO  58   0.802 -14.632   1.428
  466    HD2  PRO  58           2HD      PRO  58   2.412 -12.694   2.474
  467    HD3  PRO  58           1HD      PRO  58   2.041 -14.211   3.313
  468    H    ILE  59           HN       ILE  59   4.481 -12.552   0.817
  469    HA   ILE  59           HA       ILE  59   5.087 -12.662  -2.008
  470    HB   ILE  59           HB       ILE  59   5.092 -10.286  -0.138
  471   HG12  ILE  59          2HG1      ILE  59   2.999 -11.317  -2.070
  472   HG13  ILE  59          1HG1      ILE  59   2.880 -11.310  -0.314
  473   HG21  ILE  59          1HG2      ILE  59   4.961  -8.961  -2.225
  474   HG22  ILE  59          2HG2      ILE  59   5.195 -10.442  -3.151
  475   HG23  ILE  59          3HG2      ILE  59   6.469  -9.861  -2.079
  476   HD11  ILE  59          3HD1      ILE  59   1.569  -9.521  -1.318
  477   HD12  ILE  59          1HD1      ILE  59   3.023  -8.870  -2.074
  478   HD13  ILE  59          2HD1      ILE  59   2.870  -8.878  -0.316
  479    H    TRP  60           HN       TRP  60   6.831 -11.979   1.010
  480    HA   TRP  60           HA       TRP  60   9.267 -11.150  -0.086
  481    HB2  TRP  60           2HB      TRP  60   8.643 -12.614   2.477
  482    HB3  TRP  60           1HB      TRP  60  10.273 -12.105   2.060
  483    HD1  TRP  60           1HD      TRP  60   7.266 -10.921   3.811
  484    HE1  TRP  60           1HE      TRP  60   7.447  -8.409   4.329
  485    HE3  TRP  60           3HE      TRP  60  11.235  -9.753   0.810
  486    HZ2  TRP  60           2HZ      TRP  60   9.049  -6.223   3.572
  487    HZ3  TRP  60           3HZ      TRP  60  12.029  -7.425   0.767
  488    HH2  TRP  60           2HH      TRP  60  10.956  -5.697   2.121
  489    H    GLU  61           HN       GLU  61   7.874 -14.304   0.165
  490    HA   GLU  61           HA       GLU  61  10.198 -15.849  -0.195
  491    HB2  GLU  61           2HB      GLU  61   7.295 -16.406  -0.798
  492    HB3  GLU  61           1HB      GLU  61   8.562 -17.604  -0.786
  493    HG2  GLU  61           2HG      GLU  61   7.639 -15.983   1.563
  494    HG3  GLU  61           1HG      GLU  61   7.281 -17.683   1.262
  495    H    GLN  62           HN       GLN  62   8.134 -14.097  -2.348
  496    HA   GLN  62           HA       GLN  62   9.250 -15.503  -4.667
  497    HB2  GLN  62           2HB      GLN  62   6.632 -14.043  -4.322
  498    HB3  GLN  62           1HB      GLN  62   7.201 -14.722  -5.837
  499    HG2  GLN  62           2HG      GLN  62   7.147 -16.943  -4.936
  500    HG3  GLN  62           1HG      GLN  62   6.751 -16.326  -3.335
  501   HE21  GLN  62          1HE2      GLN  62   4.674 -15.618  -2.910
  502   HE22  GLN  62          2HE2      GLN  62   3.341 -15.976  -3.960
  503    H    LYS  63           HN       LYS  63   8.164 -12.253  -3.636
  504    HA   LYS  63           HA       LYS  63  10.105 -11.126  -5.533
  505    HB2  LYS  63           2HB      LYS  63   7.309 -10.053  -5.126
  506    HB3  LYS  63           1HB      LYS  63   8.529  -9.410  -6.218
  507    HG2  LYS  63           2HG      LYS  63   8.461 -11.556  -7.465
  508    HG3  LYS  63           1HG      LYS  63   7.120 -12.063  -6.434
  509    HD2  LYS  63           2HD      LYS  63   5.862 -10.054  -7.181
  510    HD3  LYS  63           1HD      LYS  63   7.181  -9.690  -8.297
  511    HE2  LYS  63           2HE      LYS  63   5.422 -12.140  -8.300
  512    HE3  LYS  63           1HE      LYS  63   5.413 -10.832  -9.481
  513    HZ1  LYS  63           3HZ      LYS  63   7.693 -11.446 -10.089
  514    HZ2  LYS  63           1HZ      LYS  63   6.606 -12.725 -10.339
  515    HZ3  LYS  63           2HZ      LYS  63   7.638 -12.742  -8.996
  516    HA   PRO  64           HA       PRO  64  10.866  -9.470  -1.288
  517    HB2  PRO  64           2HB      PRO  64  13.489  -9.018  -2.602
  518    HB3  PRO  64           1HB      PRO  64  13.128  -9.724  -1.023
  519    HG2  PRO  64           2HG      PRO  64  13.891 -11.256  -3.068
  520    HG3  PRO  64           1HG      PRO  64  12.665 -11.812  -1.915
  521    HD2  PRO  64           2HD      PRO  64  12.320 -10.774  -4.696
  522    HD3  PRO  64           1HD      PRO  64  11.445 -12.069  -3.855
  523    H    GLU  65           HN       GLU  65  12.280  -8.037  -4.254
  524    HA   GLU  65           HA       GLU  65  12.383  -5.414  -3.266
  525    HB2  GLU  65           2HB      GLU  65  13.580  -6.255  -5.287
  526    HB3  GLU  65           1HB      GLU  65  12.046  -6.243  -6.141
  527    HG2  GLU  65           2HG      GLU  65  11.895  -3.790  -5.623
  528    HG3  GLU  65           1HG      GLU  65  13.562  -3.891  -5.056
  529    H    THR  66           HN       THR  66   9.863  -7.161  -4.965
  530    HA   THR  66           HA       THR  66   8.245  -4.911  -5.554
  531    HB   THR  66           HB       THR  66   7.438  -7.819  -5.351
  532    HG1  THR  66           1HG      THR  66   8.559  -6.250  -7.444
  533   HG21  THR  66          3HG2      THR  66   5.531  -6.263  -5.396
  534   HG22  THR  66          1HG2      THR  66   5.638  -7.205  -6.884
  535   HG23  THR  66          2HG2      THR  66   6.175  -5.526  -6.863
  536    H    ALA  67           HN       ALA  67   8.386  -7.159  -2.858
  537    HA   ALA  67           HA       ALA  67   5.990  -6.500  -1.582
  538    HB1  ALA  67           1HB      ALA  67   7.380  -8.391  -0.912
  539    HB2  ALA  67           2HB      ALA  67   7.039  -7.336   0.460
  540    HB3  ALA  67           3HB      ALA  67   8.619  -7.283  -0.323
  541    H    SER  68           HN       SER  68   9.209  -5.055  -1.249
  542    HA   SER  68           HA       SER  68   8.414  -3.105   0.666
  543    HB2  SER  68           2HB      SER  68  10.757  -3.999   0.252
  544    HB3  SER  68           1HB      SER  68  10.810  -2.971  -1.178
  545    HG   SER  68           HG       SER  68  11.244  -2.325   1.387
  546    H    ARG  69           HN       ARG  69   8.936  -3.010  -2.856
  547    HA   ARG  69           HA       ARG  69   8.487  -0.257  -3.173
  548    HB2  ARG  69           2HB      ARG  69   8.244  -2.575  -5.082
  549    HB3  ARG  69           1HB      ARG  69   8.071  -0.905  -5.572
  550    HG2  ARG  69           2HG      ARG  69  10.344  -0.442  -4.772
  551    HG3  ARG  69           1HG      ARG  69  10.513  -2.144  -4.348
  552    HD2  ARG  69           2HD      ARG  69  11.563  -1.797  -6.469
  553    HD3  ARG  69           1HD      ARG  69  10.081  -2.715  -6.731
  554    HE   ARG  69           HE       ARG  69   9.377  -0.076  -7.076
  555   HH11  ARG  69          1HH1      ARG  69  11.668  -2.300  -8.562
  556   HH12  ARG  69          2HH1      ARG  69  11.624  -1.483 -10.101
  557   HH21  ARG  69          1HH2      ARG  69   9.332   0.971  -9.071
  558   HH22  ARG  69          2HH2      ARG  69  10.327   0.402 -10.385
  559    H    LEU  70           HN       LEU  70   6.297  -3.003  -3.077
  560    HA   LEU  70           HA       LEU  70   3.983  -1.630  -3.964
  561    HB2  LEU  70           2HB      LEU  70   4.158  -4.086  -3.908
  562    HB3  LEU  70           1HB      LEU  70   4.217  -4.038  -2.158
  563    HG   LEU  70           HG       LEU  70   1.933  -3.151  -2.094
  564   HD11  LEU  70          1HD1      LEU  70   1.906  -1.952  -4.206
  565   HD12  LEU  70          2HD1      LEU  70   0.578  -3.111  -4.137
  566   HD13  LEU  70          3HD1      LEU  70   2.017  -3.474  -5.091
  567   HD21  LEU  70          3HD2      LEU  70   2.303  -5.554  -1.982
  568   HD22  LEU  70          1HD2      LEU  70   2.226  -5.658  -3.740
  569   HD23  LEU  70          2HD2      LEU  70   0.797  -5.186  -2.823
  570    H    ARG  71           HN       ARG  71   5.481  -2.090  -0.820
  571    HA   ARG  71           HA       ARG  71   3.406  -0.917   0.703
  572    HB2  ARG  71           2HB      ARG  71   6.325  -1.408   1.240
  573    HB3  ARG  71           1HB      ARG  71   5.273  -0.643   2.418
  574    HG2  ARG  71           2HG      ARG  71   5.079  -3.421   1.298
  575    HG3  ARG  71           1HG      ARG  71   5.352  -2.935   2.975
  576    HD2  ARG  71           2HD      ARG  71   3.107  -1.959   3.053
  577    HD3  ARG  71           1HD      ARG  71   2.837  -2.444   1.381
  578    HE   ARG  71           HE       ARG  71   3.282  -4.379   3.557
  579   HH11  ARG  71          1HH1      ARG  71   1.659  -3.366   0.648
  580   HH12  ARG  71          2HH1      ARG  71   0.560  -4.707   0.622
  581   HH21  ARG  71          1HH2      ARG  71   1.824  -6.163   3.558
  582   HH22  ARG  71          2HH2      ARG  71   0.655  -6.295   2.283
  583    H    GLY  72           HN       GLY  72   6.250   0.367  -0.916
  584    HA2  GLY  72           2HA      GLY  72   6.200   2.972   0.114
  585    HA3  GLY  72           1HA      GLY  72   6.838   2.518  -1.458
  586    H    ARG  73           HN       ARG  73   4.277   1.470  -2.400
  587    HA   ARG  73           HA       ARG  73   3.099   3.881  -3.381
  588    HB2  ARG  73           2HB      ARG  73   1.913   1.098  -3.459
  589    HB3  ARG  73           1HB      ARG  73   1.509   2.449  -4.506
  590    HG2  ARG  73           2HG      ARG  73   3.743   2.359  -5.488
  591    HG3  ARG  73           1HG      ARG  73   4.142   0.993  -4.439
  592    HD2  ARG  73           2HD      ARG  73   2.143  -0.186  -5.442
  593    HD3  ARG  73           1HD      ARG  73   2.088   1.108  -6.637
  594    HE   ARG  73           HE       ARG  73   4.588  -0.376  -6.326
  595   HH11  ARG  73          1HH1      ARG  73   1.740   0.353  -8.223
  596   HH12  ARG  73          2HH1      ARG  73   2.323  -0.447  -9.645
  597   HH21  ARG  73          1HH2      ARG  73   5.354  -1.462  -8.196
  598   HH22  ARG  73          2HH2      ARG  73   4.365  -1.481  -9.634
  599    H    ILE  74           HN       ILE  74   2.103   1.390  -1.080
  600    HA   ILE  74           HA       ILE  74  -0.417   2.440  -0.434
  601    HB   ILE  74           HB       ILE  74   1.423   0.661   1.164
  602   HG12  ILE  74          2HG1      ILE  74  -0.989   0.117  -0.581
  603   HG13  ILE  74          1HG1      ILE  74   0.680  -0.297  -0.951
  604   HG21  ILE  74          1HG2      ILE  74  -1.483   1.313   1.660
  605   HG22  ILE  74          2HG2      ILE  74  -0.121   1.792   2.672
  606   HG23  ILE  74          3HG2      ILE  74  -0.544   0.087   2.513
  607   HD11  ILE  74          3HD1      ILE  74   0.698  -1.843   0.948
  608   HD12  ILE  74          1HD1      ILE  74  -0.540  -2.247  -0.239
  609   HD13  ILE  74          2HD1      ILE  74  -0.990  -1.449   1.265
  610    H    GLU  75           HN       GLU  75   2.785   3.031   0.939
  611    HA   GLU  75           HA       GLU  75   2.168   4.514   3.192
  612    HB2  GLU  75           2HB      GLU  75   4.466   3.923   2.498
  613    HB3  GLU  75           1HB      GLU  75   4.361   5.086   1.184
  614    HG2  GLU  75           2HG      GLU  75   3.770   6.709   3.211
  615    HG3  GLU  75           1HG      GLU  75   4.740   5.520   4.081
  616    H    SER  76           HN       SER  76   2.482   5.642  -0.153
  617    HA   SER  76           HA       SER  76   1.937   8.349   0.344
  618    HB2  SER  76           2HB      SER  76   1.532   6.742  -2.172
  619    HB3  SER  76           1HB      SER  76   1.582   8.500  -2.089
  620    HG   SER  76           HG       SER  76   3.748   8.079  -1.043
  621    H    VAL  77           HN       VAL  77  -0.164   5.616  -0.384
  622    HA   VAL  77           HA       VAL  77  -2.533   7.125  -0.778
  623    HB   VAL  77           HB       VAL  77  -2.284   4.253   0.143
  624   HG11  VAL  77          1HG1      VAL  77  -4.590   5.688  -1.170
  625   HG12  VAL  77          2HG1      VAL  77  -4.509   5.193   0.521
  626   HG13  VAL  77          3HG1      VAL  77  -4.536   3.976  -0.755
  627   HG21  VAL  77          3HG2      VAL  77  -2.526   5.376  -2.648
  628   HG22  VAL  77          1HG2      VAL  77  -2.553   3.666  -2.219
  629   HG23  VAL  77          2HG2      VAL  77  -1.094   4.620  -1.952
  630    H    LEU  78           HN       LEU  78  -1.251   5.366   2.038
  631    HA   LEU  78           HA       LEU  78  -3.380   6.064   3.768
  632    HB2  LEU  78           2HB      LEU  78  -0.560   5.186   4.378
  633    HB3  LEU  78           1HB      LEU  78  -1.827   5.340   5.581
  634    HG   LEU  78           HG       LEU  78  -1.835   3.431   3.240
  635   HD11  LEU  78          1HD1      LEU  78  -1.594   1.696   4.898
  636   HD12  LEU  78          2HD1      LEU  78  -1.603   2.889   6.195
  637   HD13  LEU  78          3HD1      LEU  78  -0.265   2.844   5.047
  638   HD21  LEU  78          3HD2      LEU  78  -4.085   4.243   3.815
  639   HD22  LEU  78          1HD2      LEU  78  -3.826   3.739   5.485
  640   HD23  LEU  78          2HD2      LEU  78  -3.875   2.536   4.197
  641    H    ASP  79           HN       ASP  79  -0.338   7.610   2.967
  642    HA   ASP  79           HA       ASP  79  -0.320   9.527   5.046
  643    HB2  ASP  79           2HB      ASP  79   1.643   9.015   3.618
  644    HB3  ASP  79           1HB      ASP  79   0.824   9.756   2.249
  645    H    TRP  80           HN       TRP  80  -1.488   9.663   1.698
  646    HA   TRP  80           HA       TRP  80  -2.646  12.213   1.791
  647    HB2  TRP  80           2HB      TRP  80  -2.355  11.191  -0.331
  648    HB3  TRP  80           1HB      TRP  80  -3.234   9.748   0.153
  649    HD1  TRP  80           1HD      TRP  80  -3.896  13.445  -0.771
  650    HE1  TRP  80           1HE      TRP  80  -6.308  13.621  -1.677
  651    HE3  TRP  80           3HE      TRP  80  -5.430   8.650   0.109
  652    HZ2  TRP  80           2HZ      TRP  80  -8.560  11.921  -1.973
  653    HZ3  TRP  80           3HZ      TRP  80  -7.721   8.006  -0.512
  654    HH2  TRP  80           2HH      TRP  80  -9.250   9.611  -1.530
  655    H    ALA  81           HN       ALA  81  -3.995   9.028   2.558
  656    HA   ALA  81           HA       ALA  81  -6.625   9.815   3.084
  657    HB1  ALA  81           1HB      ALA  81  -5.070   7.570   4.368
  658    HB2  ALA  81           2HB      ALA  81  -5.932   7.482   2.832
  659    HB3  ALA  81           3HB      ALA  81  -6.827   7.733   4.330
  660    H    THR  82           HN       THR  82  -3.760   9.887   5.120
  661    HA   THR  82           HA       THR  82  -5.088  10.444   7.555
  662    HB   THR  82           HB       THR  82  -2.258  11.191   6.773
  663    HG1  THR  82           1HG      THR  82  -2.461   8.982   6.542
  664   HG21  THR  82          3HG2      THR  82  -1.823  11.093   9.191
  665   HG22  THR  82          1HG2      THR  82  -3.534  10.770   9.482
  666   HG23  THR  82          2HG2      THR  82  -3.031  12.318   8.803
  667    H    VAL  83           HN       VAL  83  -3.600  12.516   5.080
  668    HA   VAL  83           HA       VAL  83  -4.108  14.972   6.401
  669    HB   VAL  83           HB       VAL  83  -3.773  14.493   3.430
  670   HG11  VAL  83          1HG1      VAL  83  -4.695  16.703   3.953
  671   HG12  VAL  83          2HG1      VAL  83  -3.046  16.821   3.342
  672   HG13  VAL  83          3HG1      VAL  83  -3.359  16.996   5.067
  673   HG21  VAL  83          3HG2      VAL  83  -1.408  15.018   3.799
  674   HG22  VAL  83          1HG2      VAL  83  -1.898  13.582   4.699
  675   HG23  VAL  83          2HG2      VAL  83  -1.703  15.123   5.535
  676    H    ARG  84           HN       ARG  84  -5.953  12.995   4.173
  677    HA   ARG  84           HA       ARG  84  -8.058  14.867   3.749
  678    HB2  ARG  84           2HB      ARG  84  -7.813  11.898   3.329
  679    HB3  ARG  84           1HB      ARG  84  -9.303  12.767   2.997
  680    HG2  ARG  84           2HG      ARG  84  -6.657  13.461   1.754
  681    HG3  ARG  84           1HG      ARG  84  -7.845  12.382   1.017
  682    HD2  ARG  84           2HD      ARG  84  -8.352  15.245   1.809
  683    HD3  ARG  84           1HD      ARG  84  -7.996  14.691   0.173
  684    HE   ARG  84           HE       ARG  84 -10.116  13.209   0.691
  685   HH11  ARG  84          1HH1      ARG  84  -9.575  16.571   1.515
  686   HH12  ARG  84          2HH1      ARG  84 -11.248  17.013   1.318
  687   HH21  ARG  84          1HH2      ARG  84 -12.325  13.791   0.456
  688   HH22  ARG  84          2HH2      ARG  84 -12.810  15.432   0.783
  689    H    GLY  85           HN       GLY  85  -7.207  13.000   6.420
  690    HA2  GLY  85           2HA      GLY  85  -8.227  12.944   8.491
  691    HA3  GLY  85           1HA      GLY  85  -9.597  13.800   7.803
  692    H    TYR  86           HN       TYR  86  -8.452  10.884   6.304
  693    HA   TYR  86           HA       TYR  86 -10.961   9.568   6.910
  694    HB2  TYR  86           2HB      TYR  86  -8.568   8.538   5.360
  695    HB3  TYR  86           1HB      TYR  86 -10.143   7.760   5.454
  696    HD1  TYR  86           1HD      TYR  86 -11.655  10.525   5.259
  697    HD2  TYR  86           2HD      TYR  86  -8.622   8.637   2.952
  698    HE1  TYR  86           1HE      TYR  86 -12.391  11.784   3.273
  699    HE2  TYR  86           2HE      TYR  86  -9.339   9.891   0.967
  700    HH   TYR  86           HH       TYR  86 -11.473  11.016   0.157
  701    H    ARG  87           HN       ARG  87  -7.624   9.429   7.840
  702    HA   ARG  87           HA       ARG  87  -8.301   7.760  10.116
  703    HB2  ARG  87           2HB      ARG  87  -6.179   6.386   9.680
  704    HB3  ARG  87           1HB      ARG  87  -7.596   6.006   8.713
  705    HG2  ARG  87           2HG      ARG  87  -6.595   6.594   6.795
  706    HG3  ARG  87           1HG      ARG  87  -5.815   8.001   7.517
  707    HD2  ARG  87           2HD      ARG  87  -4.874   5.252   8.209
  708    HD3  ARG  87           1HD      ARG  87  -4.372   5.999   6.690
  709    HE   ARG  87           HE       ARG  87  -3.599   7.906   8.175
  710   HH11  ARG  87          1HH1      ARG  87  -3.616   4.551   9.270
  711   HH12  ARG  87          2HH1      ARG  87  -2.342   4.822  10.420
  712   HH21  ARG  87          1HH2      ARG  87  -1.936   8.209   9.670
  713   HH22  ARG  87          2HH2      ARG  87  -1.392   6.879  10.644
  714    H    GLU  88           HN       GLU  88  -6.704   7.872  11.811
  715    HA   GLU  88           HA       GLU  88  -4.911  10.196  11.534
  716    HB2  GLU  88           2HB      GLU  88  -6.467   9.330  13.981
  717    HB3  GLU  88           1HB      GLU  88  -5.303  10.644  13.936
  718    HG2  GLU  88           2HG      GLU  88  -6.731  11.806  12.295
  719    HG3  GLU  88           1HG      GLU  88  -7.920  10.513  12.456
  720    H    GLY  89           HN       GLY  89  -3.218  10.168  13.364
  721    HA2  GLY  89           2HA      GLY  89  -1.788   8.951  14.798
  722    HA3  GLY  89           1HA      GLY  89  -2.435   7.452  14.139
  723    H    ASP  90           HN       ASP  90  -0.165   6.849  14.023
  724    HA   ASP  90           HA       ASP  90   1.439   8.158  11.983
  725    HB2  ASP  90           2HB      ASP  90   2.274   7.131  14.228
  726    HB3  ASP  90           1HB      ASP  90   2.173   5.593  13.378
  727    H    ASN  91           HN       ASN  91   2.599   6.538  10.420
  728    HA   ASN  91           HA       ASN  91   0.439   5.202   8.974
  729    HB2  ASN  91           2HB      ASN  91   2.037   6.842   7.883
  730    HB3  ASN  91           1HB      ASN  91   3.322   5.673   8.140
  731   HD21  ASN  91          1HD2      ASN  91   2.227   6.854   5.692
  732   HD22  ASN  91          2HD2      ASN  91   1.774   5.521   4.694
  733    HA   PRO  92           HA       PRO  92   2.090   1.281  10.373
  734    HB2  PRO  92           2HB      PRO  92   0.383  -0.363   9.142
  735    HB3  PRO  92           1HB      PRO  92  -0.142   0.695  10.458
  736    HG2  PRO  92           2HG      PRO  92  -0.486   1.027   7.507
  737    HG3  PRO  92           1HG      PRO  92  -1.636   1.361   8.813
  738    HD2  PRO  92           2HD      PRO  92  -0.078   3.269   7.556
  739    HD3  PRO  92           1HD      PRO  92  -0.790   3.450   9.170
  740    H    ALA  93           HN       ALA  93   2.239   2.384   7.155
  741    HA   ALA  93           HA       ALA  93   3.325  -0.108   6.099
  742    HB1  ALA  93           1HB      ALA  93   1.712   1.147   4.757
  743    HB2  ALA  93           2HB      ALA  93   3.263   0.998   3.935
  744    HB3  ALA  93           3HB      ALA  93   2.820   2.518   4.710
  745    H    ARG  94           HN       ARG  94   4.627   2.270   7.874
  746    HA   ARG  94           HA       ARG  94   7.113   2.376   6.334
  747    HB2  ARG  94           2HB      ARG  94   7.713   4.139   8.149
  748    HB3  ARG  94           1HB      ARG  94   6.645   4.576   6.830
  749    HG2  ARG  94           2HG      ARG  94   5.331   5.406   8.424
  750    HG3  ARG  94           1HG      ARG  94   4.872   3.738   8.733
  751    HD2  ARG  94           2HD      ARG  94   7.175   5.098  10.113
  752    HD3  ARG  94           1HD      ARG  94   5.533   5.099  10.748
  753    HE   ARG  94           HE       ARG  94   7.037   2.608  10.268
  754   HH11  ARG  94          1HH1      ARG  94   4.913   4.605  12.205
  755   HH12  ARG  94          2HH1      ARG  94   4.846   3.474  13.529
  756   HH21  ARG  94          1HH2      ARG  94   6.968   1.111  12.012
  757   HH22  ARG  94          2HH2      ARG  94   6.010   1.483  13.414
  758    H    TRP  95           HN       TRP  95   9.124   1.951   7.342
  759    HA   TRP  95           HA       TRP  95   8.880   0.198   9.702
  760    HB2  TRP  95           2HB      TRP  95   9.957  -0.378   7.029
  761    HB3  TRP  95           1HB      TRP  95  10.980  -0.896   8.370
  762    HD1  TRP  95           1HD      TRP  95   9.556  -2.370  10.317
  763    HE1  TRP  95           1HE      TRP  95   7.880  -4.277   9.903
  764    HE3  TRP  95           3HE      TRP  95   8.311  -1.305   5.479
  765    HZ2  TRP  95           2HZ      TRP  95   6.241  -5.202   7.803
  766    HZ3  TRP  95           3HZ      TRP  95   6.675  -2.748   4.341
  767    HH2  TRP  95           2HH      TRP  95   5.664  -4.654   5.481
  768    H    ARG  96           HN       ARG  96   9.982   0.974  11.336
  769    HA   ARG  96           HA       ARG  96  12.564   2.265  10.826
  770    HB2  ARG  96           2HB      ARG  96  11.092   3.586  12.237
  771    HB3  ARG  96           1HB      ARG  96  10.836   2.216  13.311
  772    HG2  ARG  96           2HG      ARG  96  13.059   2.293  14.096
  773    HG3  ARG  96           1HG      ARG  96  13.532   3.418  12.824
  774    HD2  ARG  96           2HD      ARG  96  12.211   5.166  13.800
  775    HD3  ARG  96           1HD      ARG  96  11.526   4.051  14.981
  776    HE   ARG  96           HE       ARG  96  13.721   3.899  16.000
  777   HH11  ARG  96          1HH1      ARG  96  13.241   6.502  13.698
  778   HH12  ARG  96          2HH1      ARG  96  14.495   7.496  14.373
  779   HH21  ARG  96          1HH2      ARG  96  15.385   5.205  16.882
  780   HH22  ARG  96          2HH2      ARG  96  15.706   6.770  16.187
  781    H    GLY  97           HN       GLY  97  14.082   0.767  10.687
  782    HA2  GLY  97           2HA      GLY  97  15.496  -0.766  12.019
  783    HA3  GLY  97           1HA      GLY  97  13.995  -1.510  12.567
  784    H    TYR  98           HN       TYR  98  12.515  -2.034  10.539
  785    HA   TYR  98           HA       TYR  98  12.123  -3.242   8.657
  786    HB2  TYR  98           2HB      TYR  98  13.523  -1.278   7.782
  787    HB3  TYR  98           1HB      TYR  98  14.872  -2.396   7.755
  788    HD1  TYR  98           2HD      TYR  98  11.308  -2.422   6.603
  789    HD2  TYR  98           1HD      TYR  98  15.386  -3.202   5.662
  790    HE1  TYR  98           2HE      TYR  98  10.647  -3.114   4.336
  791    HE2  TYR  98           1HE      TYR  98  14.737  -3.891   3.395
  792    HH   TYR  98           HH       TYR  98  12.801  -4.704   2.200
  793    H    LEU  99           HN       LEU  99  13.718  -4.863   7.067
  794    HA   LEU  99           HA       LEU  99  14.279  -7.086   8.732
  795    HB2  LEU  99           2HB      LEU  99  14.950  -6.514   5.847
  796    HB3  LEU  99           1HB      LEU  99  15.368  -8.020   6.637
  797    HG   LEU  99           HG       LEU  99  12.884  -8.303   7.115
  798   HD11  LEU  99          1HD1      LEU  99  12.679  -6.141   5.029
  799   HD12  LEU  99          2HD1      LEU  99  12.190  -6.002   6.716
  800   HD13  LEU  99          3HD1      LEU  99  11.347  -7.119   5.645
  801   HD21  LEU  99          3HD2      LEU  99  13.846  -8.284   4.263
  802   HD22  LEU  99          1HD2      LEU  99  12.444  -9.165   4.869
  803   HD23  LEU  99          2HD2      LEU  99  14.062  -9.587   5.432
  804    H    GLU 100           HN       GLU 100  16.591  -5.585   6.505
  805    HA   GLU 100           HA       GLU 100  18.461  -5.073   8.648
  806    HB2  GLU 100           2HB      GLU 100  18.972  -7.404   8.115
  807    HB3  GLU 100           1HB      GLU 100  19.130  -6.999   6.411
  808    HG2  GLU 100           2HG      GLU 100  21.315  -7.230   7.376
  809    HG3  GLU 100           1HG      GLU 100  21.040  -5.536   6.973
  810    H    HIS 101           HN       HIS 101  18.727  -2.971   8.193
  811    HA   HIS 101           HA       HIS 101  18.912  -1.998   5.494
  812    HB2  HIS 101           2HB      HIS 101  17.957  -0.603   7.306
  813    HB3  HIS 101           1HB      HIS 101  19.526  -0.584   8.105
  814    HD1  HIS 101           1HD      HIS 101  17.716   0.807   5.114
  815    HD2  HIS 101           2HD      HIS 101  21.379   1.225   7.050
  816    HE1  HIS 101           1HE      HIS 101  18.792   2.846   4.105
  817    HE2  HIS 101           2HE      HIS 101  21.019   3.062   5.253
  818    H    HIS 102           HN       HIS 102  20.661  -2.568   4.353
  819    HA   HIS 102           HA       HIS 102  23.287  -2.132   5.565
  820    HB2  HIS 102           2HB      HIS 102  24.141  -4.260   4.783
  821    HB3  HIS 102           1HB      HIS 102  22.744  -4.542   5.810
  822    HD1  HIS 102           1HD      HIS 102  20.594  -5.489   4.657
  823    HD2  HIS 102           2HD      HIS 102  23.868  -5.071   2.123
  824    HE1  HIS 102           1HE      HIS 102  20.016  -6.786   2.580
  825    HE2  HIS 102           2HE      HIS 102  22.085  -6.669   1.149
  826    H    HIS 103           HN       HIS 103  24.669  -1.141   4.260
  827    HA   HIS 103           HA       HIS 103  23.960  -0.727   1.469
  828    HB2  HIS 103           2HB      HIS 103  25.717   0.564   3.419
  829    HB3  HIS 103           1HB      HIS 103  26.471   0.374   1.841
  830    HD1  HIS 103           1HD      HIS 103  24.096   2.445   3.693
  831    HD2  HIS 103           2HD      HIS 103  24.993   1.663  -0.291
  832    HE1  HIS 103           1HE      HIS 103  23.078   4.335   2.383
  833    HE2  HIS 103           2HE      HIS 103  23.894   3.983   0.025
  834    H    HIS 104           HN       HIS 104  26.942  -1.700   3.153
  835    HA   HIS 104           HA       HIS 104  28.631  -3.117   2.600
  836    HB2  HIS 104           2HB      HIS 104  26.578  -4.694   2.627
  837    HB3  HIS 104           1HB      HIS 104  26.689  -4.648   0.872
  838    HD1  HIS 104           1HD      HIS 104  28.557  -5.835   3.920
  839    HD2  HIS 104           2HD      HIS 104  28.695  -6.222  -0.222
  840    HE1  HIS 104           1HE      HIS 104  30.199  -7.686   3.462
  841    HE2  HIS 104           2HE      HIS 104  30.166  -7.996   0.962
  842    H    HIS 105           HN       HIS 105  27.818  -0.829   0.886
  843    HA   HIS 105           HA       HIS 105  29.715  -0.992  -1.173
  844    HB2  HIS 105           2HB      HIS 105  27.917  -2.546  -2.103
  845    HB3  HIS 105           1HB      HIS 105  26.868  -1.135  -2.190
  846    HD1  HIS 105           1HD      HIS 105  27.346   0.597  -4.064
  847    HD2  HIS 105           2HD      HIS 105  29.949  -2.650  -4.016
  848    HE1  HIS 105           1HE      HIS 105  28.605   0.698  -6.239
  849    HE2  HIS 105           2HE      HIS 105  30.048  -1.373  -6.260
  850    H    HIS 106           HN       HIS 106  30.286   1.087  -1.396
  851    HA   HIS 106           HA       HIS 106  28.158   3.096  -1.474
  852    HB2  HIS 106           2HB      HIS 106  29.378   4.625  -0.018
  853    HB3  HIS 106           1HB      HIS 106  29.029   3.129   0.829
  854    HD1  HIS 106           1HD      HIS 106  31.098   1.506   1.232
  855    HD2  HIS 106           2HD      HIS 106  32.032   5.310  -0.167
  856    HE1  HIS 106           1HE      HIS 106  33.544   1.817   1.698
  857    HE2  HIS 106           2HE      HIS 106  34.066   4.162   0.952
  Start of MODEL   11
    1    H1   MET   1           H1       MET   1 -16.073   2.616   5.052
    2    H2   MET   1           H2       MET   1 -16.116   4.309   5.038
    3    H3   MET   1           H3       MET   1 -14.991   3.494   6.014
    4    HA   MET   1           HA       MET   1 -15.056   3.455   3.055
    5    HB2  MET   1           2HB      MET   1 -14.315   5.615   3.935
    6    HB3  MET   1           1HB      MET   1 -13.165   4.810   4.994
    7    HG2  MET   1           2HG      MET   1 -11.950   5.655   3.145
    8    HG3  MET   1           1HG      MET   1 -12.040   3.909   2.957
    9    HE1  MET   1           2HE      MET   1 -13.504   7.363   1.771
   10    HE2  MET   1           3HE      MET   1 -14.931   6.480   2.313
   11    HE3  MET   1           1HE      MET   1 -14.713   6.839   0.601
   12    H    THR   2           HN       THR   2 -14.029   1.776   2.183
   13    HA   THR   2           HA       THR   2 -12.420   0.081   3.956
   14    HB   THR   2           HB       THR   2 -12.515  -1.597   2.141
   15    HG1  THR   2           1HG      THR   2 -14.360   0.170   0.862
   16   HG21  THR   2          3HG2      THR   2 -15.225  -0.510   2.907
   17   HG22  THR   2          1HG2      THR   2 -14.228  -1.575   3.899
   18   HG23  THR   2          2HG2      THR   2 -14.877  -2.153   2.364
   19    H    PHE   3           HN       PHE   3 -10.396  -0.862   2.985
   20    HA   PHE   3           HA       PHE   3  -8.666   1.232   2.225
   21    HB2  PHE   3           2HB      PHE   3  -7.909  -0.793   3.419
   22    HB3  PHE   3           1HB      PHE   3  -8.225  -1.754   1.978
   23    HD1  PHE   3           2HD      PHE   3  -6.204   1.119   3.198
   24    HD2  PHE   3           1HD      PHE   3  -6.561  -2.050   0.383
   25    HE1  PHE   3           2HE      PHE   3  -3.925   1.583   2.391
   26    HE2  PHE   3           1HE      PHE   3  -4.284  -1.590  -0.430
   27    HZ   PHE   3           HZ       PHE   3  -2.963   0.227   0.574
   28    H    SER   4           HN       SER   4 -10.362  -1.236   0.380
   29    HA   SER   4           HA       SER   4  -9.117  -0.821  -2.100
   30    HB2  SER   4           2HB      SER   4 -10.561  -2.761  -1.639
   31    HB3  SER   4           1HB      SER   4 -11.960  -1.692  -1.525
   32    HG   SER   4           HG       SER   4 -10.640  -1.293  -3.847
   33    H    GLU   5           HN       GLU   5 -12.034   0.643  -0.693
   34    HA   GLU   5           HA       GLU   5 -12.678   2.306  -2.863
   35    HB2  GLU   5           2HB      GLU   5 -13.230   2.524   0.091
   36    HB3  GLU   5           1HB      GLU   5 -13.921   3.609  -1.097
   37    HG2  GLU   5           2HG      GLU   5 -15.104   1.812  -2.140
   38    HG3  GLU   5           1HG      GLU   5 -14.293   0.632  -1.109
   39    H    CYS   6           HN       CYS   6 -10.824   2.900   0.089
   40    HA   CYS   6           HA       CYS   6 -10.316   5.626  -0.329
   41    HB2  CYS   6           2HB      CYS   6  -9.985   4.287   1.789
   42    HB3  CYS   6           1HB      CYS   6  -8.492   3.695   1.095
   43    HG   CYS   6           HG       CYS   6  -7.803   6.619   0.702
   44    H    ALA   7           HN       ALA   7  -8.392   2.765  -1.129
   45    HA   ALA   7           HA       ALA   7  -6.208   4.055  -2.312
   46    HB1  ALA   7           1HB      ALA   7  -7.383   1.384  -3.074
   47    HB2  ALA   7           2HB      ALA   7  -6.240   1.665  -1.761
   48    HB3  ALA   7           3HB      ALA   7  -5.751   1.947  -3.432
   49    H    ALA   8           HN       ALA   8  -9.289   3.016  -3.727
   50    HA   ALA   8           HA       ALA   8  -8.715   3.743  -6.382
   51    HB1  ALA   8           1HB      ALA   8 -11.407   3.693  -5.023
   52    HB2  ALA   8           2HB      ALA   8 -10.597   2.300  -5.740
   53    HB3  ALA   8           3HB      ALA   8 -11.106   3.645  -6.760
   54    H    LEU   9           HN       LEU   9  -9.984   5.568  -3.655
   55    HA   LEU   9           HA       LEU   9 -10.671   7.919  -5.055
   56    HB2  LEU   9           2HB      LEU   9  -9.729   7.646  -2.199
   57    HB3  LEU   9           1HB      LEU   9 -10.536   9.042  -2.875
   58    HG   LEU   9           HG       LEU   9 -11.756   6.302  -2.537
   59   HD11  LEU   9          1HD1      LEU   9 -11.458   7.442  -0.422
   60   HD12  LEU   9          2HD1      LEU   9 -13.164   7.423  -0.868
   61   HD13  LEU   9          3HD1      LEU   9 -12.216   8.896  -1.072
   62   HD21  LEU   9          3HD2      LEU   9 -13.836   7.363  -3.239
   63   HD22  LEU   9          1HD2      LEU   9 -12.618   7.464  -4.510
   64   HD23  LEU   9          2HD2      LEU   9 -12.979   8.879  -3.521
   65    H    TYR  10           HN       TYR  10  -7.683   6.894  -3.461
   66    HA   TYR  10           HA       TYR  10  -6.170   9.213  -3.815
   67    HB2  TYR  10           2HB      TYR  10  -5.442   7.294  -2.453
   68    HB3  TYR  10           1HB      TYR  10  -5.238   6.335  -3.909
   69    HD1  TYR  10           2HD      TYR  10  -3.933   9.256  -2.055
   70    HD2  TYR  10           1HD      TYR  10  -3.251   6.473  -5.199
   71    HE1  TYR  10           2HE      TYR  10  -1.610  10.030  -2.228
   72    HE2  TYR  10           1HE      TYR  10  -0.924   7.248  -5.383
   73    HH   TYR  10           HH       TYR  10   0.529   9.275  -3.035
   74    H    ILE  11           HN       ILE  11  -6.650   6.451  -5.934
   75    HA   ILE  11           HA       ILE  11  -4.994   7.306  -8.055
   76    HB   ILE  11           HB       ILE  11  -7.402   5.481  -8.057
   77   HG12  ILE  11          2HG1      ILE  11  -4.441   4.863  -8.065
   78   HG13  ILE  11          1HG1      ILE  11  -5.482   4.786  -6.648
   79   HG21  ILE  11          1HG2      ILE  11  -5.317   5.853 -10.205
   80   HG22  ILE  11          2HG2      ILE  11  -7.003   6.360 -10.302
   81   HG23  ILE  11          3HG2      ILE  11  -6.604   4.644 -10.209
   82   HD11  ILE  11          3HD1      ILE  11  -6.794   3.025  -7.716
   83   HD12  ILE  11          1HD1      ILE  11  -5.093   2.581  -7.568
   84   HD13  ILE  11          2HD1      ILE  11  -5.736   3.100  -9.125
   85    H    LYS  12           HN       LYS  12  -8.514   7.606  -7.547
   86    HA   LYS  12           HA       LYS  12  -8.997   8.916 -10.008
   87    HB2  LYS  12           2HB      LYS  12 -10.652   8.630  -7.516
   88    HB3  LYS  12           1HB      LYS  12 -11.219   9.538  -8.911
   89    HG2  LYS  12           2HG      LYS  12 -10.831   7.481 -10.286
   90    HG3  LYS  12           1HG      LYS  12 -10.536   6.616  -8.777
   91    HD2  LYS  12           2HD      LYS  12 -12.766   7.153  -7.996
   92    HD3  LYS  12           1HD      LYS  12 -13.065   8.124  -9.436
   93    HE2  LYS  12           2HE      LYS  12 -12.810   6.116 -10.830
   94    HE3  LYS  12           1HE      LYS  12 -12.539   5.154  -9.379
   95    HZ1  LYS  12           3HZ      LYS  12 -15.024   6.664  -9.998
   96    HZ2  LYS  12           1HZ      LYS  12 -14.760   5.702  -8.623
   97    HZ3  LYS  12           2HZ      LYS  12 -14.825   4.991 -10.163
   98    H    ALA  13           HN       ALA  13  -8.235  10.135  -6.804
   99    HA   ALA  13           HA       ALA  13  -8.930  12.832  -7.262
  100    HB1  ALA  13           1HB      ALA  13  -7.554  13.351  -5.338
  101    HB2  ALA  13           2HB      ALA  13  -6.778  11.770  -5.433
  102    HB3  ALA  13           3HB      ALA  13  -8.491  11.888  -5.028
  103    H    HIS  14           HN       HIS  14  -6.444  10.957  -8.605
  104    HA   HIS  14           HA       HIS  14  -4.986  13.395  -9.412
  105    HB2  HIS  14           2HB      HIS  14  -3.876  10.622  -8.915
  106    HB3  HIS  14           1HB      HIS  14  -2.957  11.945  -9.620
  107    HD1  HIS  14           1HD      HIS  14  -4.256  10.645  -6.385
  108    HD2  HIS  14           2HD      HIS  14  -2.188  13.962  -7.803
  109    HE1  HIS  14           1HE      HIS  14  -3.320  11.783  -4.348
  110    HE2  HIS  14           2HE      HIS  14  -1.877  13.635  -5.257
  111    H    ARG  15           HN       ARG  15  -7.145  11.329 -10.543
  112    HA   ARG  15           HA       ARG  15  -5.941   9.776 -12.532
  113    HB2  ARG  15           2HB      ARG  15  -8.166   9.342 -13.335
  114    HB3  ARG  15           1HB      ARG  15  -8.194   9.407 -11.579
  115    HG2  ARG  15           2HG      ARG  15  -9.026  11.738 -11.734
  116    HG3  ARG  15           1HG      ARG  15  -9.120  11.542 -13.483
  117    HD2  ARG  15           2HD      ARG  15 -10.582   9.859 -11.457
  118    HD3  ARG  15           1HD      ARG  15 -11.283  11.194 -12.368
  119    HE   ARG  15           HE       ARG  15 -10.221   8.761 -13.675
  120   HH11  ARG  15          1HH1      ARG  15 -12.656  11.245 -13.299
  121   HH12  ARG  15          2HH1      ARG  15 -13.667  10.635 -14.570
  122   HH21  ARG  15          1HH2      ARG  15 -11.564   7.938 -15.339
  123   HH22  ARG  15          2HH2      ARG  15 -13.072   8.730 -15.705
  124    H    SER  16           HN       SER  16  -6.824  13.158 -12.674
  125    HA   SER  16           HA       SER  16  -6.936  13.266 -15.527
  126    HB2  SER  16           2HB      SER  16  -6.594  15.479 -13.485
  127    HB3  SER  16           1HB      SER  16  -7.002  15.696 -15.180
  128    HG   SER  16           HG       SER  16  -9.001  15.329 -14.703
  129    H    SER  17           HN       SER  17  -4.495  14.121 -13.093
  130    HA   SER  17           HA       SER  17  -2.445  14.650 -15.016
  131    HB2  SER  17           2HB      SER  17  -2.064  13.764 -12.150
  132    HB3  SER  17           1HB      SER  17  -1.004  14.778 -13.121
  133    HG   SER  17           HG       SER  17  -3.129  16.144 -13.153
  134    H    TRP  18           HN       TRP  18  -4.049  11.994 -13.881
  135    HA   TRP  18           HA       TRP  18  -1.881  10.094 -14.344
  136    HB2  TRP  18           2HB      TRP  18  -4.180  10.221 -12.515
  137    HB3  TRP  18           1HB      TRP  18  -3.884   8.645 -13.231
  138    HD1  TRP  18           1HD      TRP  18  -0.989  10.971 -12.251
  139    HE1  TRP  18           1HE      TRP  18   0.308   9.831 -10.329
  140    HE3  TRP  18           3HE      TRP  18  -4.143   7.096 -11.439
  141    HZ2  TRP  18           2HZ      TRP  18  -0.008   7.528  -8.681
  142    HZ3  TRP  18           3HZ      TRP  18  -3.596   5.439  -9.698
  143    HH2  TRP  18           2HH      TRP  18  -1.578   5.662  -8.339
  144    H    LYS  19           HN       LYS  19  -2.769  10.841 -16.718
  145    HA   LYS  19           HA       LYS  19  -4.630   9.390 -18.042
  146    HB2  LYS  19           2HB      LYS  19  -1.672   9.458 -18.741
  147    HB3  LYS  19           1HB      LYS  19  -2.975   9.073 -19.855
  148    HG2  LYS  19           2HG      LYS  19  -2.516  11.728 -18.506
  149    HG3  LYS  19           1HG      LYS  19  -2.195  11.343 -20.196
  150    HD2  LYS  19           2HD      LYS  19  -4.588  10.889 -20.528
  151    HD3  LYS  19           1HD      LYS  19  -4.892  11.323 -18.846
  152    HE2  LYS  19           2HE      LYS  19  -3.706  13.165 -20.919
  153    HE3  LYS  19           1HE      LYS  19  -5.401  13.149 -20.442
  154    HZ1  LYS  19           3HZ      LYS  19  -3.062  13.896 -18.773
  155    HZ2  LYS  19           1HZ      LYS  19  -4.609  13.627 -18.131
  156    HZ3  LYS  19           2HZ      LYS  19  -4.362  14.872 -19.246
  157    H    ASN  20           HN       ASN  20  -4.647   6.392 -16.902
  158    HA   ASN  20           HA       ASN  20  -6.001   6.165 -18.688
  159    HB2  ASN  20           2HB      ASN  20  -6.000   8.703 -18.880
  160    HB3  ASN  20           1HB      ASN  20  -4.651   8.547 -19.994
  161   HD21  ASN  20          1HD2      ASN  20  -5.022   7.923 -22.081
  162   HD22  ASN  20          2HD2      ASN  20  -6.606   7.691 -22.735
  163    H    THR  21           HN       THR  21  -2.892   5.926 -18.329
  164    HA   THR  21           HA       THR  21  -2.552   4.147 -20.647
  165    HB   THR  21           HB       THR  21  -0.134   4.149 -20.017
  166    HG1  THR  21           1HG      THR  21  -0.670   6.377 -18.349
  167   HG21  THR  21          3HG2      THR  21  -0.866   5.690 -21.751
  168   HG22  THR  21          1HG2      THR  21   0.383   6.449 -20.764
  169   HG23  THR  21          2HG2      THR  21  -1.311   6.885 -20.533
  170    H    LYS  22           HN       LYS  22  -0.757   2.335 -19.495
  171    HA   LYS  22           HA       LYS  22  -2.536   0.927 -17.731
  172    HB2  LYS  22           2HB      LYS  22   0.203   0.239 -18.777
  173    HB3  LYS  22           1HB      LYS  22  -0.717  -0.809 -17.706
  174    HG2  LYS  22           2HG      LYS  22  -2.537  -0.831 -19.403
  175    HG3  LYS  22           1HG      LYS  22  -1.463   0.056 -20.488
  176    HD2  LYS  22           2HD      LYS  22  -0.917  -2.652 -19.278
  177    HD3  LYS  22           1HD      LYS  22  -1.410  -2.345 -20.944
  178    HE2  LYS  22           2HE      LYS  22   1.109  -1.284 -19.674
  179    HE3  LYS  22           1HE      LYS  22   1.029  -2.732 -20.674
  180    HZ1  LYS  22           3HZ      LYS  22   0.324  -1.412 -22.534
  181    HZ2  LYS  22           1HZ      LYS  22   1.749  -0.744 -21.900
  182    HZ3  LYS  22           2HZ      LYS  22   0.256  -0.010 -21.579
  183    H    HIS  23           HN       HIS  23  -0.439   3.361 -17.057
  184    HA   HIS  23           HA       HIS  23   0.980   2.464 -14.802
  185    HB2  HIS  23           2HB      HIS  23  -0.024   5.191 -15.596
  186    HB3  HIS  23           1HB      HIS  23   0.825   4.936 -14.077
  187    HD1  HIS  23           1HD      HIS  23   3.330   4.893 -14.154
  188    HD2  HIS  23           2HD      HIS  23   1.602   4.684 -17.938
  189    HE1  HIS  23           1HE      HIS  23   5.224   5.173 -15.788
  190    HE2  HIS  23           2HE      HIS  23   4.107   5.305 -18.043
  191    H    ALA  24           HN       ALA  24  -2.248   3.924 -15.049
  192    HA   ALA  24           HA       ALA  24  -2.832   3.893 -12.282
  193    HB1  ALA  24           1HB      ALA  24  -5.153   4.205 -12.972
  194    HB2  ALA  24           2HB      ALA  24  -4.724   3.799 -14.633
  195    HB3  ALA  24           3HB      ALA  24  -4.074   5.258 -13.888
  196    H    ASP  25           HN       ASP  25  -3.268   1.531 -14.873
  197    HA   ASP  25           HA       ASP  25  -4.819  -0.320 -13.379
  198    HB2  ASP  25           2HB      ASP  25  -4.619  -0.313 -15.877
  199    HB3  ASP  25           1HB      ASP  25  -2.983  -0.934 -15.707
  200    H    GLN  26           HN       GLN  26  -1.352  -0.008 -14.009
  201    HA   GLN  26           HA       GLN  26  -0.459  -2.269 -12.660
  202    HB2  GLN  26           2HB      GLN  26   0.757   0.419 -13.228
  203    HB3  GLN  26           1HB      GLN  26   1.622  -0.749 -12.253
  204    HG2  GLN  26           2HG      GLN  26   1.433  -2.370 -14.123
  205    HG3  GLN  26           1HG      GLN  26   0.711  -1.092 -15.092
  206   HE21  GLN  26          1HE2      GLN  26   1.989   0.545 -15.883
  207   HE22  GLN  26          2HE2      GLN  26   3.717   0.494 -15.833
  208    H    TRP  27           HN       TRP  27  -1.226   0.963 -11.440
  209    HA   TRP  27           HA       TRP  27  -0.509   0.467  -8.750
  210    HB2  TRP  27           2HB      TRP  27  -2.158   2.495 -10.178
  211    HB3  TRP  27           1HB      TRP  27  -2.379   2.342  -8.439
  212    HD1  TRP  27           1HD      TRP  27   0.538   2.936 -10.937
  213    HE1  TRP  27           1HE      TRP  27   2.240   4.494  -9.788
  214    HE3  TRP  27           3HE      TRP  27  -1.696   3.328  -6.364
  215    HZ2  TRP  27           2HZ      TRP  27   2.582   5.724  -7.258
  216    HZ3  TRP  27           3HZ      TRP  27  -0.626   4.708  -4.633
  217    HH2  TRP  27           2HH      TRP  27   1.468   5.881  -5.070
  218    H    THR  28           HN       THR  28  -3.621   0.294 -10.443
  219    HA   THR  28           HA       THR  28  -5.147  -0.352  -8.158
  220    HB   THR  28           HB       THR  28  -5.830  -0.988 -11.034
  221    HG1  THR  28           1HG      THR  28  -5.211   1.273 -10.577
  222   HG21  THR  28          3HG2      THR  28  -7.322  -2.006  -9.367
  223   HG22  THR  28          1HG2      THR  28  -8.144  -0.739 -10.281
  224   HG23  THR  28          2HG2      THR  28  -7.586  -0.422  -8.639
  225    H    ASN  29           HN       ASN  29  -3.832  -2.386 -10.769
  226    HA   ASN  29           HA       ASN  29  -5.238  -4.714 -10.087
  227    HB2  ASN  29           2HB      ASN  29  -4.032  -4.147 -12.269
  228    HB3  ASN  29           1HB      ASN  29  -2.556  -4.671 -11.468
  229   HD21  ASN  29          1HD2      ASN  29  -4.006  -5.743 -13.793
  230   HD22  ASN  29          2HD2      ASN  29  -4.305  -7.405 -13.423
  231    H    THR  30           HN       THR  30  -1.872  -3.792  -9.307
  232    HA   THR  30           HA       THR  30  -1.206  -6.199  -8.029
  233    HB   THR  30           HB       THR  30  -0.044  -3.486  -7.390
  234    HG1  THR  30           1HG      THR  30   0.642  -5.347  -9.446
  235   HG21  THR  30          3HG2      THR  30   1.993  -4.785  -6.896
  236   HG22  THR  30          1HG2      THR  30   1.103  -6.276  -7.203
  237   HG23  THR  30          2HG2      THR  30   0.653  -5.242  -5.848
  238    H    ILE  31           HN       ILE  31  -2.378  -3.121  -6.679
  239    HA   ILE  31           HA       ILE  31  -2.261  -3.985  -3.985
  240    HB   ILE  31           HB       ILE  31  -3.898  -1.752  -5.207
  241   HG12  ILE  31          2HG1      ILE  31  -1.221  -1.693  -3.791
  242   HG13  ILE  31          1HG1      ILE  31  -1.453  -1.537  -5.528
  243   HG21  ILE  31          1HG2      ILE  31  -3.209  -2.291  -2.319
  244   HG22  ILE  31          2HG2      ILE  31  -4.809  -2.398  -3.052
  245   HG23  ILE  31          3HG2      ILE  31  -3.999  -0.836  -2.927
  246   HD11  ILE  31          3HD1      ILE  31  -2.426   0.371  -3.419
  247   HD12  ILE  31          1HD1      ILE  31  -2.743   0.518  -5.148
  248   HD13  ILE  31          2HD1      ILE  31  -1.089   0.627  -4.542
  249    H    LYS  32           HN       LYS  32  -4.859  -3.887  -6.382
  250    HA   LYS  32           HA       LYS  32  -6.948  -4.726  -4.695
  251    HB2  LYS  32           2HB      LYS  32  -7.202  -3.780  -7.012
  252    HB3  LYS  32           1HB      LYS  32  -6.670  -5.332  -7.641
  253    HG2  LYS  32           2HG      LYS  32  -8.575  -6.368  -6.349
  254    HG3  LYS  32           1HG      LYS  32  -9.165  -4.726  -6.088
  255    HD2  LYS  32           2HD      LYS  32  -9.310  -4.387  -8.499
  256    HD3  LYS  32           1HD      LYS  32  -8.678  -6.013  -8.773
  257    HE2  LYS  32           2HE      LYS  32 -10.636  -6.877  -7.454
  258    HE3  LYS  32           1HE      LYS  32 -11.295  -5.244  -7.497
  259    HZ1  LYS  32           3HZ      LYS  32 -11.260  -5.367  -9.935
  260    HZ2  LYS  32           1HZ      LYS  32 -12.240  -6.571  -9.244
  261    HZ3  LYS  32           2HZ      LYS  32 -10.703  -6.965  -9.844
  262    H    THR  33           HN       THR  33  -4.481  -6.481  -6.427
  263    HA   THR  33           HA       THR  33  -5.797  -9.023  -6.094
  264    HB   THR  33           HB       THR  33  -3.029  -8.392  -7.135
  265    HG1  THR  33           1HG      THR  33  -4.352  -7.600  -8.651
  266   HG21  THR  33          3HG2      THR  33  -4.668 -10.926  -7.320
  267   HG22  THR  33          1HG2      THR  33  -3.210 -10.708  -6.352
  268   HG23  THR  33          2HG2      THR  33  -3.118 -10.643  -8.110
  269    H    TYR  34           HN       TYR  34  -2.781  -7.560  -4.811
  270    HA   TYR  34           HA       TYR  34  -2.379  -9.839  -3.099
  271    HB2  TYR  34           2HB      TYR  34  -0.889  -7.251  -3.449
  272    HB3  TYR  34           1HB      TYR  34  -0.460  -8.419  -2.199
  273    HD1  TYR  34           2HD      TYR  34   0.155 -10.765  -2.909
  274    HD2  TYR  34           1HD      TYR  34  -0.162  -7.553  -5.677
  275    HE1  TYR  34           2HE      TYR  34   1.476 -12.046  -4.536
  276    HE2  TYR  34           1HE      TYR  34   1.154  -8.829  -7.316
  277    HH   TYR  34           HH       TYR  34   1.724 -12.121  -7.029
  278    H    CYS  35           HN       CYS  35  -3.265  -6.434  -2.563
  279    HA   CYS  35           HA       CYS  35  -3.482  -6.923   0.296
  280    HB2  CYS  35           2HB      CYS  35  -3.972  -4.372  -1.258
  281    HB3  CYS  35           1HB      CYS  35  -3.817  -4.518   0.490
  282    HG   CYS  35           HG       CYS  35  -1.104  -5.574   0.131
  283    H    GLY  36           HN       GLY  36  -5.525  -6.545  -2.476
  284    HA2  GLY  36           2HA      GLY  36  -7.910  -5.649  -1.457
  285    HA3  GLY  36           1HA      GLY  36  -7.782  -6.792  -2.780
  286    HA   PRO  37           HA       PRO  37  -9.552 -10.159  -0.594
  287    HB2  PRO  37           2HB      PRO  37  -6.943 -11.567  -0.321
  288    HB3  PRO  37           1HB      PRO  37  -8.475 -12.144  -0.991
  289    HG2  PRO  37           2HG      PRO  37  -6.474 -11.486  -2.603
  290    HG3  PRO  37           1HG      PRO  37  -8.147 -11.068  -3.020
  291    HD2  PRO  37           2HD      PRO  37  -5.965  -9.324  -1.951
  292    HD3  PRO  37           1HD      PRO  37  -7.219  -8.957  -3.154
  293    H    VAL  38           HN       VAL  38  -6.626  -8.880   0.854
  294    HA   VAL  38           HA       VAL  38  -7.285 -10.092   3.425
  295    HB   VAL  38           HB       VAL  38  -4.905  -8.349   2.780
  296   HG11  VAL  38          1HG1      VAL  38  -3.948  -9.368   4.796
  297   HG12  VAL  38          2HG1      VAL  38  -5.461 -10.235   5.069
  298   HG13  VAL  38          3HG1      VAL  38  -5.425  -8.473   5.146
  299   HG21  VAL  38          3HG2      VAL  38  -3.622 -10.411   2.561
  300   HG22  VAL  38          1HG2      VAL  38  -4.916 -10.344   1.366
  301   HG23  VAL  38          2HG2      VAL  38  -5.090 -11.360   2.796
  302    H    ILE  39           HN       ILE  39  -6.146  -6.814   2.563
  303    HA   ILE  39           HA       ILE  39  -7.748  -5.809   4.813
  304    HB   ILE  39           HB       ILE  39  -6.300  -3.800   4.716
  305   HG12  ILE  39          2HG1      ILE  39  -4.728  -5.389   2.671
  306   HG13  ILE  39          1HG1      ILE  39  -5.695  -3.961   2.320
  307   HG21  ILE  39          1HG2      ILE  39  -4.840  -6.422   5.002
  308   HG22  ILE  39          2HG2      ILE  39  -5.774  -5.603   6.253
  309   HG23  ILE  39          3HG2      ILE  39  -4.292  -4.871   5.636
  310   HD11  ILE  39          3HD1      ILE  39  -3.347  -3.398   2.445
  311   HD12  ILE  39          1HD1      ILE  39  -3.253  -4.071   4.071
  312   HD13  ILE  39          2HD1      ILE  39  -4.228  -2.633   3.768
  313    H    GLY  40           HN       GLY  40  -8.102  -6.124   1.610
  314    HA2  GLY  40           2HA      GLY  40  -8.720  -3.614   0.581
  315    HA3  GLY  40           1HA      GLY  40  -9.417  -5.126   0.026
  316    HA   PRO  41           HA       PRO  41 -13.303  -3.998   1.788
  317    HB2  PRO  41           2HB      PRO  41 -13.794  -6.471   3.218
  318    HB3  PRO  41           1HB      PRO  41 -14.478  -5.925   1.685
  319    HG2  PRO  41           2HG      PRO  41 -12.733  -8.015   1.897
  320    HG3  PRO  41           1HG      PRO  41 -12.892  -7.013   0.444
  321    HD2  PRO  41           2HD      PRO  41 -10.834  -6.894   2.616
  322    HD3  PRO  41           1HD      PRO  41 -10.631  -6.726   0.858
  323    H    LEU  42           HN       LEU  42 -10.769  -4.580   3.868
  324    HA   LEU  42           HA       LEU  42 -12.208  -4.099   6.324
  325    HB2  LEU  42           2HB      LEU  42  -9.247  -4.095   5.709
  326    HB3  LEU  42           1HB      LEU  42  -9.924  -3.872   7.310
  327    HG   LEU  42           HG       LEU  42 -10.139  -6.363   5.616
  328   HD11  LEU  42          1HD1      LEU  42  -7.931  -6.049   6.590
  329   HD12  LEU  42          2HD1      LEU  42  -8.779  -7.375   7.387
  330   HD13  LEU  42          3HD1      LEU  42  -8.651  -5.806   8.182
  331   HD21  LEU  42          3HD2      LEU  42 -11.249  -7.363   7.547
  332   HD22  LEU  42          1HD2      LEU  42 -12.174  -5.997   6.921
  333   HD23  LEU  42          2HD2      LEU  42 -11.207  -5.810   8.385
  334    H    SER  43           HN       SER  43 -11.785  -2.171   7.645
  335    HA   SER  43           HA       SER  43 -12.164   0.203   6.151
  336    HB2  SER  43           2HB      SER  43 -13.042  -0.152   8.454
  337    HB3  SER  43           1HB      SER  43 -11.396  -0.063   9.065
  338    HG   SER  43           HG       SER  43 -13.075   1.949   8.161
  339    H    VAL  44           HN       VAL  44 -10.791   1.927   5.778
  340    HA   VAL  44           HA       VAL  44  -8.009   1.453   5.600
  341    HB   VAL  44           HB       VAL  44  -9.201   3.126   4.215
  342   HG11  VAL  44          1HG1      VAL  44  -9.779   5.309   5.119
  343   HG12  VAL  44          2HG1      VAL  44  -9.298   4.785   6.732
  344   HG13  VAL  44          3HG1      VAL  44 -10.678   4.031   5.938
  345   HG21  VAL  44          3HG2      VAL  44  -6.939   4.279   5.844
  346   HG22  VAL  44          1HG2      VAL  44  -7.481   4.856   4.267
  347   HG23  VAL  44          2HG2      VAL  44  -6.781   3.245   4.423
  348    H    GLN  45           HN       GLN  45 -10.072   2.368   8.153
  349    HA   GLN  45           HA       GLN  45  -8.153   3.521   9.905
  350    HB2  GLN  45           2HB      GLN  45 -10.832   2.201  10.361
  351    HB3  GLN  45           1HB      GLN  45  -9.908   2.995  11.618
  352    HG2  GLN  45           2HG      GLN  45 -10.705   4.433   9.124
  353    HG3  GLN  45           1HG      GLN  45 -11.792   4.297  10.505
  354   HE21  GLN  45          1HE2      GLN  45 -11.768   6.522  10.768
  355   HE22  GLN  45          2HE2      GLN  45 -10.407   7.346  11.464
  356    H    ASP  46           HN       ASP  46  -9.242   0.279   9.141
  357    HA   ASP  46           HA       ASP  46  -8.042  -0.846  11.516
  358    HB2  ASP  46           2HB      ASP  46  -9.784  -1.876   9.349
  359    HB3  ASP  46           1HB      ASP  46  -8.761  -3.038  10.195
  360    H    VAL  47           HN       VAL  47  -6.828  -0.016   8.524
  361    HA   VAL  47           HA       VAL  47  -5.053  -2.164   8.053
  362    HB   VAL  47           HB       VAL  47  -4.617   0.755   7.376
  363   HG11  VAL  47          1HG1      VAL  47  -3.426  -1.757   6.206
  364   HG12  VAL  47          2HG1      VAL  47  -2.586  -0.578   7.217
  365   HG13  VAL  47          3HG1      VAL  47  -3.157  -0.119   5.612
  366   HG21  VAL  47          3HG2      VAL  47  -6.719   0.016   6.448
  367   HG22  VAL  47          1HG2      VAL  47  -5.963  -1.445   5.811
  368   HG23  VAL  47          2HG2      VAL  47  -5.524   0.131   5.155
  369    H    ASP  48           HN       ASP  48  -3.643  -2.888   9.489
  370    HA   ASP  48           HA       ASP  48  -2.095  -0.952  11.072
  371    HB2  ASP  48           2HB      ASP  48  -3.701  -1.809  12.612
  372    HB3  ASP  48           1HB      ASP  48  -3.485  -3.451  12.030
  373    H    THR  49           HN       THR  49  -0.154  -2.007  12.063
  374    HA   THR  49           HA       THR  49   1.530  -2.850   9.996
  375    HB   THR  49           HB       THR  49   2.059  -3.221  12.947
  376    HG1  THR  49           1HG      THR  49   2.734  -0.903  11.475
  377   HG21  THR  49          3HG2      THR  49   3.722  -4.211  11.438
  378   HG22  THR  49          1HG2      THR  49   4.385  -2.827  12.308
  379   HG23  THR  49          2HG2      THR  49   3.902  -2.659  10.619
  380    H    LYS  50           HN       LYS  50  -0.085  -4.698  12.553
  381    HA   LYS  50           HA       LYS  50   1.210  -7.152  12.184
  382    HB2  LYS  50           2HB      LYS  50  -0.377  -6.435  14.046
  383    HB3  LYS  50           1HB      LYS  50  -1.694  -6.794  12.946
  384    HG2  LYS  50           2HG      LYS  50   0.366  -8.834  13.737
  385    HG3  LYS  50           1HG      LYS  50  -1.117  -8.559  14.648
  386    HD2  LYS  50           2HD      LYS  50  -2.414  -9.052  12.588
  387    HD3  LYS  50           1HD      LYS  50  -0.900  -9.433  11.766
  388    HE2  LYS  50           2HE      LYS  50  -2.096 -10.860  14.138
  389    HE3  LYS  50           1HE      LYS  50  -1.941 -11.477  12.494
  390    HZ1  LYS  50           3HZ      LYS  50  -0.201 -12.425  13.732
  391    HZ2  LYS  50           1HZ      LYS  50   0.221 -10.946  14.450
  392    HZ3  LYS  50           2HZ      LYS  50   0.526 -11.208  12.802
  393    H    LEU  51           HN       LEU  51  -1.685  -5.802  10.667
  394    HA   LEU  51           HA       LEU  51  -2.335  -8.069   9.112
  395    HB2  LEU  51           2HB      LEU  51  -3.006  -5.154   8.732
  396    HB3  LEU  51           1HB      LEU  51  -3.741  -6.464   7.838
  397    HG   LEU  51           HG       LEU  51  -3.971  -5.982  10.801
  398   HD11  LEU  51          1HD1      LEU  51  -6.014  -5.794   8.595
  399   HD12  LEU  51          2HD1      LEU  51  -5.273  -4.430   9.431
  400   HD13  LEU  51          3HD1      LEU  51  -6.318  -5.544  10.314
  401   HD21  LEU  51          3HD2      LEU  51  -3.933  -8.367  10.320
  402   HD22  LEU  51          1HD2      LEU  51  -5.180  -8.149   9.090
  403   HD23  LEU  51          2HD2      LEU  51  -5.555  -7.851  10.786
  404    H    ILE  52           HN       ILE  52  -0.497  -5.122   8.430
  405    HA   ILE  52           HA       ILE  52  -0.027  -5.575   5.709
  406    HB   ILE  52           HB       ILE  52   1.715  -4.119   7.709
  407   HG12  ILE  52          2HG1      ILE  52  -0.393  -3.080   5.798
  408   HG13  ILE  52          1HG1      ILE  52  -0.612  -3.281   7.535
  409   HG21  ILE  52          1HG2      ILE  52   1.693  -3.997   4.696
  410   HG22  ILE  52          2HG2      ILE  52   2.978  -4.655   5.708
  411   HG23  ILE  52          3HG2      ILE  52   2.617  -2.929   5.751
  412   HD11  ILE  52          3HD1      ILE  52  -0.178  -0.969   6.978
  413   HD12  ILE  52          1HD1      ILE  52   1.333  -1.420   6.190
  414   HD13  ILE  52          2HD1      ILE  52   1.150  -1.630   7.931
  415    H    MET  53           HN       MET  53   1.775  -6.598   8.578
  416    HA   MET  53           HA       MET  53   3.958  -7.775   7.237
  417    HB2  MET  53           2HB      MET  53   2.727  -8.345   9.935
  418    HB3  MET  53           1HB      MET  53   4.183  -9.145   9.362
  419    HG2  MET  53           2HG      MET  53   5.306  -6.979   9.195
  420    HG3  MET  53           1HG      MET  53   3.842  -6.182   9.769
  421    HE1  MET  53           3HE      MET  53   6.794  -5.900  11.065
  422    HE2  MET  53           1HE      MET  53   6.390  -5.931  12.779
  423    HE3  MET  53           2HE      MET  53   5.392  -5.006  11.661
  424    H    LYS  54           HN       LYS  54   0.773  -9.014   8.090
  425    HA   LYS  54           HA       LYS  54   1.329 -11.718   7.443
  426    HB2  LYS  54           2HB      LYS  54  -0.894 -10.225   8.411
  427    HB3  LYS  54           1HB      LYS  54  -1.430 -11.177   7.036
  428    HG2  LYS  54           2HG      LYS  54   0.031 -12.309   9.414
  429    HG3  LYS  54           1HG      LYS  54  -1.722 -12.300   9.231
  430    HD2  LYS  54           2HD      LYS  54  -1.202 -14.409   8.468
  431    HD3  LYS  54           1HD      LYS  54  -1.201 -13.492   6.962
  432    HE2  LYS  54           2HE      LYS  54   0.732 -14.869   6.926
  433    HE3  LYS  54           1HE      LYS  54   1.282 -13.225   7.245
  434    HZ1  LYS  54           3HZ      LYS  54   1.409 -13.789   9.616
  435    HZ2  LYS  54           1HZ      LYS  54   2.411 -14.786   8.676
  436    HZ3  LYS  54           2HZ      LYS  54   0.939 -15.381   9.263
  437    H    VAL  55           HN       VAL  55   0.073  -8.985   5.613
  438    HA   VAL  55           HA       VAL  55  -0.563 -10.428   3.251
  439    HB   VAL  55           HB       VAL  55   0.185  -7.506   3.499
  440   HG11  VAL  55          1HG1      VAL  55   0.280  -8.309   1.201
  441   HG12  VAL  55          2HG1      VAL  55  -1.099  -7.232   1.426
  442   HG13  VAL  55          3HG1      VAL  55  -1.344  -8.976   1.358
  443   HG21  VAL  55          3HG2      VAL  55  -1.668  -8.040   4.970
  444   HG22  VAL  55          1HG2      VAL  55  -2.512  -8.843   3.644
  445   HG23  VAL  55          2HG2      VAL  55  -2.238  -7.101   3.589
  446    H    LEU  56           HN       LEU  56   2.290  -8.572   4.247
  447    HA   LEU  56           HA       LEU  56   3.645  -8.895   1.755
  448    HB2  LEU  56           2HB      LEU  56   4.621  -7.988   4.459
  449    HB3  LEU  56           1HB      LEU  56   5.590  -7.938   3.000
  450    HG   LEU  56           HG       LEU  56   3.016  -6.423   3.424
  451   HD11  LEU  56          1HD1      LEU  56   5.880  -5.494   3.453
  452   HD12  LEU  56          2HD1      LEU  56   4.810  -5.609   4.848
  453   HD13  LEU  56          3HD1      LEU  56   4.457  -4.458   3.559
  454   HD21  LEU  56          3HD2      LEU  56   3.413  -6.984   1.081
  455   HD22  LEU  56          1HD2      LEU  56   5.040  -6.312   1.188
  456   HD23  LEU  56          2HD2      LEU  56   3.636  -5.258   1.367
  457    H    ASP  57           HN       ASP  57   3.431 -10.798   4.607
  458    HA   ASP  57           HA       ASP  57   5.921 -11.902   4.889
  459    HB2  ASP  57           2HB      ASP  57   3.748 -12.252   6.266
  460    HB3  ASP  57           1HB      ASP  57   3.493 -13.632   5.211
  461    HA   PRO  58           HA       PRO  58   5.050 -15.433   1.760
  462    HB2  PRO  58           2HB      PRO  58   2.876 -15.315   0.158
  463    HB3  PRO  58           1HB      PRO  58   2.835 -16.052   1.764
  464    HG2  PRO  58           2HG      PRO  58   1.913 -13.347   0.893
  465    HG3  PRO  58           1HG      PRO  58   1.147 -14.483   2.016
  466    HD2  PRO  58           2HD      PRO  58   2.607 -12.322   2.817
  467    HD3  PRO  58           1HD      PRO  58   2.439 -13.802   3.781
  468    H    ILE  59           HN       ILE  59   4.506 -12.121   1.016
  469    HA   ILE  59           HA       ILE  59   4.978 -12.306  -1.804
  470    HB   ILE  59           HB       ILE  59   5.046  -9.882   0.005
  471   HG12  ILE  59          2HG1      ILE  59   2.863 -10.966  -1.791
  472   HG13  ILE  59          1HG1      ILE  59   2.863 -11.016  -0.032
  473   HG21  ILE  59          1HG2      ILE  59   4.774  -8.586  -2.068
  474   HG22  ILE  59          2HG2      ILE  59   4.927 -10.074  -3.006
  475   HG23  ILE  59          3HG2      ILE  59   6.289  -9.491  -2.048
  476   HD11  ILE  59          3HD1      ILE  59   2.796  -8.539  -1.736
  477   HD12  ILE  59          1HD1      ILE  59   2.824  -8.573   0.026
  478   HD13  ILE  59          2HD1      ILE  59   1.443  -9.238  -0.845
  479    H    TRP  60           HN       TRP  60   6.934 -11.596   1.044
  480    HA   TRP  60           HA       TRP  60   9.237 -10.634  -0.221
  481    HB2  TRP  60           2HB      TRP  60   8.931 -12.198   2.344
  482    HB3  TRP  60           1HB      TRP  60  10.450 -11.482   1.823
  483    HD1  TRP  60           1HD      TRP  60   7.546 -10.738   3.907
  484    HE1  TRP  60           1HE      TRP  60   7.415  -8.230   4.461
  485    HE3  TRP  60           3HE      TRP  60  10.904  -8.981   0.480
  486    HZ2  TRP  60           2HZ      TRP  60   8.585  -5.816   3.560
  487    HZ3  TRP  60           3HZ      TRP  60  11.345  -6.564   0.390
  488    HH2  TRP  60           2HH      TRP  60  10.210  -5.014   1.898
  489    H    GLU  61           HN       GLU  61   8.042 -13.890   0.123
  490    HA   GLU  61           HA       GLU  61  10.480 -15.200  -0.478
  491    HB2  GLU  61           2HB      GLU  61   7.605 -16.087  -0.555
  492    HB3  GLU  61           1HB      GLU  61   8.964 -17.146  -0.842
  493    HG2  GLU  61           2HG      GLU  61   9.817 -16.489   1.433
  494    HG3  GLU  61           1HG      GLU  61   8.247 -15.726   1.688
  495    H    GLN  62           HN       GLN  62   7.933 -13.804  -2.381
  496    HA   GLN  62           HA       GLN  62   8.901 -15.193  -4.772
  497    HB2  GLN  62           2HB      GLN  62   6.296 -13.746  -4.268
  498    HB3  GLN  62           1HB      GLN  62   6.741 -14.532  -5.773
  499    HG2  GLN  62           2HG      GLN  62   6.386 -15.881  -3.110
  500    HG3  GLN  62           1HG      GLN  62   5.252 -15.926  -4.458
  501   HE21  GLN  62          1HE2      GLN  62   7.362 -16.149  -6.467
  502   HE22  GLN  62          2HE2      GLN  62   7.953 -17.770  -6.353
  503    H    LYS  63           HN       LYS  63   7.941 -11.952  -3.640
  504    HA   LYS  63           HA       LYS  63   9.543 -10.800  -5.817
  505    HB2  LYS  63           2HB      LYS  63   6.728  -9.938  -5.116
  506    HB3  LYS  63           1HB      LYS  63   7.771  -9.166  -6.300
  507    HG2  LYS  63           2HG      LYS  63   7.702 -11.120  -7.706
  508    HG3  LYS  63           1HG      LYS  63   6.787 -12.005  -6.483
  509    HD2  LYS  63           2HD      LYS  63   4.933 -10.434  -6.717
  510    HD3  LYS  63           1HD      LYS  63   5.847  -9.520  -7.921
  511    HE2  LYS  63           2HE      LYS  63   5.860 -11.449  -9.398
  512    HE3  LYS  63           1HE      LYS  63   5.009 -12.405  -8.186
  513    HZ1  LYS  63           3HZ      LYS  63   3.547 -11.536  -9.942
  514    HZ2  LYS  63           1HZ      LYS  63   3.915  -9.953  -9.463
  515    HZ3  LYS  63           2HZ      LYS  63   3.099 -10.994  -8.402
  516    HA   PRO  64           HA       PRO  64  10.463  -8.776  -1.730
  517    HB2  PRO  64           2HB      PRO  64  13.168  -8.693  -2.897
  518    HB3  PRO  64           1HB      PRO  64  12.644  -9.285  -1.319
  519    HG2  PRO  64           2HG      PRO  64  13.424 -10.973  -3.248
  520    HG3  PRO  64           1HG      PRO  64  12.108 -11.382  -2.130
  521    HD2  PRO  64           2HD      PRO  64  11.956 -10.410  -4.963
  522    HD3  PRO  64           1HD      PRO  64  11.009 -11.679  -4.156
  523    H    GLU  65           HN       GLU  65  11.775  -8.001  -4.943
  524    HA   GLU  65           HA       GLU  65  12.154  -5.253  -4.505
  525    HB2  GLU  65           2HB      GLU  65  13.143  -6.478  -6.387
  526    HB3  GLU  65           1HB      GLU  65  11.546  -6.705  -7.075
  527    HG2  GLU  65           2HG      GLU  65  11.318  -4.297  -7.365
  528    HG3  GLU  65           1HG      GLU  65  12.922  -4.066  -6.668
  529    H    THR  66           HN       THR  66   9.385  -7.092  -5.659
  530    HA   THR  66           HA       THR  66   7.795  -4.823  -6.305
  531    HB   THR  66           HB       THR  66   6.800  -7.611  -5.694
  532    HG1  THR  66           1HG      THR  66   7.073  -7.386  -8.265
  533   HG21  THR  66          3HG2      THR  66   5.750  -5.418  -7.496
  534   HG22  THR  66          1HG2      THR  66   5.048  -5.919  -5.956
  535   HG23  THR  66          2HG2      THR  66   5.048  -7.027  -7.327
  536    H    ALA  67           HN       ALA  67   8.278  -6.765  -3.438
  537    HA   ALA  67           HA       ALA  67   6.013  -5.986  -1.981
  538    HB1  ALA  67           1HB      ALA  67   8.723  -6.784  -0.943
  539    HB2  ALA  67           2HB      ALA  67   7.386  -7.872  -1.314
  540    HB3  ALA  67           3HB      ALA  67   7.238  -6.709   0.004
  541    H    SER  68           HN       SER  68   9.227  -4.476  -2.225
  542    HA   SER  68           HA       SER  68   8.638  -2.461  -0.301
  543    HB2  SER  68           2HB      SER  68  10.646  -1.312  -1.501
  544    HB3  SER  68           1HB      SER  68  10.919  -2.799  -0.596
  545    HG   SER  68           HG       SER  68  10.760  -2.432  -3.397
  546    H    ARG  69           HN       ARG  69   8.265  -2.724  -3.780
  547    HA   ARG  69           HA       ARG  69   7.553  -0.032  -4.263
  548    HB2  ARG  69           2HB      ARG  69   7.041  -2.601  -5.755
  549    HB3  ARG  69           1HB      ARG  69   6.495  -1.049  -6.347
  550    HG2  ARG  69           2HG      ARG  69   8.812  -0.255  -6.393
  551    HG3  ARG  69           1HG      ARG  69   9.342  -1.840  -5.831
  552    HD2  ARG  69           2HD      ARG  69   8.477  -2.888  -7.828
  553    HD3  ARG  69           1HD      ARG  69   7.806  -1.351  -8.375
  554    HE   ARG  69           HE       ARG  69  10.273  -0.618  -8.324
  555   HH11  ARG  69          1HH1      ARG  69   9.124  -3.811  -9.181
  556   HH12  ARG  69          2HH1      ARG  69  10.495  -4.179 -10.179
  557   HH21  ARG  69          1HH2      ARG  69  12.067  -1.086  -9.668
  558   HH22  ARG  69          2HH2      ARG  69  12.153  -2.618 -10.476
  559    H    LEU  70           HN       LEU  70   5.781  -2.878  -3.275
  560    HA   LEU  70           HA       LEU  70   3.180  -1.770  -3.564
  561    HB2  LEU  70           2HB      LEU  70   3.636  -4.197  -3.415
  562    HB3  LEU  70           1HB      LEU  70   4.129  -3.992  -1.745
  563    HG   LEU  70           HG       LEU  70   1.832  -3.239  -1.191
  564   HD11  LEU  70          1HD1      LEU  70   1.195  -2.393  -3.388
  565   HD12  LEU  70          2HD1      LEU  70   0.036  -3.587  -2.803
  566   HD13  LEU  70          3HD1      LEU  70   1.218  -4.033  -4.034
  567   HD21  LEU  70          3HD2      LEU  70   0.796  -5.454  -1.367
  568   HD22  LEU  70          1HD2      LEU  70   2.479  -5.553  -0.850
  569   HD23  LEU  70          2HD2      LEU  70   2.045  -5.940  -2.515
  570    H    ARG  71           HN       ARG  71   5.484  -1.982  -0.887
  571    HA   ARG  71           HA       ARG  71   3.823  -0.978   1.130
  572    HB2  ARG  71           2HB      ARG  71   6.805  -1.068   0.786
  573    HB3  ARG  71           1HB      ARG  71   6.072  -0.303   2.186
  574    HG2  ARG  71           2HG      ARG  71   4.901  -2.440   2.673
  575    HG3  ARG  71           1HG      ARG  71   5.810  -3.179   1.352
  576    HD2  ARG  71           2HD      ARG  71   7.110  -1.790   3.685
  577    HD3  ARG  71           1HD      ARG  71   6.755  -3.516   3.663
  578    HE   ARG  71           HE       ARG  71   8.238  -3.627   1.672
  579   HH11  ARG  71          1HH1      ARG  71   8.531  -0.902   3.844
  580   HH12  ARG  71          2HH1      ARG  71  10.246  -0.714   3.588
  581   HH21  ARG  71          1HH2      ARG  71  10.510  -3.402   1.341
  582   HH22  ARG  71          2HH2      ARG  71  11.366  -2.138   2.168
  583    H    GLY  72           HN       GLY  72   5.999   0.676  -1.124
  584    HA2  GLY  72           2HA      GLY  72   5.768   3.260  -0.052
  585    HA3  GLY  72           1HA      GLY  72   6.138   2.886  -1.730
  586    H    ARG  73           HN       ARG  73   3.737   1.524  -2.347
  587    HA   ARG  73           HA       ARG  73   2.072   3.748  -2.944
  588    HB2  ARG  73           2HB      ARG  73   1.749   0.779  -3.363
  589    HB3  ARG  73           1HB      ARG  73   0.521   1.942  -3.852
  590    HG2  ARG  73           2HG      ARG  73   2.190   3.071  -5.269
  591    HG3  ARG  73           1HG      ARG  73   3.370   1.841  -4.822
  592    HD2  ARG  73           2HD      ARG  73   0.740   1.082  -6.037
  593    HD3  ARG  73           1HD      ARG  73   2.087   1.598  -7.047
  594    HE   ARG  73           HE       ARG  73   3.017  -0.390  -5.324
  595   HH11  ARG  73          1HH1      ARG  73   0.760  -0.044  -7.972
  596   HH12  ARG  73          2HH1      ARG  73   0.993  -1.655  -8.571
  597   HH21  ARG  73          1HH2      ARG  73   3.346  -2.524  -6.110
  598   HH22  ARG  73          2HH2      ARG  73   2.477  -3.066  -7.508
  599    H    ILE  74           HN       ILE  74   1.796   1.013  -0.700
  600    HA   ILE  74           HA       ILE  74  -0.764   1.607   0.295
  601    HB   ILE  74           HB       ILE  74   1.553   0.304   1.741
  602   HG12  ILE  74          2HG1      ILE  74  -0.777  -0.929   0.253
  603   HG13  ILE  74          1HG1      ILE  74   0.873  -0.833  -0.353
  604   HG21  ILE  74          1HG2      ILE  74  -0.117   1.079   3.321
  605   HG22  ILE  74          2HG2      ILE  74  -0.167  -0.679   3.200
  606   HG23  ILE  74          3HG2      ILE  74  -1.395   0.297   2.391
  607   HD11  ILE  74          3HD1      ILE  74   1.618  -2.231   1.524
  608   HD12  ILE  74          1HD1      ILE  74   0.425  -3.039   0.507
  609   HD13  ILE  74          2HD1      ILE  74  -0.057  -2.364   2.064
  610    H    GLU  75           HN       GLU  75   2.448   2.575   1.446
  611    HA   GLU  75           HA       GLU  75   1.745   4.115   3.655
  612    HB2  GLU  75           2HB      GLU  75   4.050   3.545   3.088
  613    HB3  GLU  75           1HB      GLU  75   3.970   4.536   1.644
  614    HG2  GLU  75           2HG      GLU  75   3.538   6.497   3.166
  615    HG3  GLU  75           1HG      GLU  75   3.966   5.435   4.506
  616    H    SER  76           HN       SER  76   2.058   5.072   0.266
  617    HA   SER  76           HA       SER  76   1.566   7.801   0.606
  618    HB2  SER  76           2HB      SER  76   0.981   6.081  -1.799
  619    HB3  SER  76           1HB      SER  76   1.108   7.837  -1.802
  620    HG   SER  76           HG       SER  76   3.178   5.996  -1.128
  621    H    VAL  77           HN       VAL  77  -0.668   5.126  -0.078
  622    HA   VAL  77           HA       VAL  77  -2.968   6.762  -0.336
  623    HB   VAL  77           HB       VAL  77  -2.774   3.830   0.384
  624   HG11  VAL  77          1HG1      VAL  77  -4.921   4.775   1.061
  625   HG12  VAL  77          2HG1      VAL  77  -5.111   3.680  -0.308
  626   HG13  VAL  77          3HG1      VAL  77  -5.155   5.426  -0.562
  627   HG21  VAL  77          3HG2      VAL  77  -1.792   4.340  -1.781
  628   HG22  VAL  77          1HG2      VAL  77  -3.255   5.198  -2.261
  629   HG23  VAL  77          2HG2      VAL  77  -3.307   3.457  -1.983
  630    H    LEU  78           HN       LEU  78  -1.650   4.887   2.390
  631    HA   LEU  78           HA       LEU  78  -3.714   5.453   4.210
  632    HB2  LEU  78           2HB      LEU  78  -0.811   4.806   4.698
  633    HB3  LEU  78           1HB      LEU  78  -2.010   4.908   5.971
  634    HG   LEU  78           HG       LEU  78  -2.003   2.929   3.694
  635   HD11  LEU  78          1HD1      LEU  78  -1.624   1.289   5.476
  636   HD12  LEU  78          2HD1      LEU  78  -1.519   2.600   6.649
  637   HD13  LEU  78          3HD1      LEU  78  -0.313   2.464   5.371
  638   HD21  LEU  78          3HD2      LEU  78  -3.918   1.914   4.825
  639   HD22  LEU  78          1HD2      LEU  78  -4.281   3.562   4.313
  640   HD23  LEU  78          2HD2      LEU  78  -3.920   3.225   6.005
  641    H    ASP  79           HN       ASP  79  -0.671   7.158   3.570
  642    HA   ASP  79           HA       ASP  79  -0.972   9.051   5.666
  643    HB2  ASP  79           2HB      ASP  79   1.198   8.565   4.561
  644    HB3  ASP  79           1HB      ASP  79   0.602   9.335   3.092
  645    H    TRP  80           HN       TRP  80  -1.797   9.081   2.234
  646    HA   TRP  80           HA       TRP  80  -2.836  11.674   2.041
  647    HB2  TRP  80           2HB      TRP  80  -2.394  10.273   0.089
  648    HB3  TRP  80           1HB      TRP  80  -3.632   9.132   0.596
  649    HD1  TRP  80           1HD      TRP  80  -3.270  12.683  -0.860
  650    HE1  TRP  80           1HE      TRP  80  -5.470  13.292  -2.057
  651    HE3  TRP  80           3HE      TRP  80  -6.071   8.625   0.500
  652    HZ2  TRP  80           2HZ      TRP  80  -8.055  12.177  -2.372
  653    HZ3  TRP  80           3HZ      TRP  80  -8.391   8.477  -0.292
  654    HH2  TRP  80           2HH      TRP  80  -9.359  10.217  -1.697
  655    H    ALA  81           HN       ALA  81  -4.387   8.612   2.917
  656    HA   ALA  81           HA       ALA  81  -6.981   9.620   3.359
  657    HB1  ALA  81           1HB      ALA  81  -5.644   7.241   4.645
  658    HB2  ALA  81           2HB      ALA  81  -6.485   7.235   3.095
  659    HB3  ALA  81           3HB      ALA  81  -7.378   7.552   4.582
  660    H    THR  82           HN       THR  82  -4.108   9.531   5.350
  661    HA   THR  82           HA       THR  82  -5.301  10.121   7.838
  662    HB   THR  82           HB       THR  82  -2.529  10.896   6.893
  663    HG1  THR  82           1HG      THR  82  -3.098   8.592   6.738
  664   HG21  THR  82          3HG2      THR  82  -3.660  10.487   9.666
  665   HG22  THR  82          1HG2      THR  82  -3.155  12.021   8.952
  666   HG23  THR  82          2HG2      THR  82  -1.959  10.770   9.292
  667    H    VAL  83           HN       VAL  83  -3.975  12.187   5.273
  668    HA   VAL  83           HA       VAL  83  -4.478  14.634   6.652
  669    HB   VAL  83           HB       VAL  83  -4.021  14.172   3.698
  670   HG11  VAL  83          1HG1      VAL  83  -5.014  16.339   4.135
  671   HG12  VAL  83          2HG1      VAL  83  -3.328  16.514   3.644
  672   HG13  VAL  83          3HG1      VAL  83  -3.775  16.682   5.342
  673   HG21  VAL  83          3HG2      VAL  83  -2.043  14.856   5.874
  674   HG22  VAL  83          1HG2      VAL  83  -1.688  14.730   4.150
  675   HG23  VAL  83          2HG2      VAL  83  -2.185  13.299   5.054
  676    H    ARG  84           HN       ARG  84  -6.162  12.897   4.043
  677    HA   ARG  84           HA       ARG  84  -8.239  14.764   3.714
  678    HB2  ARG  84           2HB      ARG  84  -7.582  12.070   2.800
  679    HB3  ARG  84           1HB      ARG  84  -9.311  12.352   2.957
  680    HG2  ARG  84           2HG      ARG  84  -8.519  12.848   0.716
  681    HG3  ARG  84           1HG      ARG  84  -9.149  14.282   1.520
  682    HD2  ARG  84           2HD      ARG  84  -6.757  14.834   2.122
  683    HD3  ARG  84           1HD      ARG  84  -6.278  13.557   1.002
  684    HE   ARG  84           HE       ARG  84  -8.053  15.265  -0.324
  685   HH11  ARG  84          1HH1      ARG  84  -4.770  15.277   0.941
  686   HH12  ARG  84          2HH1      ARG  84  -4.251  16.556  -0.117
  687   HH21  ARG  84          1HH2      ARG  84  -7.349  16.932  -1.693
  688   HH22  ARG  84          2HH2      ARG  84  -5.703  17.479  -1.612
  689    H    GLY  85           HN       GLY  85  -7.691  12.384   6.140
  690    HA2  GLY  85           2HA      GLY  85  -8.839  12.283   8.173
  691    HA3  GLY  85           1HA      GLY  85 -10.128  13.246   7.466
  692    H    TYR  86           HN       TYR  86  -8.872  10.361   5.947
  693    HA   TYR  86           HA       TYR  86 -11.474   9.087   6.294
  694    HB2  TYR  86           2HB      TYR  86  -9.082   8.309   4.617
  695    HB3  TYR  86           1HB      TYR  86 -10.563   7.361   4.720
  696    HD1  TYR  86           2HD      TYR  86 -12.735   9.114   4.461
  697    HD2  TYR  86           1HD      TYR  86  -8.909   9.443   2.624
  698    HE1  TYR  86           2HE      TYR  86 -13.723  10.466   2.661
  699    HE2  TYR  86           1HE      TYR  86  -9.888  10.795   0.819
  700    HH   TYR  86           HH       TYR  86 -12.109  11.147  -0.233
  701    H    ARG  87           HN       ARG  87  -8.156   8.818   7.324
  702    HA   ARG  87           HA       ARG  87  -9.094   6.919   9.335
  703    HB2  ARG  87           2HB      ARG  87  -7.057   5.605   9.252
  704    HB3  ARG  87           1HB      ARG  87  -7.860   5.572   7.691
  705    HG2  ARG  87           2HG      ARG  87  -6.233   6.874   6.685
  706    HG3  ARG  87           1HG      ARG  87  -5.653   7.513   8.228
  707    HD2  ARG  87           2HD      ARG  87  -5.456   4.591   7.547
  708    HD3  ARG  87           1HD      ARG  87  -4.212   5.740   7.056
  709    HE   ARG  87           HE       ARG  87  -3.702   6.119   9.351
  710   HH11  ARG  87          1HH1      ARG  87  -5.981   3.493   8.849
  711   HH12  ARG  87          2HH1      ARG  87  -5.719   2.814  10.429
  712   HH21  ARG  87          1HH2      ARG  87  -3.357   5.194  11.400
  713   HH22  ARG  87          2HH2      ARG  87  -4.250   3.781  11.881
  714    H    GLU  88           HN       GLU  88  -7.364   6.706  11.099
  715    HA   GLU  88           HA       GLU  88  -7.040   9.324  12.164
  716    HB2  GLU  88           2HB      GLU  88  -6.162   6.633  13.225
  717    HB3  GLU  88           1HB      GLU  88  -6.153   8.136  14.145
  718    HG2  GLU  88           2HG      GLU  88  -8.553   8.320  13.939
  719    HG3  GLU  88           1HG      GLU  88  -8.603   6.891  12.916
  720    H    GLY  89           HN       GLY  89  -4.816   9.591  13.497
  721    HA2  GLY  89           2HA      GLY  89  -3.173  10.507  11.329
  722    HA3  GLY  89           1HA      GLY  89  -2.975  10.874  13.021
  723    H    ASP  90           HN       ASP  90  -3.030   7.583  11.903
  724    HA   ASP  90           HA       ASP  90  -0.123   7.484  12.391
  725    HB2  ASP  90           2HB      ASP  90  -1.478   6.352  14.152
  726    HB3  ASP  90           1HB      ASP  90  -2.067   5.236  12.923
  727    H    ASN  91           HN       ASN  91   1.150   6.310  11.023
  728    HA   ASN  91           HA       ASN  91  -0.162   5.016   8.724
  729    HB2  ASN  91           2HB      ASN  91   0.883   7.104   7.978
  730    HB3  ASN  91           1HB      ASN  91   2.410   6.618   8.708
  731   HD21  ASN  91          1HD2      ASN  91   0.287   6.232   5.998
  732   HD22  ASN  91          2HD2      ASN  91   1.356   5.279   5.040
  733    HA   PRO  92           HA       PRO  92   2.334   1.885  10.951
  734    HB2  PRO  92           2HB      PRO  92   0.717  -0.202  10.415
  735    HB3  PRO  92           1HB      PRO  92   0.359   0.964  11.695
  736    HG2  PRO  92           2HG      PRO  92  -0.725   0.826   8.904
  737    HG3  PRO  92           1HG      PRO  92  -1.594   1.098  10.427
  738    HD2  PRO  92           2HD      PRO  92  -0.908   3.118   8.762
  739    HD3  PRO  92           1HD      PRO  92  -0.986   3.317  10.524
  740    H    ALA  93           HN       ALA  93   1.963   2.579   7.775
  741    HA   ALA  93           HA       ALA  93   3.044   0.080   6.726
  742    HB1  ALA  93           1HB      ALA  93   2.778   1.108   4.528
  743    HB2  ALA  93           2HB      ALA  93   2.300   2.627   5.287
  744    HB3  ALA  93           3HB      ALA  93   1.277   1.200   5.451
  745    H    ARG  94           HN       ARG  94   4.071   3.203   7.728
  746    HA   ARG  94           HA       ARG  94   6.576   3.065   6.277
  747    HB2  ARG  94           2HB      ARG  94   5.474   5.232   6.545
  748    HB3  ARG  94           1HB      ARG  94   5.583   5.085   8.291
  749    HG2  ARG  94           2HG      ARG  94   7.958   5.265   8.227
  750    HG3  ARG  94           1HG      ARG  94   7.971   5.157   6.466
  751    HD2  ARG  94           2HD      ARG  94   6.691   7.376   8.063
  752    HD3  ARG  94           1HD      ARG  94   8.273   7.467   7.291
  753    HE   ARG  94           HE       ARG  94   6.609   6.773   5.249
  754   HH11  ARG  94          1HH1      ARG  94   6.574   9.361   7.617
  755   HH12  ARG  94          2HH1      ARG  94   5.767  10.485   6.572
  756   HH21  ARG  94          1HH2      ARG  94   5.553   8.270   3.866
  757   HH22  ARG  94          2HH2      ARG  94   5.175   9.863   4.449
  758    H    TRP  95           HN       TRP  95   8.404   2.360   7.046
  759    HA   TRP  95           HA       TRP  95   8.495   1.473   9.852
  760    HB2  TRP  95           2HB      TRP  95   9.216   0.136   7.322
  761    HB3  TRP  95           1HB      TRP  95  10.373  -0.058   8.636
  762    HD1  TRP  95           1HD      TRP  95   9.055  -0.827  11.077
  763    HE1  TRP  95           1HE      TRP  95   7.379  -2.760  11.331
  764    HE3  TRP  95           3HE      TRP  95   7.538  -1.204   6.213
  765    HZ2  TRP  95           2HZ      TRP  95   5.628  -4.245   9.674
  766    HZ3  TRP  95           3HZ      TRP  95   5.858  -2.905   5.631
  767    HH2  TRP  95           2HH      TRP  95   4.924  -4.392   7.326
  768    H    ARG  96           HN       ARG  96   9.891   2.545  11.058
  769    HA   ARG  96           HA       ARG  96  12.037   4.091  10.000
  770    HB2  ARG  96           2HB      ARG  96  12.686   4.412  12.323
  771    HB3  ARG  96           1HB      ARG  96  10.944   4.585  12.173
  772    HG2  ARG  96           2HG      ARG  96  10.532   2.535  13.204
  773    HG3  ARG  96           1HG      ARG  96  12.185   1.976  12.955
  774    HD2  ARG  96           2HD      ARG  96  12.926   3.790  14.522
  775    HD3  ARG  96           1HD      ARG  96  11.223   4.074  14.885
  776    HE   ARG  96           HE       ARG  96  11.108   1.941  15.898
  777   HH11  ARG  96          1HH1      ARG  96  14.330   2.840  14.896
  778   HH12  ARG  96          2HH1      ARG  96  15.112   1.597  15.818
  779   HH21  ARG  96          1HH2      ARG  96  12.123   0.291  17.119
  780   HH22  ARG  96          2HH2      ARG  96  13.855   0.164  17.110
  781    H    GLY  97           HN       GLY  97  11.622   0.801  10.939
  782    HA2  GLY  97           2HA      GLY  97  14.036  -0.084   9.847
  783    HA3  GLY  97           1HA      GLY  97  14.276   0.126  11.574
  784    H    TYR  98           HN       TYR  98  12.500  -1.623   9.111
  785    HA   TYR  98           HA       TYR  98  11.897  -3.720  11.095
  786    HB2  TYR  98           2HB      TYR  98   9.945  -3.033   9.804
  787    HB3  TYR  98           1HB      TYR  98  10.812  -3.304   8.296
  788    HD1  TYR  98           1HD      TYR  98  10.040  -5.219  11.417
  789    HD2  TYR  98           2HD      TYR  98  10.257  -5.243   7.168
  790    HE1  TYR  98           1HE      TYR  98   9.234  -7.543  11.397
  791    HE2  TYR  98           2HE      TYR  98   9.455  -7.568   7.135
  792    HH   TYR  98           HH       TYR  98   8.166  -9.121   9.926
  793    H    LEU  99           HN       LEU  99  13.195  -3.120   7.874
  794    HA   LEU  99           HA       LEU  99  14.666  -5.661   7.929
  795    HB2  LEU  99           2HB      LEU  99  14.212  -3.656   5.717
  796    HB3  LEU  99           1HB      LEU  99  15.131  -5.136   5.558
  797    HG   LEU  99           HG       LEU  99  12.185  -4.986   6.190
  798   HD11  LEU  99          1HD1      LEU  99  13.619  -5.690   3.636
  799   HD12  LEU  99          2HD1      LEU  99  12.638  -4.253   3.927
  800   HD13  LEU  99          3HD1      LEU  99  11.886  -5.848   3.916
  801   HD21  LEU  99          3HD2      LEU  99  13.309  -6.965   7.128
  802   HD22  LEU  99          1HD2      LEU  99  13.920  -7.361   5.522
  803   HD23  LEU  99          2HD2      LEU  99  12.185  -7.382   5.835
  804    H    GLU 100           HN       GLU 100  15.202  -3.096   9.389
  805    HA   GLU 100           HA       GLU 100  17.291  -1.642   8.284
  806    HB2  GLU 100           2HB      GLU 100  15.973  -0.897  10.229
  807    HB3  GLU 100           1HB      GLU 100  16.737  -2.138  11.213
  808    HG2  GLU 100           2HG      GLU 100  18.884  -1.080  10.971
  809    HG3  GLU 100           1HG      GLU 100  18.217   0.098   9.842
  810    H    HIS 101           HN       HIS 101  19.248  -2.165   7.788
  811    HA   HIS 101           HA       HIS 101  20.943  -3.642   9.587
  812    HB2  HIS 101           2HB      HIS 101  21.582  -5.404   8.054
  813    HB3  HIS 101           1HB      HIS 101  19.843  -5.474   8.287
  814    HD1  HIS 101           1HD      HIS 101  18.348  -4.669   6.252
  815    HD2  HIS 101           2HD      HIS 101  22.415  -5.019   5.447
  816    HE1  HIS 101           1HE      HIS 101  18.547  -4.670   3.744
  817    HE2  HIS 101           2HE      HIS 101  21.027  -4.741   3.280
  818    H    HIS 102           HN       HIS 102  23.122  -3.127   9.218
  819    HA   HIS 102           HA       HIS 102  23.366  -0.762   7.567
  820    HB2  HIS 102           2HB      HIS 102  24.391  -1.344   9.995
  821    HB3  HIS 102           1HB      HIS 102  25.763  -1.758   8.969
  822    HD1  HIS 102           1HD      HIS 102  23.413   1.144   9.586
  823    HD2  HIS 102           2HD      HIS 102  27.242   0.386   8.163
  824    HE1  HIS 102           1HE      HIS 102  24.443   3.400   9.180
  825    HE2  HIS 102           2HE      HIS 102  26.818   2.922   8.501
  826    H    HIS 103           HN       HIS 103  24.266  -0.626   5.667
  827    HA   HIS 103           HA       HIS 103  25.633  -2.998   4.586
  828    HB2  HIS 103           2HB      HIS 103  23.604  -2.449   3.383
  829    HB3  HIS 103           1HB      HIS 103  24.109  -0.774   3.211
  830    HD1  HIS 103           1HD      HIS 103  24.982  -4.237   1.956
  831    HD2  HIS 103           2HD      HIS 103  25.650  -0.243   1.004
  832    HE1  HIS 103           1HE      HIS 103  26.082  -4.254  -0.306
  833    HE2  HIS 103           2HE      HIS 103  26.268  -1.821  -0.953
  834    H    HIS 104           HN       HIS 104  27.668  -2.856   3.898
  835    HA   HIS 104           HA       HIS 104  28.846  -0.299   3.205
  836    HB2  HIS 104           2HB      HIS 104  29.533  -1.772   5.690
  837    HB3  HIS 104           1HB      HIS 104  30.880  -1.145   4.750
  838    HD1  HIS 104           1HD      HIS 104  29.222  -0.211   7.594
  839    HD2  HIS 104           2HD      HIS 104  29.907   1.795   4.012
  840    HE1  HIS 104           1HE      HIS 104  29.018   2.240   8.131
  841    HE2  HIS 104           2HE      HIS 104  29.515   3.438   5.970
  842    H    HIS 105           HN       HIS 105  30.474  -0.490   1.749
  843    HA   HIS 105           HA       HIS 105  31.707  -3.129   1.436
  844    HB2  HIS 105           2HB      HIS 105  31.667  -3.006  -0.987
  845    HB3  HIS 105           1HB      HIS 105  30.027  -2.908  -0.368
  846    HD1  HIS 105           1HD      HIS 105  32.295  -1.330  -2.688
  847    HD2  HIS 105           2HD      HIS 105  29.027  -0.109  -0.419
  848    HE1  HIS 105           1HE      HIS 105  31.482   0.797  -3.755
  849    HE2  HIS 105           2HE      HIS 105  29.361   1.367  -2.518
  850    H    HIS 106           HN       HIS 106  33.753  -2.934   1.831
  851    HA   HIS 106           HA       HIS 106  35.832  -2.088   2.168
  852    HB2  HIS 106           2HB      HIS 106  35.078  -0.137  -0.021
  853    HB3  HIS 106           1HB      HIS 106  36.691  -0.334   0.643
  854    HD1  HIS 106           1HD      HIS 106  36.340  -0.719  -2.307
  855    HD2  HIS 106           2HD      HIS 106  35.963  -3.824   0.435
  856    HE1  HIS 106           1HE      HIS 106  36.748  -2.832  -3.613
  857    HE2  HIS 106           2HE      HIS 106  36.659  -4.684  -1.905
  Start of MODEL   12
    1    H1   MET   1           H1       MET   1 -15.187   4.546   5.481
    2    H2   MET   1           H2       MET   1 -13.904   3.729   6.236
    3    H3   MET   1           H3       MET   1 -15.191   2.851   5.568
    4    HA   MET   1           HA       MET   1 -14.605   3.524   3.364
    5    HB2  MET   1           2HB      MET   1 -13.705   5.748   3.992
    6    HB3  MET   1           1HB      MET   1 -12.303   4.968   4.709
    7    HG2  MET   1           2HG      MET   1 -11.758   5.833   2.523
    8    HG3  MET   1           1HG      MET   1 -11.685   4.072   2.522
    9    HE1  MET   1           2HE      MET   1 -14.905   6.329   2.458
   10    HE2  MET   1           3HE      MET   1 -15.212   6.459   0.725
   11    HE3  MET   1           1HE      MET   1 -13.792   7.233   1.429
   12    H    THR   2           HN       THR   2 -13.589   1.867   2.308
   13    HA   THR   2           HA       THR   2 -11.955   0.094   3.963
   14    HB   THR   2           HB       THR   2 -12.181  -1.540   2.144
   15    HG1  THR   2           1HG      THR   2 -14.041   0.061   0.789
   16   HG21  THR   2          3HG2      THR   2 -14.615  -1.880   2.279
   17   HG22  THR   2          1HG2      THR   2 -14.796  -0.253   2.931
   18   HG23  THR   2          2HG2      THR   2 -13.920  -1.478   3.848
   19    H    PHE   3           HN       PHE   3 -10.033  -0.930   2.907
   20    HA   PHE   3           HA       PHE   3  -8.168   1.056   2.226
   21    HB2  PHE   3           2HB      PHE   3  -7.537  -1.055   3.301
   22    HB3  PHE   3           1HB      PHE   3  -7.986  -1.938   1.846
   23    HD1  PHE   3           1HD      PHE   3  -5.694   0.740   3.047
   24    HD2  PHE   3           2HD      PHE   3  -6.396  -2.364   0.215
   25    HE1  PHE   3           1HE      PHE   3  -3.412   1.023   2.176
   26    HE2  PHE   3           2HE      PHE   3  -4.115  -2.079  -0.661
   27    HZ   PHE   3           HZ       PHE   3  -2.619  -0.387   0.317
   28    H    SER   4           HN       SER   4  -9.913  -1.299   0.230
   29    HA   SER   4           HA       SER   4  -8.582  -0.695  -2.189
   30    HB2  SER   4           2HB      SER   4 -11.367  -1.800  -1.762
   31    HB3  SER   4           1HB      SER   4 -10.458  -1.857  -3.273
   32    HG   SER   4           HG       SER   4  -8.996  -2.832  -1.218
   33    H    GLU   5           HN       GLU   5 -11.569   0.559  -0.749
   34    HA   GLU   5           HA       GLU   5 -12.259   2.227  -2.925
   35    HB2  GLU   5           2HB      GLU   5 -13.025   2.219  -0.013
   36    HB3  GLU   5           1HB      GLU   5 -13.690   3.367  -1.156
   37    HG2  GLU   5           2HG      GLU   5 -14.618   1.574  -2.470
   38    HG3  GLU   5           1HG      GLU   5 -13.892   0.383  -1.396
   39    H    CYS   6           HN       CYS   6 -10.508   2.799   0.084
   40    HA   CYS   6           HA       CYS   6 -10.079   5.561  -0.230
   41    HB2  CYS   6           2HB      CYS   6  -9.661   4.134   1.830
   42    HB3  CYS   6           1HB      CYS   6  -8.157   3.641   1.079
   43    HG   CYS   6           HG       CYS   6  -7.745   6.684   0.812
   44    H    ALA   7           HN       ALA   7  -8.151   2.769  -1.186
   45    HA   ALA   7           HA       ALA   7  -6.008   4.110  -2.380
   46    HB1  ALA   7           1HB      ALA   7  -5.635   2.047  -3.654
   47    HB2  ALA   7           2HB      ALA   7  -7.234   1.469  -3.182
   48    HB3  ALA   7           3HB      ALA   7  -5.984   1.706  -1.959
   49    H    ALA   8           HN       ALA   8  -9.115   3.086  -3.731
   50    HA   ALA   8           HA       ALA   8  -8.697   3.932  -6.369
   51    HB1  ALA   8           1HB      ALA   8 -11.298   3.824  -4.843
   52    HB2  ALA   8           2HB      ALA   8 -10.554   2.482  -5.707
   53    HB3  ALA   8           3HB      ALA   8 -11.125   3.893  -6.595
   54    H    LEU   9           HN       LEU   9  -9.893   5.670  -3.530
   55    HA   LEU   9           HA       LEU   9 -10.610   8.072  -4.792
   56    HB2  LEU   9           2HB      LEU   9  -9.478   7.648  -2.021
   57    HB3  LEU   9           1HB      LEU   9 -10.262   9.112  -2.575
   58    HG   LEU   9           HG       LEU   9 -11.622   6.425  -2.387
   59   HD11  LEU   9          1HD1      LEU   9 -10.986   7.273  -0.181
   60   HD12  LEU   9          2HD1      LEU   9 -12.733   7.338  -0.419
   61   HD13  LEU   9          3HD1      LEU   9 -11.770   8.809  -0.548
   62   HD21  LEU   9          3HD2      LEU   9 -13.671   7.775  -2.630
   63   HD22  LEU   9          1HD2      LEU   9 -12.628   7.868  -4.051
   64   HD23  LEU   9          2HD2      LEU   9 -12.674   9.204  -2.900
   65    H    TYR  10           HN       TYR  10  -7.541   7.024  -3.374
   66    HA   TYR  10           HA       TYR  10  -6.058   9.351  -3.850
   67    HB2  TYR  10           2HB      TYR  10  -5.246   7.593  -2.385
   68    HB3  TYR  10           1HB      TYR  10  -5.180   6.457  -3.724
   69    HD1  TYR  10           2HD      TYR  10  -3.541   9.323  -2.126
   70    HD2  TYR  10           1HD      TYR  10  -3.382   6.552  -5.356
   71    HE1  TYR  10           2HE      TYR  10  -1.214   9.984  -2.577
   72    HE2  TYR  10           1HE      TYR  10  -1.060   7.205  -5.810
   73    HH   TYR  10           HH       TYR  10   0.838   8.845  -3.693
   74    H    ILE  11           HN       ILE  11  -6.400   6.413  -5.789
   75    HA   ILE  11           HA       ILE  11  -4.694   7.157  -7.887
   76    HB   ILE  11           HB       ILE  11  -7.048   5.262  -7.893
   77   HG12  ILE  11          2HG1      ILE  11  -4.081   4.718  -7.679
   78   HG13  ILE  11          1HG1      ILE  11  -5.175   4.785  -6.303
   79   HG21  ILE  11          1HG2      ILE  11  -4.825   5.544  -9.912
   80   HG22  ILE  11          2HG2      ILE  11  -6.518   5.964 -10.168
   81   HG23  ILE  11          3HG2      ILE  11  -6.057   4.282  -9.901
   82   HD11  ILE  11          3HD1      ILE  11  -6.415   2.894  -7.193
   83   HD12  ILE  11          1HD1      ILE  11  -4.711   2.497  -6.972
   84   HD13  ILE  11          2HD1      ILE  11  -5.337   2.833  -8.586
   85    H    LYS  12           HN       LYS  12  -8.229   7.475  -7.583
   86    HA   LYS  12           HA       LYS  12  -8.623   8.677 -10.098
   87    HB2  LYS  12           2HB      LYS  12 -10.278   8.806  -7.576
   88    HB3  LYS  12           1HB      LYS  12 -10.796   9.478  -9.118
   89    HG2  LYS  12           2HG      LYS  12 -10.592   7.220 -10.115
   90    HG3  LYS  12           1HG      LYS  12 -10.219   6.585  -8.511
   91    HD2  LYS  12           2HD      LYS  12 -12.389   7.375  -7.698
   92    HD3  LYS  12           1HD      LYS  12 -12.761   8.006  -9.306
   93    HE2  LYS  12           2HE      LYS  12 -12.474   5.682 -10.190
   94    HE3  LYS  12           1HE      LYS  12 -12.334   5.126  -8.525
   95    HZ1  LYS  12           3HZ      LYS  12 -14.688   6.562  -9.631
   96    HZ2  LYS  12           1HZ      LYS  12 -14.554   5.884  -8.080
   97    HZ3  LYS  12           2HZ      LYS  12 -14.583   4.879  -9.448
   98    H    ALA  13           HN       ALA  13  -7.740  10.010  -6.977
   99    HA   ALA  13           HA       ALA  13  -8.125  12.734  -7.659
  100    HB1  ALA  13           1HB      ALA  13  -7.921  11.940  -5.346
  101    HB2  ALA  13           2HB      ALA  13  -6.775  13.230  -5.708
  102    HB3  ALA  13           3HB      ALA  13  -6.224  11.556  -5.639
  103    H    HIS  14           HN       HIS  14  -5.809  10.472  -8.705
  104    HA   HIS  14           HA       HIS  14  -4.063  12.661  -9.626
  105    HB2  HIS  14           2HB      HIS  14  -3.341   9.949  -8.566
  106    HB3  HIS  14           1HB      HIS  14  -2.262  10.787  -9.675
  107    HD1  HIS  14           1HD      HIS  14  -1.706  10.108  -6.597
  108    HD2  HIS  14           2HD      HIS  14  -2.785  13.794  -8.186
  109    HE1  HIS  14           1HE      HIS  14  -0.870  11.823  -4.958
  110    HE2  HIS  14           2HE      HIS  14  -1.366  14.049  -6.035
  111    H    ARG  15           HN       ARG  15  -6.358  10.754 -10.795
  112    HA   ARG  15           HA       ARG  15  -5.086   9.448 -12.974
  113    HB2  ARG  15           2HB      ARG  15  -7.339   9.240 -13.938
  114    HB3  ARG  15           1HB      ARG  15  -7.301   8.760 -12.247
  115    HG2  ARG  15           2HG      ARG  15  -8.262  10.903 -11.606
  116    HG3  ARG  15           1HG      ARG  15  -8.279  11.406 -13.299
  117    HD2  ARG  15           2HD      ARG  15  -9.929   9.851 -13.863
  118    HD3  ARG  15           1HD      ARG  15  -9.668   8.905 -12.397
  119    HE   ARG  15           HE       ARG  15 -10.518  11.169 -11.333
  120   HH11  ARG  15          1HH1      ARG  15 -11.738   9.516 -14.171
  121   HH12  ARG  15          2HH1      ARG  15 -13.383  10.020 -13.913
  122   HH21  ARG  15          1HH2      ARG  15 -12.654  11.818 -10.983
  123   HH22  ARG  15          2HH2      ARG  15 -13.902  11.340 -12.096
  124    H    SER  16           HN       SER  16  -6.195  12.696 -12.443
  125    HA   SER  16           HA       SER  16  -6.092  13.565 -15.137
  126    HB2  SER  16           2HB      SER  16  -5.843  15.100 -12.537
  127    HB3  SER  16           1HB      SER  16  -6.121  15.810 -14.119
  128    HG   SER  16           HG       SER  16  -8.135  15.588 -13.540
  129    H    SER  17           HN       SER  17  -3.761  13.071 -12.619
  130    HA   SER  17           HA       SER  17  -1.671  14.590 -13.903
  131    HB2  SER  17           2HB      SER  17  -1.134  12.594 -11.743
  132    HB3  SER  17           1HB      SER  17  -0.472  14.212 -11.967
  133    HG   SER  17           HG       SER  17  -2.049  15.022 -10.823
  134    H    TRP  18           HN       TRP  18  -2.788  11.305 -13.685
  135    HA   TRP  18           HA       TRP  18  -0.399  10.266 -14.996
  136    HB2  TRP  18           2HB      TRP  18  -2.771   8.866 -13.757
  137    HB3  TRP  18           1HB      TRP  18  -1.398   8.047 -14.491
  138    HD1  TRP  18           1HD      TRP  18   0.673  10.318 -13.069
  139    HE1  TRP  18           1HE      TRP  18   1.305   9.860 -10.614
  140    HE3  TRP  18           3HE      TRP  18  -3.132   7.138 -11.829
  141    HZ2  TRP  18           2HZ      TRP  18   0.324   8.343  -8.447
  142    HZ3  TRP  18           3HZ      TRP  18  -3.208   6.222  -9.551
  143    HH2  TRP  18           2HH      TRP  18  -1.519   6.815  -7.892
  144    H    LYS  19           HN       LYS  19  -1.938  11.875 -16.653
  145    HA   LYS  19           HA       LYS  19  -2.909   9.890 -18.569
  146    HB2  LYS  19           2HB      LYS  19  -4.431  11.582 -19.501
  147    HB3  LYS  19           1HB      LYS  19  -4.824  11.226 -17.828
  148    HG2  LYS  19           2HG      LYS  19  -3.724  13.288 -17.122
  149    HG3  LYS  19           1HG      LYS  19  -3.303  13.639 -18.801
  150    HD2  LYS  19           2HD      LYS  19  -5.663  13.749 -19.385
  151    HD3  LYS  19           1HD      LYS  19  -6.110  13.334 -17.729
  152    HE2  LYS  19           2HE      LYS  19  -5.010  15.398 -16.947
  153    HE3  LYS  19           1HE      LYS  19  -4.642  15.812 -18.622
  154    HZ1  LYS  19           3HZ      LYS  19  -7.371  15.447 -17.509
  155    HZ2  LYS  19           1HZ      LYS  19  -6.995  15.896 -19.099
  156    HZ3  LYS  19           2HZ      LYS  19  -6.631  16.944 -17.819
  157    H    ASN  20           HN       ASN  20  -0.635  10.890 -20.763
  158    HA   ASN  20           HA       ASN  20  -3.010   9.421 -19.946
  159    HB2  ASN  20           2HB      ASN  20  -3.363  10.251 -22.163
  160    HB3  ASN  20           1HB      ASN  20  -1.751   9.763 -22.671
  161   HD21  ASN  20          1HD2      ASN  20  -1.425   7.734 -23.422
  162   HD22  ASN  20          2HD2      ASN  20  -2.684   6.553 -23.596
  163    H    THR  21           HN       THR  21  -2.100   8.052 -18.511
  164    HA   THR  21           HA       THR  21  -0.255   6.060 -19.642
  165    HB   THR  21           HB       THR  21   0.831   5.831 -17.427
  166    HG1  THR  21           1HG      THR  21  -1.102   7.706 -16.773
  167   HG21  THR  21          3HG2      THR  21   0.979   8.626 -18.560
  168   HG22  THR  21          1HG2      THR  21   1.879   7.228 -19.146
  169   HG23  THR  21          2HG2      THR  21   2.185   7.859 -17.530
  170    H    LYS  22           HN       LYS  22  -0.660   3.939 -19.111
  171    HA   LYS  22           HA       LYS  22  -3.198   3.386 -17.830
  172    HB2  LYS  22           2HB      LYS  22  -1.288   1.824 -19.482
  173    HB3  LYS  22           1HB      LYS  22  -2.300   0.933 -18.355
  174    HG2  LYS  22           2HG      LYS  22  -4.243   2.253 -19.420
  175    HG3  LYS  22           1HG      LYS  22  -3.101   2.558 -20.729
  176    HD2  LYS  22           2HD      LYS  22  -4.511   0.574 -21.144
  177    HD3  LYS  22           1HD      LYS  22  -2.792   0.182 -21.063
  178    HE2  LYS  22           2HE      LYS  22  -3.988  -1.496 -19.843
  179    HE3  LYS  22           1HE      LYS  22  -3.122  -0.490 -18.686
  180    HZ1  LYS  22           3HZ      LYS  22  -5.262  -0.823 -17.802
  181    HZ2  LYS  22           1HZ      LYS  22  -6.029  -0.487 -19.279
  182    HZ3  LYS  22           2HZ      LYS  22  -5.279   0.761 -18.414
  183    H    HIS  23           HN       HIS  23  -0.118   3.831 -16.659
  184    HA   HIS  23           HA       HIS  23   0.112   1.658 -14.907
  185    HB2  HIS  23           2HB      HIS  23   1.752   2.919 -13.648
  186    HB3  HIS  23           1HB      HIS  23   2.039   3.073 -15.367
  187    HD1  HIS  23           1HD      HIS  23   2.916   5.308 -15.859
  188    HD2  HIS  23           2HD      HIS  23   0.078   5.414 -12.819
  189    HE1  HIS  23           1HE      HIS  23   2.794   7.708 -15.126
  190    HE2  HIS  23           2HE      HIS  23   1.234   7.702 -13.150
  191    H    ALA  24           HN       ALA  24  -1.817   4.541 -14.690
  192    HA   ALA  24           HA       ALA  24  -2.524   4.498 -11.990
  193    HB1  ALA  24           1HB      ALA  24  -4.276   5.135 -14.362
  194    HB2  ALA  24           2HB      ALA  24  -3.200   6.263 -13.539
  195    HB3  ALA  24           3HB      ALA  24  -4.592   5.592 -12.690
  196    H    ASP  25           HN       ASP  25  -3.827   2.670 -14.718
  197    HA   ASP  25           HA       ASP  25  -5.826   1.244 -13.307
  198    HB2  ASP  25           2HB      ASP  25  -5.879   1.423 -15.723
  199    HB3  ASP  25           1HB      ASP  25  -4.323   0.628 -15.860
  200    H    GLN  26           HN       GLN  26  -2.493   0.530 -14.169
  201    HA   GLN  26           HA       GLN  26  -2.301  -2.033 -13.086
  202    HB2  GLN  26           2HB      GLN  26  -0.243   0.126 -13.497
  203    HB3  GLN  26           1HB      GLN  26   0.164  -1.480 -12.928
  204    HG2  GLN  26           2HG      GLN  26  -1.279  -0.969 -15.509
  205    HG3  GLN  26           1HG      GLN  26   0.475  -1.081 -15.380
  206   HE21  GLN  26          1HE2      GLN  26   0.547  -2.871 -16.720
  207   HE22  GLN  26          2HE2      GLN  26   0.030  -4.437 -16.206
  208    H    TRP  27           HN       TRP  27  -1.994   1.134 -11.563
  209    HA   TRP  27           HA       TRP  27  -1.051   0.396  -9.060
  210    HB2  TRP  27           2HB      TRP  27  -2.816   2.582 -10.055
  211    HB3  TRP  27           1HB      TRP  27  -2.763   2.307  -8.320
  212    HD1  TRP  27           1HD      TRP  27  -0.171   2.898 -11.175
  213    HE1  TRP  27           1HE      TRP  27   1.708   4.384 -10.219
  214    HE3  TRP  27           3HE      TRP  27  -1.828   3.291  -6.354
  215    HZ2  TRP  27           2HZ      TRP  27   2.387   5.556  -7.750
  216    HZ3  TRP  27           3HZ      TRP  27  -0.506   4.617  -4.760
  217    HH2  TRP  27           2HH      TRP  27   1.559   5.726  -5.444
  218    H    THR  28           HN       THR  28  -4.418   0.531 -10.190
  219    HA   THR  28           HA       THR  28  -5.526  -0.560  -7.805
  220    HB   THR  28           HB       THR  28  -6.771  -0.661 -10.557
  221    HG1  THR  28           1HG      THR  28  -6.016   1.508  -9.141
  222   HG21  THR  28          3HG2      THR  28  -8.870  -0.460  -9.301
  223   HG22  THR  28          1HG2      THR  28  -7.963  -0.440  -7.790
  224   HG23  THR  28          2HG2      THR  28  -7.958  -1.883  -8.802
  225    H    ASN  29           HN       ASN  29  -4.572  -1.884 -10.920
  226    HA   ASN  29           HA       ASN  29  -5.714  -4.418 -10.734
  227    HB2  ASN  29           2HB      ASN  29  -4.543  -3.155 -12.704
  228    HB3  ASN  29           1HB      ASN  29  -3.090  -3.957 -12.121
  229   HD21  ASN  29          1HD2      ASN  29  -6.102  -4.304 -13.738
  230   HD22  ASN  29          2HD2      ASN  29  -5.901  -5.948 -14.220
  231    H    THR  30           HN       THR  30  -2.408  -3.381  -9.886
  232    HA   THR  30           HA       THR  30  -1.535  -5.943  -9.063
  233    HB   THR  30           HB       THR  30  -0.429  -3.279  -8.155
  234    HG1  THR  30           1HG      THR  30  -0.344  -4.605 -10.610
  235   HG21  THR  30          3HG2      THR  30   1.678  -4.503  -7.957
  236   HG22  THR  30          1HG2      THR  30   0.873  -5.989  -8.467
  237   HG23  THR  30          2HG2      THR  30   0.433  -5.227  -6.938
  238    H    ILE  31           HN       ILE  31  -2.780  -3.151  -7.233
  239    HA   ILE  31           HA       ILE  31  -2.402  -4.261  -4.670
  240    HB   ILE  31           HB       ILE  31  -4.364  -2.159  -5.601
  241   HG12  ILE  31          2HG1      ILE  31  -1.735  -1.937  -4.118
  242   HG13  ILE  31          1HG1      ILE  31  -1.971  -1.586  -5.826
  243   HG21  ILE  31          1HG2      ILE  31  -5.197  -3.201  -3.561
  244   HG22  ILE  31          2HG2      ILE  31  -4.632  -1.560  -3.240
  245   HG23  ILE  31          3HG2      ILE  31  -3.636  -2.941  -2.780
  246   HD11  ILE  31          3HD1      ILE  31  -3.486   0.237  -5.238
  247   HD12  ILE  31          1HD1      ILE  31  -1.895   0.451  -4.511
  248   HD13  ILE  31          2HD1      ILE  31  -3.246  -0.119  -3.528
  249    H    LYS  32           HN       LYS  32  -5.147  -4.351  -6.901
  250    HA   LYS  32           HA       LYS  32  -6.984  -5.580  -5.168
  251    HB2  LYS  32           2HB      LYS  32  -7.472  -4.500  -7.405
  252    HB3  LYS  32           1HB      LYS  32  -6.858  -5.963  -8.158
  253    HG2  LYS  32           2HG      LYS  32  -8.574  -7.277  -7.020
  254    HG3  LYS  32           1HG      LYS  32  -9.203  -5.807  -6.277
  255    HD2  LYS  32           2HD      LYS  32  -9.690  -4.906  -8.509
  256    HD3  LYS  32           1HD      LYS  32  -9.085  -6.396  -9.235
  257    HE2  LYS  32           2HE      LYS  32 -10.807  -7.665  -8.031
  258    HE3  LYS  32           1HE      LYS  32 -11.422  -6.164  -7.343
  259    HZ1  LYS  32           3HZ      LYS  32 -11.919  -5.395  -9.590
  260    HZ2  LYS  32           1HZ      LYS  32 -12.730  -6.841  -9.234
  261    HZ3  LYS  32           2HZ      LYS  32 -11.361  -6.865 -10.230
  262    H    THR  33           HN       THR  33  -4.389  -6.864  -7.105
  263    HA   THR  33           HA       THR  33  -5.271  -9.591  -6.928
  264    HB   THR  33           HB       THR  33  -2.519  -8.564  -7.652
  265    HG1  THR  33           1HG      THR  33  -3.855  -7.655  -9.144
  266   HG21  THR  33          3HG2      THR  33  -2.575 -10.958  -7.170
  267   HG22  THR  33          1HG2      THR  33  -2.337 -10.677  -8.896
  268   HG23  THR  33          2HG2      THR  33  -3.922 -11.165  -8.292
  269    H    TYR  34           HN       TYR  34  -2.595  -7.745  -5.437
  270    HA   TYR  34           HA       TYR  34  -1.878  -9.997  -3.790
  271    HB2  TYR  34           2HB      TYR  34  -0.808  -7.198  -4.040
  272    HB3  TYR  34           1HB      TYR  34  -0.222  -8.313  -2.809
  273    HD1  TYR  34           1HD      TYR  34  -0.412  -7.659  -6.426
  274    HD2  TYR  34           2HD      TYR  34   1.188 -10.166  -3.385
  275    HE1  TYR  34           1HE      TYR  34   1.127  -8.655  -8.064
  276    HE2  TYR  34           2HE      TYR  34   2.731 -11.168  -5.015
  277    HH   TYR  34           HH       TYR  34   3.213  -9.853  -8.144
  278    H    CYS  35           HN       CYS  35  -3.255  -6.776  -3.144
  279    HA   CYS  35           HA       CYS  35  -3.426  -7.432  -0.305
  280    HB2  CYS  35           2HB      CYS  35  -4.143  -4.845  -1.693
  281    HB3  CYS  35           1HB      CYS  35  -3.882  -5.087   0.031
  282    HG   CYS  35           HG       CYS  35  -1.207  -5.243  -0.029
  283    H    GLY  36           HN       GLY  36  -5.421  -7.137  -3.094
  284    HA2  GLY  36           2HA      GLY  36  -7.865  -6.339  -2.193
  285    HA3  GLY  36           1HA      GLY  36  -7.647  -7.533  -3.458
  286    HA   PRO  37           HA       PRO  37  -9.469 -10.707  -1.097
  287    HB2  PRO  37           2HB      PRO  37  -7.123 -12.475  -1.033
  288    HB3  PRO  37           1HB      PRO  37  -8.676 -12.696  -1.845
  289    HG2  PRO  37           2HG      PRO  37  -6.411 -12.188  -3.211
  290    HG3  PRO  37           1HG      PRO  37  -7.991 -11.582  -3.740
  291    HD2  PRO  37           2HD      PRO  37  -5.787 -10.146  -2.312
  292    HD3  PRO  37           1HD      PRO  37  -6.826  -9.581  -3.637
  293    H    VAL  38           HN       VAL  38  -6.680  -9.298   0.232
  294    HA   VAL  38           HA       VAL  38  -6.987 -10.797   2.744
  295    HB   VAL  38           HB       VAL  38  -4.660  -9.042   1.947
  296   HG11  VAL  38          1HG1      VAL  38  -3.505 -10.131   3.804
  297   HG12  VAL  38          2HG1      VAL  38  -4.964 -11.050   4.181
  298   HG13  VAL  38          3HG1      VAL  38  -4.956  -9.296   4.360
  299   HG21  VAL  38          3HG2      VAL  38  -4.921 -12.045   1.818
  300   HG22  VAL  38          1HG2      VAL  38  -3.437 -11.130   1.541
  301   HG23  VAL  38          2HG2      VAL  38  -4.807 -10.943   0.445
  302    H    ILE  39           HN       ILE  39  -5.875  -7.496   1.961
  303    HA   ILE  39           HA       ILE  39  -7.369  -6.569   4.323
  304    HB   ILE  39           HB       ILE  39  -5.766  -4.683   4.402
  305   HG12  ILE  39          2HG1      ILE  39  -4.290  -6.228   2.253
  306   HG13  ILE  39          1HG1      ILE  39  -5.144  -4.711   2.001
  307   HG21  ILE  39          1HG2      ILE  39  -4.519  -7.429   4.485
  308   HG22  ILE  39          2HG2      ILE  39  -5.405  -6.642   5.792
  309   HG23  ILE  39          3HG2      ILE  39  -3.861  -5.983   5.250
  310   HD11  ILE  39          3HD1      ILE  39  -2.762  -5.108   3.793
  311   HD12  ILE  39          1HD1      ILE  39  -3.608  -3.586   3.516
  312   HD13  ILE  39          2HD1      ILE  39  -2.747  -4.372   2.192
  313    H    GLY  40           HN       GLY  40  -7.832  -6.691   1.177
  314    HA2  GLY  40           2HA      GLY  40  -8.154  -4.079   0.242
  315    HA3  GLY  40           1HA      GLY  40  -9.017  -5.482  -0.361
  316    HA   PRO  41           HA       PRO  41 -12.770  -4.038   1.390
  317    HB2  PRO  41           2HB      PRO  41 -13.926  -6.142   2.621
  318    HB3  PRO  41           1HB      PRO  41 -13.712  -6.072   0.868
  319    HG2  PRO  41           2HG      PRO  41 -12.081  -7.506   2.921
  320    HG3  PRO  41           1HG      PRO  41 -12.612  -8.064   1.325
  321    HD2  PRO  41           2HD      PRO  41 -10.106  -7.113   1.823
  322    HD3  PRO  41           1HD      PRO  41 -10.900  -6.993   0.241
  323    H    LEU  42           HN       LEU  42 -10.301  -4.622   3.487
  324    HA   LEU  42           HA       LEU  42 -11.750  -4.310   5.964
  325    HB2  LEU  42           2HB      LEU  42  -8.801  -4.152   5.335
  326    HB3  LEU  42           1HB      LEU  42  -9.472  -4.023   6.949
  327    HG   LEU  42           HG       LEU  42  -9.638  -6.445   5.156
  328   HD11  LEU  42          1HD1      LEU  42  -8.160  -7.470   6.808
  329   HD12  LEU  42          2HD1      LEU  42  -8.083  -5.947   7.690
  330   HD13  LEU  42          3HD1      LEU  42  -7.404  -6.058   6.067
  331   HD21  LEU  42          3HD2      LEU  42 -10.606  -6.027   7.981
  332   HD22  LEU  42          1HD2      LEU  42 -10.612  -7.558   7.104
  333   HD23  LEU  42          2HD2      LEU  42 -11.623  -6.221   6.554
  334    H    SER  43           HN       SER  43 -11.865  -2.439   7.219
  335    HA   SER  43           HA       SER  43 -12.087  -0.010   5.922
  336    HB2  SER  43           2HB      SER  43 -11.606  -0.482   8.867
  337    HB3  SER  43           1HB      SER  43 -12.458   0.853   8.119
  338    HG   SER  43           HG       SER  43 -13.333  -1.682   8.703
  339    H    VAL  44           HN       VAL  44 -10.748   1.746   5.731
  340    HA   VAL  44           HA       VAL  44  -7.968   1.151   5.552
  341    HB   VAL  44           HB       VAL  44  -9.316   2.685   4.037
  342   HG11  VAL  44          1HG1      VAL  44 -10.393   4.041   5.713
  343   HG12  VAL  44          2HG1      VAL  44  -9.402   5.053   4.662
  344   HG13  VAL  44          3HG1      VAL  44  -8.831   4.632   6.277
  345   HG21  VAL  44          3HG2      VAL  44  -7.405   4.110   3.546
  346   HG22  VAL  44          1HG2      VAL  44  -6.901   2.456   3.892
  347   HG23  VAL  44          2HG2      VAL  44  -6.699   3.710   5.112
  348    H    GLN  45           HN       GLN  45  -9.906   2.304   8.074
  349    HA   GLN  45           HA       GLN  45  -7.736   3.554   9.553
  350    HB2  GLN  45           2HB      GLN  45 -10.069   4.344   9.769
  351    HB3  GLN  45           1HB      GLN  45 -10.517   2.779  10.435
  352    HG2  GLN  45           2HG      GLN  45  -8.929   3.167  12.290
  353    HG3  GLN  45           1HG      GLN  45  -8.632   4.782  11.649
  354   HE21  GLN  45          1HE2      GLN  45  -9.415   5.819  13.452
  355   HE22  GLN  45          2HE2      GLN  45 -11.097   5.854  13.829
  356    H    ASP  46           HN       ASP  46  -9.230   0.481   9.133
  357    HA   ASP  46           HA       ASP  46  -8.235  -0.600  11.633
  358    HB2  ASP  46           2HB      ASP  46 -10.066  -1.601   9.482
  359    HB3  ASP  46           1HB      ASP  46  -9.368  -2.723  10.642
  360    H    VAL  47           HN       VAL  47  -7.246  -0.384   8.377
  361    HA   VAL  47           HA       VAL  47  -5.702  -2.691   8.081
  362    HB   VAL  47           HB       VAL  47  -5.051   0.084   7.056
  363   HG11  VAL  47          1HG1      VAL  47  -3.117  -1.402   6.973
  364   HG12  VAL  47          2HG1      VAL  47  -3.728  -1.083   5.351
  365   HG13  VAL  47          3HG1      VAL  47  -4.077  -2.622   6.137
  366   HG21  VAL  47          3HG2      VAL  47  -7.262  -0.674   6.346
  367   HG22  VAL  47          1HG2      VAL  47  -6.563  -2.179   5.752
  368   HG23  VAL  47          2HG2      VAL  47  -6.141  -0.647   4.984
  369    H    ASP  48           HN       ASP  48  -4.326  -3.419   9.538
  370    HA   ASP  48           HA       ASP  48  -2.712  -1.501  11.067
  371    HB2  ASP  48           2HB      ASP  48  -4.216  -2.809  12.448
  372    HB3  ASP  48           1HB      ASP  48  -3.600  -4.305  11.773
  373    H    THR  49           HN       THR  49  -0.610  -2.355  11.800
  374    HA   THR  49           HA       THR  49   0.970  -2.952   9.529
  375    HB   THR  49           HB       THR  49   1.751  -3.002  12.452
  376    HG1  THR  49           1HG      THR  49   1.998  -0.924  10.503
  377   HG21  THR  49          3HG2      THR  49   3.469  -2.709   9.980
  378   HG22  THR  49          1HG2      THR  49   3.384  -4.142  11.003
  379   HG23  THR  49          2HG2      THR  49   4.027  -2.634  11.650
  380    H    LYS  50           HN       LYS  50  -0.289  -4.940  12.174
  381    HA   LYS  50           HA       LYS  50   1.261  -7.251  11.601
  382    HB2  LYS  50           2HB      LYS  50  -0.310  -6.609  13.645
  383    HB3  LYS  50           1HB      LYS  50  -1.510  -7.479  12.704
  384    HG2  LYS  50           2HG      LYS  50   1.140  -8.627  13.550
  385    HG3  LYS  50           1HG      LYS  50  -0.371  -8.842  14.430
  386    HD2  LYS  50           2HD      LYS  50  -1.351  -9.979  12.520
  387    HD3  LYS  50           1HD      LYS  50   0.117  -9.701  11.578
  388    HE2  LYS  50           2HE      LYS  50   1.383 -11.050  13.206
  389    HE3  LYS  50           1HE      LYS  50  -0.111 -11.360  14.088
  390    HZ1  LYS  50           3HZ      LYS  50   0.464 -13.198  12.629
  391    HZ2  LYS  50           1HZ      LYS  50   0.430 -12.175  11.280
  392    HZ3  LYS  50           2HZ      LYS  50  -0.995 -12.483  12.142
  393    H    LEU  51           HN       LEU  51  -1.835  -6.037  10.451
  394    HA   LEU  51           HA       LEU  51  -2.555  -8.301   8.927
  395    HB2  LEU  51           2HB      LEU  51  -3.334  -5.407   8.571
  396    HB3  LEU  51           1HB      LEU  51  -4.131  -6.774   7.823
  397    HG   LEU  51           HG       LEU  51  -4.038  -6.153  10.766
  398   HD11  LEU  51          1HD1      LEU  51  -6.317  -6.141   8.798
  399   HD12  LEU  51          2HD1      LEU  51  -5.554  -4.721   9.513
  400   HD13  LEU  51          3HD1      LEU  51  -6.448  -5.847  10.533
  401   HD21  LEU  51          3HD2      LEU  51  -5.545  -8.074  11.026
  402   HD22  LEU  51          1HD2      LEU  51  -3.958  -8.553  10.420
  403   HD23  LEU  51          2HD2      LEU  51  -5.330  -8.457   9.316
  404    H    ILE  52           HN       ILE  52  -0.746  -5.355   8.210
  405    HA   ILE  52           HA       ILE  52  -0.334  -5.879   5.456
  406    HB   ILE  52           HB       ILE  52   1.394  -4.269   7.349
  407   HG12  ILE  52          2HG1      ILE  52  -0.797  -3.391   5.455
  408   HG13  ILE  52          1HG1      ILE  52  -0.952  -3.490   7.205
  409   HG21  ILE  52          1HG2      ILE  52   1.282  -4.269   4.333
  410   HG22  ILE  52          2HG2      ILE  52   2.604  -4.883   5.324
  411   HG23  ILE  52          3HG2      ILE  52   2.229  -3.161   5.327
  412   HD11  ILE  52          3HD1      ILE  52   0.924  -1.680   5.705
  413   HD12  ILE  52          1HD1      ILE  52   0.753  -1.773   7.458
  414   HD13  ILE  52          2HD1      ILE  52  -0.592  -1.205   6.469
  415    H    MET  53           HN       MET  53   1.475  -6.706   8.375
  416    HA   MET  53           HA       MET  53   3.705  -7.917   7.221
  417    HB2  MET  53           2HB      MET  53   2.228  -8.350   9.792
  418    HB3  MET  53           1HB      MET  53   3.537  -9.434   9.347
  419    HG2  MET  53           2HG      MET  53   3.785  -6.448   9.598
  420    HG3  MET  53           1HG      MET  53   4.236  -7.610  10.844
  421    HE1  MET  53           3HE      MET  53   6.746  -6.869  11.075
  422    HE2  MET  53           1HE      MET  53   6.305  -5.518  10.035
  423    HE3  MET  53           2HE      MET  53   7.755  -6.461   9.689
  424    H    LYS  54           HN       LYS  54   0.460  -9.185   7.784
  425    HA   LYS  54           HA       LYS  54   0.934 -11.866   7.133
  426    HB2  LYS  54           2HB      LYS  54  -1.548 -10.206   6.659
  427    HB3  LYS  54           1HB      LYS  54  -1.476 -11.955   6.532
  428    HG2  LYS  54           2HG      LYS  54  -0.827 -12.059   8.917
  429    HG3  LYS  54           1HG      LYS  54  -1.050 -10.311   9.015
  430    HD2  LYS  54           2HD      LYS  54  -3.028 -11.517   9.820
  431    HD3  LYS  54           1HD      LYS  54  -3.395 -10.562   8.382
  432    HE2  LYS  54           2HE      LYS  54  -3.122 -12.601   7.007
  433    HE3  LYS  54           1HE      LYS  54  -2.866 -13.529   8.483
  434    HZ1  LYS  54           3HZ      LYS  54  -5.055 -13.291   9.120
  435    HZ2  LYS  54           1HZ      LYS  54  -5.198 -13.451   7.437
  436    HZ3  LYS  54           2HZ      LYS  54  -5.313 -11.920   8.155
  437    H    VAL  55           HN       VAL  55   0.211  -9.084   5.095
  438    HA   VAL  55           HA       VAL  55  -0.042 -10.600   2.685
  439    HB   VAL  55           HB       VAL  55   0.461  -7.633   2.984
  440   HG11  VAL  55          1HG1      VAL  55  -0.692  -9.238   0.708
  441   HG12  VAL  55          2HG1      VAL  55   0.879  -8.440   0.737
  442   HG13  VAL  55          3HG1      VAL  55  -0.599  -7.479   0.774
  443   HG21  VAL  55          3HG2      VAL  55  -1.963  -7.372   2.798
  444   HG22  VAL  55          1HG2      VAL  55  -1.515  -8.289   4.236
  445   HG23  VAL  55          2HG2      VAL  55  -2.151  -9.125   2.820
  446    H    LEU  56           HN       LEU  56   2.508  -8.591   4.114
  447    HA   LEU  56           HA       LEU  56   4.165  -8.802   1.777
  448    HB2  LEU  56           2HB      LEU  56   4.627  -7.595   4.492
  449    HB3  LEU  56           1HB      LEU  56   5.828  -7.574   3.217
  450    HG   LEU  56           HG       LEU  56   3.105  -6.273   3.107
  451   HD11  LEU  56          1HD1      LEU  56   4.376  -4.189   3.107
  452   HD12  LEU  56          2HD1      LEU  56   5.876  -5.099   3.274
  453   HD13  LEU  56          3HD1      LEU  56   4.682  -5.123   4.571
  454   HD21  LEU  56          3HD2      LEU  56   3.771  -7.078   0.912
  455   HD22  LEU  56          1HD2      LEU  56   5.347  -6.310   1.090
  456   HD23  LEU  56          2HD2      LEU  56   3.892  -5.321   0.984
  457    H    ASP  57           HN       ASP  57   3.993 -10.491   4.836
  458    HA   ASP  57           HA       ASP  57   6.570 -11.316   5.249
  459    HB2  ASP  57           2HB      ASP  57   4.569 -11.830   6.694
  460    HB3  ASP  57           1HB      ASP  57   4.209 -13.149   5.612
  461    HA   PRO  58           HA       PRO  58   6.131 -15.146   2.388
  462    HB2  PRO  58           2HB      PRO  58   4.076 -15.168   0.593
  463    HB3  PRO  58           1HB      PRO  58   3.996 -15.936   2.182
  464    HG2  PRO  58           2HG      PRO  58   2.898 -13.312   1.283
  465    HG3  PRO  58           1HG      PRO  58   2.190 -14.513   2.378
  466    HD2  PRO  58           2HD      PRO  58   3.398 -12.234   3.247
  467    HD3  PRO  58           1HD      PRO  58   3.366 -13.729   4.194
  468    H    ILE  59           HN       ILE  59   5.036 -12.039   1.141
  469    HA   ILE  59           HA       ILE  59   6.030 -12.398  -1.493
  470    HB   ILE  59           HB       ILE  59   5.494  -9.787  -0.076
  471   HG12  ILE  59          2HG1      ILE  59   3.557 -11.307   0.035
  472   HG13  ILE  59          1HG1      ILE  59   3.243  -9.915  -0.988
  473   HG21  ILE  59          1HG2      ILE  59   5.101  -8.922  -2.332
  474   HG22  ILE  59          2HG2      ILE  59   5.522 -10.495  -3.008
  475   HG23  ILE  59          3HG2      ILE  59   6.739  -9.545  -2.157
  476   HD11  ILE  59          3HD1      ILE  59   3.960 -12.673  -1.947
  477   HD12  ILE  59          1HD1      ILE  59   3.623 -11.276  -2.969
  478   HD13  ILE  59          2HD1      ILE  59   2.349 -11.959  -1.956
  479    H    TRP  60           HN       TRP  60   7.442 -11.149   1.491
  480    HA   TRP  60           HA       TRP  60   9.714  -9.898   0.492
  481    HB2  TRP  60           2HB      TRP  60   9.386 -11.553   2.999
  482    HB3  TRP  60           1HB      TRP  60  10.840 -10.638   2.631
  483    HD1  TRP  60           1HD      TRP  60   8.051 -10.315   4.775
  484    HE1  TRP  60           1HE      TRP  60   7.435  -7.869   5.271
  485    HE3  TRP  60           3HE      TRP  60  10.575  -8.051   0.949
  486    HZ2  TRP  60           2HZ      TRP  60   7.938  -5.322   4.184
  487    HZ3  TRP  60           3HZ      TRP  60  10.451  -5.599   0.748
  488    HH2  TRP  60           2HH      TRP  60   9.159  -4.265   2.333
  489    H    GLU  61           HN       GLU  61   9.076 -13.338   0.939
  490    HA   GLU  61           HA       GLU  61  11.729 -14.080   0.105
  491    HB2  GLU  61           2HB      GLU  61   9.260 -15.635   0.841
  492    HB3  GLU  61           1HB      GLU  61  10.728 -16.389   0.276
  493    HG2  GLU  61           2HG      GLU  61  11.923 -15.260   2.172
  494    HG3  GLU  61           1HG      GLU  61  10.330 -14.809   2.785
  495    H    GLN  62           HN       GLN  62   8.431 -14.187  -1.177
  496    HA   GLN  62           HA       GLN  62   9.052 -15.655  -3.511
  497    HB2  GLN  62           2HB      GLN  62   6.770 -13.757  -2.950
  498    HB3  GLN  62           1HB      GLN  62   6.862 -14.826  -4.338
  499    HG2  GLN  62           2HG      GLN  62   6.861 -15.773  -1.486
  500    HG3  GLN  62           1HG      GLN  62   5.414 -15.635  -2.481
  501   HE21  GLN  62          1HE2      GLN  62   4.945 -17.798  -2.400
  502   HE22  GLN  62          2HE2      GLN  62   5.888 -18.994  -3.234
  503    H    LYS  63           HN       LYS  63   8.398 -12.180  -3.087
  504    HA   LYS  63           HA       LYS  63  10.015 -11.602  -5.454
  505    HB2  LYS  63           2HB      LYS  63   7.180 -10.612  -5.045
  506    HB3  LYS  63           1HB      LYS  63   8.255 -10.126  -6.349
  507    HG2  LYS  63           2HG      LYS  63   8.205 -12.298  -7.311
  508    HG3  LYS  63           1HG      LYS  63   7.382 -12.967  -5.902
  509    HD2  LYS  63           2HD      LYS  63   5.409 -11.630  -6.400
  510    HD3  LYS  63           1HD      LYS  63   6.236 -10.903  -7.779
  511    HE2  LYS  63           2HE      LYS  63   6.400 -13.076  -8.853
  512    HE3  LYS  63           1HE      LYS  63   5.637 -13.841  -7.460
  513    HZ1  LYS  63           3HZ      LYS  63   4.301 -11.734  -9.060
  514    HZ2  LYS  63           1HZ      LYS  63   3.601 -12.787  -7.933
  515    HZ3  LYS  63           2HZ      LYS  63   4.156 -13.385  -9.418
  516    HA   PRO  64           HA       PRO  64  11.037  -9.055  -1.736
  517    HB2  PRO  64           2HB      PRO  64  13.500  -8.721  -3.364
  518    HB3  PRO  64           1HB      PRO  64  13.326  -9.129  -1.654
  519    HG2  PRO  64           2HG      PRO  64  14.007 -10.991  -3.426
  520    HG3  PRO  64           1HG      PRO  64  12.899 -11.366  -2.094
  521    HD2  PRO  64           2HD      PRO  64  12.295 -10.872  -4.979
  522    HD3  PRO  64           1HD      PRO  64  11.562 -12.035  -3.857
  523    H    GLU  65           HN       GLU  65  11.872  -8.160  -5.085
  524    HA   GLU  65           HA       GLU  65  11.989  -5.390  -4.563
  525    HB2  GLU  65           2HB      GLU  65  11.629  -6.896  -7.144
  526    HB3  GLU  65           1HB      GLU  65  12.063  -5.210  -7.005
  527    HG2  GLU  65           2HG      GLU  65  14.158  -5.746  -6.005
  528    HG3  GLU  65           1HG      GLU  65  13.709  -7.446  -5.882
  529    H    THR  66           HN       THR  66   9.467  -7.587  -5.574
  530    HA   THR  66           HA       THR  66   7.607  -5.578  -6.368
  531    HB   THR  66           HB       THR  66   7.005  -8.415  -5.509
  532    HG1  THR  66           1HG      THR  66   8.255  -7.362  -7.763
  533   HG21  THR  66          3HG2      THR  66   5.036  -6.958  -5.743
  534   HG22  THR  66          1HG2      THR  66   5.078  -8.196  -7.000
  535   HG23  THR  66          2HG2      THR  66   5.547  -6.539  -7.379
  536    H    ALA  67           HN       ALA  67   8.269  -7.321  -3.385
  537    HA   ALA  67           HA       ALA  67   6.006  -6.550  -1.921
  538    HB1  ALA  67           1HB      ALA  67   7.304  -7.107   0.066
  539    HB2  ALA  67           2HB      ALA  67   8.786  -7.108  -0.890
  540    HB3  ALA  67           3HB      ALA  67   7.540  -8.316  -1.195
  541    H    SER  68           HN       SER  68   9.186  -4.999  -2.244
  542    HA   SER  68           HA       SER  68   8.568  -2.864  -0.473
  543    HB2  SER  68           2HB      SER  68  10.628  -1.819  -1.609
  544    HB3  SER  68           1HB      SER  68  10.858  -3.331  -0.729
  545    HG   SER  68           HG       SER  68  11.582  -4.110  -2.528
  546    H    ARG  69           HN       ARG  69   8.434  -3.244  -3.991
  547    HA   ARG  69           HA       ARG  69   7.745  -0.572  -4.583
  548    HB2  ARG  69           2HB      ARG  69   7.390  -3.171  -6.060
  549    HB3  ARG  69           1HB      ARG  69   6.855  -1.645  -6.724
  550    HG2  ARG  69           2HG      ARG  69   9.125  -0.782  -6.640
  551    HG3  ARG  69           1HG      ARG  69   9.672  -2.301  -5.930
  552    HD2  ARG  69           2HD      ARG  69   8.899  -3.485  -7.956
  553    HD3  ARG  69           1HD      ARG  69   8.452  -1.935  -8.662
  554    HE   ARG  69           HE       ARG  69  11.117  -1.717  -7.947
  555   HH11  ARG  69          1HH1      ARG  69   9.172  -3.656 -10.122
  556   HH12  ARG  69          2HH1      ARG  69  10.468  -3.943 -11.240
  557   HH21  ARG  69          1HH2      ARG  69  12.840  -2.101  -9.424
  558   HH22  ARG  69          2HH2      ARG  69  12.553  -3.085 -10.829
  559    H    LEU  70           HN       LEU  70   5.825  -3.433  -3.845
  560    HA   LEU  70           HA       LEU  70   3.289  -2.233  -4.272
  561    HB2  LEU  70           2HB      LEU  70   3.627  -4.672  -4.149
  562    HB3  LEU  70           1HB      LEU  70   4.069  -4.525  -2.460
  563    HG   LEU  70           HG       LEU  70   1.769  -3.671  -1.988
  564   HD11  LEU  70          1HD1      LEU  70   0.032  -4.035  -3.672
  565   HD12  LEU  70          2HD1      LEU  70   1.267  -4.478  -4.850
  566   HD13  LEU  70          3HD1      LEU  70   1.214  -2.839  -4.201
  567   HD21  LEU  70          3HD2      LEU  70   2.341  -5.992  -1.581
  568   HD22  LEU  70          1HD2      LEU  70   1.974  -6.399  -3.258
  569   HD23  LEU  70          2HD2      LEU  70   0.685  -5.864  -2.179
  570    H    ARG  71           HN       ARG  71   5.391  -2.592  -1.450
  571    HA   ARG  71           HA       ARG  71   3.651  -1.443   0.440
  572    HB2  ARG  71           2HB      ARG  71   5.810  -2.706   0.900
  573    HB3  ARG  71           1HB      ARG  71   6.663  -1.219   0.502
  574    HG2  ARG  71           2HG      ARG  71   5.001  -0.221   2.304
  575    HG3  ARG  71           1HG      ARG  71   5.011  -1.892   2.869
  576    HD2  ARG  71           2HD      ARG  71   6.722  -0.776   4.055
  577    HD3  ARG  71           1HD      ARG  71   7.525  -1.766   2.837
  578    HE   ARG  71           HE       ARG  71   7.744   0.314   1.506
  579   HH11  ARG  71          1HH1      ARG  71   7.253   0.531   4.960
  580   HH12  ARG  71          2HH1      ARG  71   7.939   2.120   5.087
  581   HH21  ARG  71          1HH2      ARG  71   8.657   2.412   1.682
  582   HH22  ARG  71          2HH2      ARG  71   8.725   3.178   3.241
  583    H    GLY  72           HN       GLY  72   5.951  -0.054  -1.819
  584    HA2  GLY  72           2HA      GLY  72   6.064   2.557  -0.800
  585    HA3  GLY  72           1HA      GLY  72   6.375   2.104  -2.468
  586    H    ARG  73           HN       ARG  73   3.844   1.145  -3.197
  587    HA   ARG  73           HA       ARG  73   2.514   3.631  -3.640
  588    HB2  ARG  73           2HB      ARG  73   0.861   2.341  -4.898
  589    HB3  ARG  73           1HB      ARG  73   2.496   1.904  -5.360
  590    HG2  ARG  73           2HG      ARG  73   2.322  -0.101  -3.923
  591    HG3  ARG  73           1HG      ARG  73   0.638   0.324  -3.602
  592    HD2  ARG  73           2HD      ARG  73   0.752  -1.330  -5.368
  593    HD3  ARG  73           1HD      ARG  73   0.167   0.205  -6.014
  594    HE   ARG  73           HE       ARG  73   2.989  -0.039  -6.302
  595   HH11  ARG  73          1HH1      ARG  73  -0.046  -1.081  -7.695
  596   HH12  ARG  73          2HH1      ARG  73   0.623  -1.377  -9.268
  597   HH21  ARG  73          1HH2      ARG  73   3.881  -0.403  -8.382
  598   HH22  ARG  73          2HH2      ARG  73   2.859  -0.972  -9.671
  599    H    ILE  74           HN       ILE  74   2.022   0.917  -1.467
  600    HA   ILE  74           HA       ILE  74  -0.525   1.717  -0.499
  601    HB   ILE  74           HB       ILE  74   1.634   0.058   0.824
  602   HG12  ILE  74          2HG1      ILE  74  -0.901  -0.781  -0.598
  603   HG13  ILE  74          1HG1      ILE  74   0.717  -0.868  -1.289
  604   HG21  ILE  74          1HG2      ILE  74  -1.265   0.356   1.594
  605   HG22  ILE  74          2HG2      ILE  74   0.110   1.018   2.481
  606   HG23  ILE  74          3HG2      ILE  74  -0.095  -0.729   2.347
  607   HD11  ILE  74          3HD1      ILE  74   1.358  -2.449   0.473
  608   HD12  ILE  74          1HD1      ILE  74   0.008  -3.038  -0.497
  609   HD13  ILE  74          2HD1      ILE  74  -0.284  -2.381   1.115
  610    H    GLU  75           HN       GLU  75   2.797   2.376   0.465
  611    HA   GLU  75           HA       GLU  75   2.433   3.797   2.812
  612    HB2  GLU  75           2HB      GLU  75   4.624   3.186   1.916
  613    HB3  GLU  75           1HB      GLU  75   4.408   4.297   0.574
  614    HG2  GLU  75           2HG      GLU  75   4.212   6.117   2.362
  615    HG3  GLU  75           1HG      GLU  75   4.886   4.917   3.465
  616    H    SER  76           HN       SER  76   2.392   4.977  -0.520
  617    HA   SER  76           HA       SER  76   2.040   7.694   0.135
  618    HB2  SER  76           2HB      SER  76   2.867   6.672  -2.065
  619    HB3  SER  76           1HB      SER  76   1.163   6.454  -2.453
  620    HG   SER  76           HG       SER  76   2.679   8.783  -2.278
  621    H    VAL  77           HN       VAL  77  -0.265   5.142  -0.745
  622    HA   VAL  77           HA       VAL  77  -2.567   6.785  -0.761
  623    HB   VAL  77           HB       VAL  77  -2.359   3.822  -0.190
  624   HG11  VAL  77          1HG1      VAL  77  -4.759   5.484  -0.956
  625   HG12  VAL  77          2HG1      VAL  77  -4.477   4.723   0.610
  626   HG13  VAL  77          3HG1      VAL  77  -4.727   3.725  -0.823
  627   HG21  VAL  77          3HG2      VAL  77  -1.463   4.406  -2.370
  628   HG22  VAL  77          1HG2      VAL  77  -2.932   5.303  -2.753
  629   HG23  VAL  77          2HG2      VAL  77  -2.996   3.552  -2.545
  630    H    LEU  78           HN       LEU  78  -1.127   4.745   1.771
  631    HA   LEU  78           HA       LEU  78  -3.055   5.259   3.749
  632    HB2  LEU  78           2HB      LEU  78  -0.149   4.495   3.939
  633    HB3  LEU  78           1HB      LEU  78  -1.173   4.669   5.352
  634    HG   LEU  78           HG       LEU  78  -1.658   2.723   3.096
  635   HD11  LEU  78          1HD1      LEU  78  -0.597   2.273   5.879
  636   HD12  LEU  78          2HD1      LEU  78   0.324   2.136   4.380
  637   HD13  LEU  78          3HD1      LEU  78  -0.996   1.013   4.711
  638   HD21  LEU  78          3HD2      LEU  78  -3.023   3.061   5.766
  639   HD22  LEU  78          1HD2      LEU  78  -3.328   1.762   4.610
  640   HD23  LEU  78          2HD2      LEU  78  -3.718   3.428   4.186
  641    H    ASP  79           HN       ASP  79   0.033   6.875   3.052
  642    HA   ASP  79           HA       ASP  79  -0.048   8.713   5.166
  643    HB2  ASP  79           2HB      ASP  79   1.966   8.293   3.834
  644    HB3  ASP  79           1HB      ASP  79   1.200   9.026   2.429
  645    H    TRP  80           HN       TRP  80  -1.344   8.892   1.894
  646    HA   TRP  80           HA       TRP  80  -2.276  11.536   1.951
  647    HB2  TRP  80           2HB      TRP  80  -2.151  10.306  -0.124
  648    HB3  TRP  80           1HB      TRP  80  -3.284   9.101   0.470
  649    HD1  TRP  80           1HD      TRP  80  -3.217  12.795  -0.656
  650    HE1  TRP  80           1HE      TRP  80  -5.575  13.420  -1.476
  651    HE3  TRP  80           3HE      TRP  80  -5.676   8.476   0.554
  652    HZ2  TRP  80           2HZ      TRP  80  -8.131  12.238  -1.602
  653    HZ3  TRP  80           3HZ      TRP  80  -8.078   8.307   0.046
  654    HH2  TRP  80           2HH      TRP  80  -9.277  10.151  -1.008
  655    H    ALA  81           HN       ALA  81  -3.845   8.495   2.860
  656    HA   ALA  81           HA       ALA  81  -6.369   9.556   3.470
  657    HB1  ALA  81           1HB      ALA  81  -5.044   7.096   4.600
  658    HB2  ALA  81           2HB      ALA  81  -5.985   7.176   3.108
  659    HB3  ALA  81           3HB      ALA  81  -6.768   7.465   4.662
  660    H    THR  82           HN       THR  82  -3.426   9.341   5.367
  661    HA   THR  82           HA       THR  82  -4.560   9.814   7.904
  662    HB   THR  82           HB       THR  82  -1.800  10.640   6.980
  663    HG1  THR  82           1HG      THR  82  -1.149   8.588   7.454
  664   HG21  THR  82          3HG2      THR  82  -1.186  10.372   9.327
  665   HG22  THR  82          1HG2      THR  82  -2.847   9.931   9.725
  666   HG23  THR  82          2HG2      THR  82  -2.479  11.558   9.157
  667    H    VAL  83           HN       VAL  83  -3.159  12.034   5.502
  668    HA   VAL  83           HA       VAL  83  -3.608  14.371   7.065
  669    HB   VAL  83           HB       VAL  83  -3.210  14.215   4.076
  670   HG11  VAL  83          1HG1      VAL  83  -2.726  16.452   6.038
  671   HG12  VAL  83          2HG1      VAL  83  -4.019  16.377   4.842
  672   HG13  VAL  83          3HG1      VAL  83  -2.339  16.491   4.318
  673   HG21  VAL  83          3HG2      VAL  83  -1.419  13.041   5.262
  674   HG22  VAL  83          1HG2      VAL  83  -1.141  14.470   6.256
  675   HG23  VAL  83          2HG2      VAL  83  -0.831  14.529   4.520
  676    H    ARG  84           HN       ARG  84  -5.409  12.749   4.490
  677    HA   ARG  84           HA       ARG  84  -7.455  14.629   4.207
  678    HB2  ARG  84           2HB      ARG  84  -6.778  12.013   3.271
  679    HB3  ARG  84           1HB      ARG  84  -8.476  12.043   3.731
  680    HG2  ARG  84           2HG      ARG  84  -8.138  12.596   1.387
  681    HG3  ARG  84           1HG      ARG  84  -8.864  13.916   2.294
  682    HD2  ARG  84           2HD      ARG  84  -6.598  14.941   2.476
  683    HD3  ARG  84           1HD      ARG  84  -6.004  13.687   1.385
  684    HE   ARG  84           HE       ARG  84  -8.222  14.922   0.197
  685   HH11  ARG  84          1HH1      ARG  84  -4.894  15.675   1.035
  686   HH12  ARG  84          2HH1      ARG  84  -4.752  16.914  -0.185
  687   HH21  ARG  84          1HH2      ARG  84  -8.017  16.500  -1.389
  688   HH22  ARG  84          2HH2      ARG  84  -6.510  17.345  -1.599
  689    H    GLY  85           HN       GLY  85  -6.779  12.463   6.764
  690    HA2  GLY  85           2HA      GLY  85  -7.808  12.560   8.862
  691    HA3  GLY  85           1HA      GLY  85  -9.154  13.422   8.134
  692    H    TYR  86           HN       TYR  86  -7.919  10.368   6.900
  693    HA   TYR  86           HA       TYR  86 -10.487   9.134   7.524
  694    HB2  TYR  86           2HB      TYR  86  -8.180   8.336   5.772
  695    HB3  TYR  86           1HB      TYR  86  -9.407   7.160   6.232
  696    HD1  TYR  86           1HD      TYR  86 -11.793   7.573   5.594
  697    HD2  TYR  86           2HD      TYR  86  -8.606   9.941   4.069
  698    HE1  TYR  86           1HE      TYR  86 -13.257   8.365   3.789
  699    HE2  TYR  86           2HE      TYR  86 -10.066  10.739   2.253
  700    HH   TYR  86           HH       TYR  86 -13.435  10.262   2.269
  701    H    ARG  87           HN       ARG  87  -7.574   9.511   9.006
  702    HA   ARG  87           HA       ARG  87  -8.324   7.786  11.134
  703    HB2  ARG  87           2HB      ARG  87  -6.619   6.186  11.127
  704    HB3  ARG  87           1HB      ARG  87  -7.103   6.248   9.438
  705    HG2  ARG  87           2HG      ARG  87  -5.203   7.725   8.962
  706    HG3  ARG  87           1HG      ARG  87  -4.713   7.621  10.654
  707    HD2  ARG  87           2HD      ARG  87  -3.394   6.089   9.347
  708    HD3  ARG  87           1HD      ARG  87  -4.478   5.166  10.386
  709    HE   ARG  87           HE       ARG  87  -5.602   4.410   8.526
  710   HH11  ARG  87          1HH1      ARG  87  -3.378   6.957   7.649
  711   HH12  ARG  87          2HH1      ARG  87  -3.515   6.678   5.945
  712   HH21  ARG  87          1HH2      ARG  87  -5.810   4.025   6.297
  713   HH22  ARG  87          2HH2      ARG  87  -4.927   5.004   5.169
  714    H    GLU  88           HN       GLU  88  -6.576   7.881  12.881
  715    HA   GLU  88           HA       GLU  88  -5.159  10.461  12.739
  716    HB2  GLU  88           2HB      GLU  88  -6.261   9.050  15.181
  717    HB3  GLU  88           1HB      GLU  88  -5.442  10.607  15.169
  718    HG2  GLU  88           2HG      GLU  88  -7.217  11.652  14.029
  719    HG3  GLU  88           1HG      GLU  88  -7.961  10.107  13.617
  720    H    GLY  89           HN       GLY  89  -3.179  10.509  14.179
  721    HA2  GLY  89           2HA      GLY  89  -1.242   9.494  15.020
  722    HA3  GLY  89           1HA      GLY  89  -1.903   7.923  14.588
  723    H    ASP  90           HN       ASP  90  -0.271   7.079  13.386
  724    HA   ASP  90           HA       ASP  90   0.520   8.593  10.994
  725    HB2  ASP  90           2HB      ASP  90   2.089   6.727  12.754
  726    HB3  ASP  90           1HB      ASP  90   2.558   7.003  11.085
  727    H    ASN  91           HN       ASN  91   1.467   6.873   9.311
  728    HA   ASN  91           HA       ASN  91  -0.742   5.132   8.718
  729    HB2  ASN  91           2HB      ASN  91   0.452   4.768   6.602
  730    HB3  ASN  91           1HB      ASN  91   0.232   6.472   6.935
  731   HD21  ASN  91          1HD2      ASN  91   2.112   5.243   5.156
  732   HD22  ASN  91          2HD2      ASN  91   3.687   5.697   5.701
  733    HA   PRO  92           HA       PRO  92   1.046   1.515  10.457
  734    HB2  PRO  92           2HB      PRO  92  -0.278  -0.401   9.086
  735    HB3  PRO  92           1HB      PRO  92  -1.062   0.619  10.300
  736    HG2  PRO  92           2HG      PRO  92  -1.077   0.872   7.316
  737    HG3  PRO  92           1HG      PRO  92  -2.421   1.046   8.461
  738    HD2  PRO  92           2HD      PRO  92  -1.110   3.169   7.392
  739    HD3  PRO  92           1HD      PRO  92  -1.836   3.200   9.011
  740    H    ALA  93           HN       ALA  93   1.786   2.507   7.385
  741    HA   ALA  93           HA       ALA  93   3.372   0.123   6.740
  742    HB1  ALA  93           1HB      ALA  93   1.900   0.987   4.959
  743    HB2  ALA  93           2HB      ALA  93   3.602   1.060   4.500
  744    HB3  ALA  93           3HB      ALA  93   2.762   2.524   5.009
  745    H    ARG  94           HN       ARG  94   3.920   2.365   8.755
  746    HA   ARG  94           HA       ARG  94   6.169   3.790   7.760
  747    HB2  ARG  94           2HB      ARG  94   6.540   4.313  10.209
  748    HB3  ARG  94           1HB      ARG  94   5.010   4.823   9.514
  749    HG2  ARG  94           2HG      ARG  94   3.887   2.925  10.525
  750    HG3  ARG  94           1HG      ARG  94   5.423   2.343  11.169
  751    HD2  ARG  94           2HD      ARG  94   4.174   5.002  11.843
  752    HD3  ARG  94           1HD      ARG  94   4.042   3.552  12.836
  753    HE   ARG  94           HE       ARG  94   6.633   3.712  12.782
  754   HH11  ARG  94          1HH1      ARG  94   4.387   6.395  12.954
  755   HH12  ARG  94          2HH1      ARG  94   5.482   7.427  13.824
  756   HH21  ARG  94          1HH2      ARG  94   8.065   5.050  13.930
  757   HH22  ARG  94          2HH2      ARG  94   7.581   6.660  14.376
  758    H    TRP  95           HN       TRP  95   8.036   2.966   7.306
  759    HA   TRP  95           HA       TRP  95   9.320   1.139   9.191
  760    HB2  TRP  95           2HB      TRP  95   8.641   0.492   6.362
  761    HB3  TRP  95           1HB      TRP  95  10.191  -0.064   6.986
  762    HD1  TRP  95           1HD      TRP  95   9.899  -1.451   9.464
  763    HE1  TRP  95           1HE      TRP  95   8.207  -3.319   9.974
  764    HE3  TRP  95           3HE      TRP  95   6.465  -0.435   5.820
  765    HZ2  TRP  95           2HZ      TRP  95   5.719  -4.233   8.958
  766    HZ3  TRP  95           3HZ      TRP  95   4.463  -1.851   5.654
  767    HH2  TRP  95           2HH      TRP  95   4.098  -3.710   7.189
  768    H    ARG  96           HN       ARG  96  10.947   2.461   9.777
  769    HA   ARG  96           HA       ARG  96  12.326   4.140   7.915
  770    HB2  ARG  96           2HB      ARG  96  13.842   4.614   9.795
  771    HB3  ARG  96           1HB      ARG  96  12.158   4.810  10.246
  772    HG2  ARG  96           2HG      ARG  96  12.162   2.805  11.495
  773    HG3  ARG  96           1HG      ARG  96  13.714   2.305  10.819
  774    HD2  ARG  96           2HD      ARG  96  13.946   3.131  13.113
  775    HD3  ARG  96           1HD      ARG  96  14.833   4.126  11.961
  776    HE   ARG  96           HE       ARG  96  12.401   5.361  12.233
  777   HH11  ARG  96          1HH1      ARG  96  14.967   4.395  14.410
  778   HH12  ARG  96          2HH1      ARG  96  14.688   5.706  15.523
  779   HH21  ARG  96          1HH2      ARG  96  12.030   7.080  13.700
  780   HH22  ARG  96          2HH2      ARG  96  13.017   7.223  15.120
  781    H    GLY  97           HN       GLY  97  12.546   0.869   8.813
  782    HA2  GLY  97           2HA      GLY  97  14.825   0.476   7.074
  783    HA3  GLY  97           1HA      GLY  97  15.128   0.110   8.766
  784    H    TYR  98           HN       TYR  98  12.731  -0.573   6.229
  785    HA   TYR  98           HA       TYR  98  11.948  -3.030   7.412
  786    HB2  TYR  98           2HB      TYR  98  10.913  -3.432   5.077
  787    HB3  TYR  98           1HB      TYR  98  10.287  -2.120   6.059
  788    HD1  TYR  98           2HD      TYR  98  11.199   0.252   5.547
  789    HD2  TYR  98           1HD      TYR  98  11.588  -3.035   2.877
  790    HE1  TYR  98           2HE      TYR  98  11.548   1.814   3.685
  791    HE2  TYR  98           1HE      TYR  98  11.927  -1.476   1.005
  792    HH   TYR  98           HH       TYR  98  11.506   0.803   0.402
  793    H    LEU  99           HN       LEU  99  13.617  -2.540   4.273
  794    HA   LEU  99           HA       LEU  99  15.282  -4.856   4.963
  795    HB2  LEU  99           2HB      LEU  99  14.154  -4.066   2.287
  796    HB3  LEU  99           1HB      LEU  99  15.459  -5.212   2.474
  797    HG   LEU  99           HG       LEU  99  12.619  -5.531   3.437
  798   HD11  LEU  99          1HD1      LEU  99  12.607  -7.417   1.876
  799   HD12  LEU  99          2HD1      LEU  99  14.259  -7.029   1.396
  800   HD13  LEU  99          3HD1      LEU  99  12.953  -5.897   1.051
  801   HD21  LEU  99          3HD2      LEU  99  14.150  -6.463   5.091
  802   HD22  LEU  99          1HD2      LEU  99  14.980  -7.371   3.828
  803   HD23  LEU  99          2HD2      LEU  99  13.304  -7.747   4.227
  804    H    GLU 100           HN       GLU 100  15.334  -2.465   2.336
  805    HA   GLU 100           HA       GLU 100  18.038  -1.684   3.208
  806    HB2  GLU 100           2HB      GLU 100  17.761  -3.280   1.153
  807    HB3  GLU 100           1HB      GLU 100  17.236  -1.829   0.315
  808    HG2  GLU 100           2HG      GLU 100  19.885  -2.139   1.704
  809    HG3  GLU 100           1HG      GLU 100  19.619  -2.389  -0.018
  810    H    HIS 101           HN       HIS 101  18.226   0.459   3.517
  811    HA   HIS 101           HA       HIS 101  16.523   2.270   1.974
  812    HB2  HIS 101           2HB      HIS 101  15.381   1.787   4.148
  813    HB3  HIS 101           1HB      HIS 101  16.779   2.451   4.984
  814    HD1  HIS 101           1HD      HIS 101  16.796   4.923   5.372
  815    HD2  HIS 101           2HD      HIS 101  13.957   3.767   2.553
  816    HE1  HIS 101           1HE      HIS 101  15.438   6.984   4.886
  817    HE2  HIS 101           2HE      HIS 101  13.641   6.235   3.286
  818    H    HIS 102           HN       HIS 102  18.960   2.144   1.162
  819    HA   HIS 102           HA       HIS 102  20.471   4.269   2.492
  820    HB2  HIS 102           2HB      HIS 102  21.137   2.288   0.348
  821    HB3  HIS 102           1HB      HIS 102  22.047   3.792   0.429
  822    HD1  HIS 102           1HD      HIS 102  21.769   0.476   1.929
  823    HD2  HIS 102           2HD      HIS 102  23.469   4.130   2.930
  824    HE1  HIS 102           1HE      HIS 102  23.438  -0.027   3.747
  825    HE2  HIS 102           2HE      HIS 102  24.229   2.239   4.516
  826    H    HIS 103           HN       HIS 103  20.099   3.684  -0.969
  827    HA   HIS 103           HA       HIS 103  19.607   5.053  -2.714
  828    HB2  HIS 103           2HB      HIS 103  17.367   4.942  -1.530
  829    HB3  HIS 103           1HB      HIS 103  17.767   6.487  -0.790
  830    HD1  HIS 103           1HD      HIS 103  16.484   4.951  -3.879
  831    HD2  HIS 103           2HD      HIS 103  17.844   8.686  -2.650
  832    HE1  HIS 103           1HE      HIS 103  15.707   6.571  -5.643
  833    HE2  HIS 103           2HE      HIS 103  16.717   8.784  -4.986
  834    H    HIS 104           HN       HIS 104  21.567   6.108  -3.031
  835    HA   HIS 104           HA       HIS 104  22.613   8.064  -1.322
  836    HB2  HIS 104           2HB      HIS 104  24.260   8.511  -2.950
  837    HB3  HIS 104           1HB      HIS 104  23.858   6.815  -3.171
  838    HD1  HIS 104           1HD      HIS 104  22.527   6.195  -5.356
  839    HD2  HIS 104           2HD      HIS 104  23.786  10.157  -5.119
  840    HE1  HIS 104           1HE      HIS 104  22.306   7.125  -7.687
  841    HE2  HIS 104           2HE      HIS 104  23.005   9.542  -7.510
  842    H    HIS 105           HN       HIS 105  22.169  10.132  -1.000
  843    HA   HIS 105           HA       HIS 105  20.073  11.301  -2.709
  844    HB2  HIS 105           2HB      HIS 105  19.299  12.534  -0.773
  845    HB3  HIS 105           1HB      HIS 105  19.410  10.830  -0.355
  846    HD1  HIS 105           1HD      HIS 105  21.020  14.160   0.360
  847    HD2  HIS 105           2HD      HIS 105  21.246  10.206   1.638
  848    HE1  HIS 105           1HE      HIS 105  22.428  14.196   2.442
  849    HE2  HIS 105           2HE      HIS 105  22.725  11.773   3.063
  850    H    HIS 106           HN       HIS 106  20.039  13.812  -2.370
  851    HA   HIS 106           HA       HIS 106  22.798  14.831  -2.422
  852    HB2  HIS 106           2HB      HIS 106  21.714  14.726  -4.716
  853    HB3  HIS 106           1HB      HIS 106  20.549  15.910  -4.134
  854    HD1  HIS 106           1HD      HIS 106  24.322  15.588  -4.478
  855    HD2  HIS 106           2HD      HIS 106  21.331  18.476  -4.545
  856    HE1  HIS 106           1HE      HIS 106  25.471  17.745  -5.077
  857    HE2  HIS 106           2HE      HIS 106  23.680  19.506  -4.892
  Start of MODEL   13
    1    H1   MET   1           H1       MET   1 -16.165   3.311   4.960
    2    H2   MET   1           H2       MET   1 -14.956   2.654   5.953
    3    H3   MET   1           H3       MET   1 -15.936   1.634   5.019
    4    HA   MET   1           HA       MET   1 -15.027   2.547   2.995
    5    HB2  MET   1           2HB      MET   1 -14.506   4.785   3.920
    6    HB3  MET   1           1HB      MET   1 -13.198   4.077   4.861
    7    HG2  MET   1           2HG      MET   1 -12.246   5.088   2.930
    8    HG3  MET   1           1HG      MET   1 -12.154   3.344   2.725
    9    HE1  MET   1           2HE      MET   1 -15.424   5.480   2.359
   10    HE2  MET   1           3HE      MET   1 -15.368   5.939   0.657
   11    HE3  MET   1           1HE      MET   1 -14.177   6.584   1.784
   12    H    THR   2           HN       THR   2 -13.879   0.937   2.154
   13    HA   THR   2           HA       THR   2 -12.173  -0.607   3.963
   14    HB   THR   2           HB       THR   2 -12.164  -2.330   2.175
   15    HG1  THR   2           1HG      THR   2 -14.187  -0.815   0.869
   16   HG21  THR   2          3HG2      THR   2 -14.520  -2.992   2.401
   17   HG22  THR   2          1HG2      THR   2 -14.906  -1.380   3.002
   18   HG23  THR   2          2HG2      THR   2 -13.846  -2.436   3.932
   19    H    PHE   3           HN       PHE   3 -10.089  -1.423   3.071
   20    HA   PHE   3           HA       PHE   3  -8.442   0.701   2.296
   21    HB2  PHE   3           2HB      PHE   3  -7.621  -1.307   3.469
   22    HB3  PHE   3           1HB      PHE   3  -7.915  -2.268   2.025
   23    HD1  PHE   3           1HD      PHE   3  -5.912   0.566   3.340
   24    HD2  PHE   3           2HD      PHE   3  -6.293  -2.443   0.351
   25    HE1  PHE   3           1HE      PHE   3  -3.649   1.087   2.532
   26    HE2  PHE   3           2HE      PHE   3  -4.028  -1.926  -0.461
   27    HZ   PHE   3           HZ       PHE   3  -2.705  -0.159   0.629
   28    H    SER   4           HN       SER   4  -9.952  -1.862   0.388
   29    HA   SER   4           HA       SER   4  -8.729  -1.310  -2.075
   30    HB2  SER   4           2HB      SER   4 -11.526  -2.365  -1.584
   31    HB3  SER   4           1HB      SER   4 -10.597  -2.530  -3.074
   32    HG   SER   4           HG       SER   4  -9.003  -3.650  -1.699
   33    H    GLU   5           HN       GLU   5 -11.749  -0.075  -0.667
   34    HA   GLU   5           HA       GLU   5 -12.477   1.518  -2.882
   35    HB2  GLU   5           2HB      GLU   5 -13.235   1.628   0.032
   36    HB3  GLU   5           1HB      GLU   5 -13.977   2.631  -1.201
   37    HG2  GLU   5           2HG      GLU   5 -14.801   0.680  -2.350
   38    HG3  GLU   5           1HG      GLU   5 -13.980  -0.371  -1.200
   39    H    CYS   6           HN       CYS   6 -10.774   2.225   0.125
   40    HA   CYS   6           HA       CYS   6 -10.531   5.006  -0.219
   41    HB2  CYS   6           2HB      CYS   6 -10.109   3.634   1.879
   42    HB3  CYS   6           1HB      CYS   6  -8.538   3.251   1.206
   43    HG   CYS   6           HG       CYS   6  -8.152   6.221   0.919
   44    H    ALA   7           HN       ALA   7  -8.355   2.348  -1.038
   45    HA   ALA   7           HA       ALA   7  -6.280   3.849  -2.171
   46    HB1  ALA   7           1HB      ALA   7  -7.218   1.098  -2.973
   47    HB2  ALA   7           2HB      ALA   7  -6.089   1.458  -1.668
   48    HB3  ALA   7           3HB      ALA   7  -5.645   1.804  -3.339
   49    H    ALA   8           HN       ALA   8  -9.254   2.584  -3.592
   50    HA   ALA   8           HA       ALA   8  -8.759   3.389  -6.246
   51    HB1  ALA   8           1HB      ALA   8 -11.156   3.094  -6.595
   52    HB2  ALA   8           2HB      ALA   8 -11.414   3.040  -4.853
   53    HB3  ALA   8           3HB      ALA   8 -10.492   1.763  -5.648
   54    H    LEU   9           HN       LEU   9 -10.089   5.068  -3.462
   55    HA   LEU   9           HA       LEU   9 -11.001   7.363  -4.861
   56    HB2  LEU   9           2HB      LEU   9 -10.142   7.071  -1.981
   57    HB3  LEU   9           1HB      LEU   9 -10.952   8.473  -2.646
   58    HG   LEU   9           HG       LEU   9 -12.113   5.697  -2.431
   59   HD11  LEU   9          1HD1      LEU   9 -11.937   6.824  -0.287
   60   HD12  LEU   9          2HD1      LEU   9 -13.623   6.728  -0.804
   61   HD13  LEU   9          3HD1      LEU   9 -12.739   8.248  -0.954
   62   HD21  LEU   9          3HD2      LEU   9 -14.197   6.732  -3.202
   63   HD22  LEU   9          1HD2      LEU   9 -12.929   6.842  -4.423
   64   HD23  LEU   9          2HD2      LEU   9 -13.345   8.256  -3.454
   65    H    TYR  10           HN       TYR  10  -7.969   6.551  -3.235
   66    HA   TYR  10           HA       TYR  10  -6.613   8.968  -3.570
   67    HB2  TYR  10           2HB      TYR  10  -5.718   7.155  -2.208
   68    HB3  TYR  10           1HB      TYR  10  -5.556   6.131  -3.627
   69    HD1  TYR  10           2HD      TYR  10  -4.280   9.264  -2.087
   70    HD2  TYR  10           1HD      TYR  10  -3.599   6.157  -4.912
   71    HE1  TYR  10           2HE      TYR  10  -1.988  10.087  -2.437
   72    HE2  TYR  10           1HE      TYR  10  -1.310   6.975  -5.271
   73    HH   TYR  10           HH       TYR  10  -0.070   9.101  -5.034
   74    H    ILE  11           HN       ILE  11  -6.754   6.142  -5.694
   75    HA   ILE  11           HA       ILE  11  -5.216   7.101  -7.821
   76    HB   ILE  11           HB       ILE  11  -7.555   5.184  -7.843
   77   HG12  ILE  11          2HG1      ILE  11  -4.574   4.666  -7.869
   78   HG13  ILE  11          1HG1      ILE  11  -5.586   4.573  -6.431
   79   HG21  ILE  11          1HG2      ILE  11  -6.664   4.391  -9.991
   80   HG22  ILE  11          2HG2      ILE  11  -5.481   5.701  -9.969
   81   HG23  ILE  11          3HG2      ILE  11  -7.202   6.069 -10.076
   82   HD11  ILE  11          3HD1      ILE  11  -5.136   2.373  -7.365
   83   HD12  ILE  11          1HD1      ILE  11  -5.863   2.867  -8.893
   84   HD13  ILE  11          2HD1      ILE  11  -6.854   2.757  -7.442
   85    H    LYS  12           HN       LYS  12  -8.739   7.268  -7.330
   86    HA   LYS  12           HA       LYS  12  -9.292   8.649  -9.733
   87    HB2  LYS  12           2HB      LYS  12 -10.841   8.350  -7.169
   88    HB3  LYS  12           1HB      LYS  12 -11.464   9.256  -8.540
   89    HG2  LYS  12           2HG      LYS  12 -11.313   7.241  -9.929
   90    HG3  LYS  12           1HG      LYS  12 -10.724   6.336  -8.531
   91    HD2  LYS  12           2HD      LYS  12 -12.793   6.722  -7.353
   92    HD3  LYS  12           1HD      LYS  12 -13.375   7.767  -8.650
   93    HE2  LYS  12           2HE      LYS  12 -14.405   5.582  -8.816
   94    HE3  LYS  12           1HE      LYS  12 -13.333   5.851 -10.186
   95    HZ1  LYS  12           3HZ      LYS  12 -13.249   3.604  -9.023
   96    HZ2  LYS  12           1HZ      LYS  12 -12.416   4.402  -7.785
   97    HZ3  LYS  12           2HZ      LYS  12 -11.767   4.365  -9.350
   98    H    ALA  13           HN       ALA  13  -8.456   9.768  -6.503
   99    HA   ALA  13           HA       ALA  13  -9.135  12.482  -6.889
  100    HB1  ALA  13           1HB      ALA  13  -7.057  11.296  -5.052
  101    HB2  ALA  13           2HB      ALA  13  -8.762  11.539  -4.673
  102    HB3  ALA  13           3HB      ALA  13  -7.714  12.929  -4.948
  103    H    HIS  14           HN       HIS  14  -6.562  10.601  -8.129
  104    HA   HIS  14           HA       HIS  14  -5.048  13.039  -8.794
  105    HB2  HIS  14           2HB      HIS  14  -4.150  10.194  -8.385
  106    HB3  HIS  14           1HB      HIS  14  -3.155  11.357  -9.251
  107    HD1  HIS  14           1HD      HIS  14  -1.420  12.298  -7.798
  108    HD2  HIS  14           2HD      HIS  14  -4.911  11.497  -5.691
  109    HE1  HIS  14           1HE      HIS  14  -0.936  12.941  -5.423
  110    HE2  HIS  14           2HE      HIS  14  -3.120  12.642  -4.208
  111    H    ARG  15           HN       ARG  15  -7.233  10.996 -10.150
  112    HA   ARG  15           HA       ARG  15  -6.018   9.942 -12.425
  113    HB2  ARG  15           2HB      ARG  15  -8.239   9.650 -13.353
  114    HB3  ARG  15           1HB      ARG  15  -8.226   9.229 -11.649
  115    HG2  ARG  15           2HG      ARG  15  -9.358  11.223 -11.056
  116    HG3  ARG  15           1HG      ARG  15  -9.149  11.896 -12.676
  117    HD2  ARG  15           2HD      ARG  15 -10.690  10.392 -13.614
  118    HD3  ARG  15           1HD      ARG  15 -10.653   9.343 -12.198
  119    HE   ARG  15           HE       ARG  15 -12.139  10.739 -11.120
  120   HH11  ARG  15          1HH1      ARG  15 -11.063  12.281 -14.094
  121   HH12  ARG  15          2HH1      ARG  15 -12.352  13.449 -14.089
  122   HH21  ARG  15          1HH2      ARG  15 -13.822  12.251 -11.141
  123   HH22  ARG  15          2HH2      ARG  15 -13.945  13.410 -12.430
  124    H    SER  16           HN       SER  16  -7.210  13.194 -11.894
  125    HA   SER  16           HA       SER  16  -7.367  13.933 -14.620
  126    HB2  SER  16           2HB      SER  16  -6.941  15.714 -12.210
  127    HB3  SER  16           1HB      SER  16  -7.634  16.171 -13.761
  128    HG   SER  16           HG       SER  16  -8.925  15.279 -11.654
  129    H    SER  17           HN       SER  17  -4.860  14.333 -12.149
  130    HA   SER  17           HA       SER  17  -2.947  15.445 -13.960
  131    HB2  SER  17           2HB      SER  17  -2.377  13.991 -11.367
  132    HB3  SER  17           1HB      SER  17  -1.422  15.254 -12.139
  133    HG   SER  17           HG       SER  17  -3.234  16.676 -11.767
  134    H    TRP  18           HN       TRP  18  -4.270  12.436 -13.418
  135    HA   TRP  18           HA       TRP  18  -1.898  10.930 -14.183
  136    HB2  TRP  18           2HB      TRP  18  -4.322  10.358 -12.616
  137    HB3  TRP  18           1HB      TRP  18  -3.725   9.034 -13.604
  138    HD1  TRP  18           1HD      TRP  18  -1.063  11.288 -12.117
  139    HE1  TRP  18           1HE      TRP  18   0.130  10.014 -10.213
  140    HE3  TRP  18           3HE      TRP  18  -4.195   7.280 -11.765
  141    HZ2  TRP  18           2HZ      TRP  18  -0.236   7.622  -8.754
  142    HZ3  TRP  18           3HZ      TRP  18  -3.702   5.532 -10.102
  143    HH2  TRP  18           2HH      TRP  18  -1.771   5.711  -8.620
  144    H    LYS  19           HN       LYS  19  -3.077  12.242 -16.437
  145    HA   LYS  19           HA       LYS  19  -4.060  10.153 -18.059
  146    HB2  LYS  19           2HB      LYS  19  -2.051  12.330 -18.711
  147    HB3  LYS  19           1HB      LYS  19  -2.677  11.207 -19.909
  148    HG2  LYS  19           2HG      LYS  19  -4.260  13.240 -18.349
  149    HG3  LYS  19           1HG      LYS  19  -3.848  13.304 -20.063
  150    HD2  LYS  19           2HD      LYS  19  -5.125  11.176 -20.366
  151    HD3  LYS  19           1HD      LYS  19  -5.660  11.324 -18.692
  152    HE2  LYS  19           2HE      LYS  19  -6.196  13.239 -20.958
  153    HE3  LYS  19           1HE      LYS  19  -7.365  12.193 -20.158
  154    HZ1  LYS  19           3HZ      LYS  19  -7.601  14.407 -19.324
  155    HZ2  LYS  19           1HZ      LYS  19  -5.947  14.514 -18.970
  156    HZ3  LYS  19           2HZ      LYS  19  -6.934  13.453 -18.087
  157    H    ASN  20           HN       ASN  20  -1.865   8.096 -16.648
  158    HA   ASN  20           HA       ASN  20  -3.757   6.937 -17.103
  159    HB2  ASN  20           2HB      ASN  20  -5.153   8.896 -17.544
  160    HB3  ASN  20           1HB      ASN  20  -4.423   9.096 -19.130
  161   HD21  ASN  20          1HD2      ASN  20  -6.601   7.174 -17.197
  162   HD22  ASN  20          2HD2      ASN  20  -7.375   6.372 -18.522
  163    H    THR  21           HN       THR  21  -2.210   5.614 -17.591
  164    HA   THR  21           HA       THR  21  -2.091   4.595 -20.295
  165    HB   THR  21           HB       THR  21   0.424   4.276 -20.035
  166    HG1  THR  21           1HG      THR  21   0.725   6.487 -18.451
  167   HG21  THR  21          3HG2      THR  21  -0.457   5.934 -21.593
  168   HG22  THR  21          1HG2      THR  21   1.015   6.526 -20.823
  169   HG23  THR  21          2HG2      THR  21  -0.558   7.121 -20.293
  170    H    LYS  22           HN       LYS  22  -0.117   2.616 -19.669
  171    HA   LYS  22           HA       LYS  22  -1.530   0.732 -18.164
  172    HB2  LYS  22           2HB      LYS  22   1.313   0.952 -19.059
  173    HB3  LYS  22           1HB      LYS  22   0.871  -0.314 -17.921
  174    HG2  LYS  22           2HG      LYS  22  -0.459   0.111 -20.586
  175    HG3  LYS  22           1HG      LYS  22   0.855  -1.030 -20.292
  176    HD2  LYS  22           2HD      LYS  22  -1.798  -1.058 -18.856
  177    HD3  LYS  22           1HD      LYS  22  -1.393  -2.081 -20.235
  178    HE2  LYS  22           2HE      LYS  22   0.420  -3.101 -18.968
  179    HE3  LYS  22           1HE      LYS  22   0.078  -2.043 -17.599
  180    HZ1  LYS  22           3HZ      LYS  22  -0.856  -4.353 -17.462
  181    HZ2  LYS  22           1HZ      LYS  22  -1.918  -3.928 -18.711
  182    HZ3  LYS  22           2HZ      LYS  22  -1.982  -3.106 -17.227
  183    H    HIS  23           HN       HIS  23   0.385   3.368 -17.082
  184    HA   HIS  23           HA       HIS  23   1.312   2.397 -14.604
  185    HB2  HIS  23           2HB      HIS  23   0.551   5.204 -15.448
  186    HB3  HIS  23           1HB      HIS  23   1.308   4.826 -13.907
  187    HD1  HIS  23           1HD      HIS  23   3.730   5.201 -13.921
  188    HD2  HIS  23           2HD      HIS  23   2.318   4.119 -17.680
  189    HE1  HIS  23           1HE      HIS  23   5.726   5.285 -15.447
  190    HE2  HIS  23           2HE      HIS  23   4.805   4.828 -17.750
  191    H    ALA  24           HN       ALA  24  -1.645   4.288 -15.304
  192    HA   ALA  24           HA       ALA  24  -2.722   4.168 -12.706
  193    HB1  ALA  24           1HB      ALA  24  -4.859   4.744 -13.744
  194    HB2  ALA  24           2HB      ALA  24  -4.198   4.364 -15.335
  195    HB3  ALA  24           3HB      ALA  24  -3.547   5.717 -14.409
  196    H    ASP  25           HN       ASP  25  -2.907   1.974 -15.438
  197    HA   ASP  25           HA       ASP  25  -4.822   0.174 -14.424
  198    HB2  ASP  25           2HB      ASP  25  -4.078   0.125 -16.768
  199    HB3  ASP  25           1HB      ASP  25  -2.469  -0.361 -16.262
  200    H    GLN  26           HN       GLN  26  -1.292   0.156 -14.300
  201    HA   GLN  26           HA       GLN  26  -0.950  -2.193 -12.849
  202    HB2  GLN  26           2HB      GLN  26   0.751   0.270 -13.186
  203    HB3  GLN  26           1HB      GLN  26   1.306  -1.130 -12.298
  204    HG2  GLN  26           2HG      GLN  26   0.465  -1.132 -15.184
  205    HG3  GLN  26           1HG      GLN  26   2.125  -1.068 -14.606
  206   HE21  GLN  26          1HE2      GLN  26   2.672  -2.955 -15.652
  207   HE22  GLN  26          2HE2      GLN  26   2.131  -4.511 -15.113
  208    H    TRP  27           HN       TRP  27  -1.284   1.160 -11.712
  209    HA   TRP  27           HA       TRP  27  -0.748   0.700  -9.008
  210    HB2  TRP  27           2HB      TRP  27  -2.179   2.782 -10.548
  211    HB3  TRP  27           1HB      TRP  27  -2.578   2.676  -8.836
  212    HD1  TRP  27           1HD      TRP  27   0.377   3.435 -11.173
  213    HE1  TRP  27           1HE      TRP  27   2.172   4.700  -9.825
  214    HE3  TRP  27           3HE      TRP  27  -1.705   3.080  -6.521
  215    HZ2  TRP  27           2HZ      TRP  27   2.632   5.456  -7.146
  216    HZ3  TRP  27           3HZ      TRP  27  -0.528   4.105  -4.619
  217    HH2  TRP  27           2HH      TRP  27   1.597   5.267  -4.926
  218    H    THR  28           HN       THR  28  -3.887   0.679 -10.689
  219    HA   THR  28           HA       THR  28  -5.358  -0.127  -8.395
  220    HB   THR  28           HB       THR  28  -6.160  -0.601 -11.274
  221    HG1  THR  28           1HG      THR  28  -5.662   1.744 -10.017
  222   HG21  THR  28          3HG2      THR  28  -7.777  -0.069  -8.773
  223   HG22  THR  28          1HG2      THR  28  -7.616  -1.623  -9.593
  224   HG23  THR  28          2HG2      THR  28  -8.434  -0.283 -10.399
  225    H    ASN  29           HN       ASN  29  -3.819  -1.811 -11.053
  226    HA   ASN  29           HA       ASN  29  -5.048  -4.322 -10.739
  227    HB2  ASN  29           2HB      ASN  29  -3.878  -3.436 -12.766
  228    HB3  ASN  29           1HB      ASN  29  -2.349  -3.695 -11.944
  229   HD21  ASN  29          1HD2      ASN  29  -1.735  -5.030 -13.642
  230   HD22  ASN  29          2HD2      ASN  29  -2.321  -6.645 -13.783
  231    H    THR  30           HN       THR  30  -1.878  -3.131  -9.618
  232    HA   THR  30           HA       THR  30  -1.075  -5.614  -8.522
  233    HB   THR  30           HB       THR  30   0.623  -4.205  -7.264
  234    HG1  THR  30           1HG      THR  30  -0.315  -2.092  -8.924
  235   HG21  THR  30          3HG2      THR  30   1.136  -5.246  -9.408
  236   HG22  THR  30          1HG2      THR  30   1.887  -3.654  -9.298
  237   HG23  THR  30          2HG2      THR  30   0.424  -3.874 -10.259
  238    H    ILE  31           HN       ILE  31  -2.370  -2.676  -6.985
  239    HA   ILE  31           HA       ILE  31  -2.269  -3.651  -4.351
  240    HB   ILE  31           HB       ILE  31  -4.094  -1.540  -5.516
  241   HG12  ILE  31          2HG1      ILE  31  -1.445  -1.299  -4.070
  242   HG13  ILE  31          1HG1      ILE  31  -1.685  -1.077  -5.799
  243   HG21  ILE  31          1HG2      ILE  31  -3.387  -2.138  -2.645
  244   HG22  ILE  31          2HG2      ILE  31  -4.968  -2.343  -3.402
  245   HG23  ILE  31          3HG2      ILE  31  -4.288  -0.727  -3.197
  246   HD11  ILE  31          3HD1      ILE  31  -3.119   0.854  -5.347
  247   HD12  ILE  31          1HD1      ILE  31  -1.505   1.055  -4.661
  248   HD13  ILE  31          2HD1      ILE  31  -2.860   0.630  -3.616
  249    H    LYS  32           HN       LYS  32  -4.816  -3.750  -6.795
  250    HA   LYS  32           HA       LYS  32  -6.865  -4.762  -5.153
  251    HB2  LYS  32           2HB      LYS  32  -6.972  -3.793  -7.553
  252    HB3  LYS  32           1HB      LYS  32  -6.569  -5.417  -8.078
  253    HG2  LYS  32           2HG      LYS  32  -8.927  -4.901  -6.300
  254    HG3  LYS  32           1HG      LYS  32  -9.031  -4.716  -8.050
  255    HD2  LYS  32           2HD      LYS  32  -8.171  -7.231  -6.620
  256    HD3  LYS  32           1HD      LYS  32  -9.786  -6.933  -7.263
  257    HE2  LYS  32           2HE      LYS  32  -7.240  -6.992  -8.881
  258    HE3  LYS  32           1HE      LYS  32  -8.410  -8.306  -8.770
  259    HZ1  LYS  32           3HZ      LYS  32  -8.830  -5.622  -9.966
  260    HZ2  LYS  32           1HZ      LYS  32 -10.087  -6.725  -9.683
  261    HZ3  LYS  32           2HZ      LYS  32  -8.840  -7.119 -10.759
  262    H    THR  33           HN       THR  33  -4.219  -6.299  -6.851
  263    HA   THR  33           HA       THR  33  -5.310  -8.951  -6.545
  264    HB   THR  33           HB       THR  33  -2.548  -8.145  -7.467
  265    HG1  THR  33           1HG      THR  33  -4.059  -7.263  -8.876
  266   HG21  THR  33          3HG2      THR  33  -2.529 -10.351  -8.540
  267   HG22  THR  33          1HG2      THR  33  -4.108 -10.704  -7.836
  268   HG23  THR  33          2HG2      THR  33  -2.705 -10.492  -6.790
  269    H    TYR  34           HN       TYR  34  -2.486  -7.203  -5.223
  270    HA   TYR  34           HA       TYR  34  -1.768  -9.464  -3.603
  271    HB2  TYR  34           2HB      TYR  34  -0.651  -6.661  -3.723
  272    HB3  TYR  34           1HB      TYR  34   0.008  -7.941  -2.713
  273    HD1  TYR  34           1HD      TYR  34   0.725 -10.122  -3.944
  274    HD2  TYR  34           2HD      TYR  34   0.144  -6.386  -5.897
  275    HE1  TYR  34           1HE      TYR  34   2.127 -10.887  -5.816
  276    HE2  TYR  34           2HE      TYR  34   1.539  -7.143  -7.773
  277    HH   TYR  34           HH       TYR  34   2.439 -10.377  -8.221
  278    H    CYS  35           HN       CYS  35  -3.055  -6.214  -2.898
  279    HA   CYS  35           HA       CYS  35  -3.093  -6.845  -0.059
  280    HB2  CYS  35           2HB      CYS  35  -3.991  -4.319  -1.459
  281    HB3  CYS  35           1HB      CYS  35  -3.673  -4.517   0.262
  282    HG   CYS  35           HG       CYS  35  -0.886  -5.276  -0.475
  283    H    GLY  36           HN       GLY  36  -5.245  -6.786  -2.723
  284    HA2  GLY  36           2HA      GLY  36  -7.682  -6.089  -1.678
  285    HA3  GLY  36           1HA      GLY  36  -7.467  -7.268  -2.956
  286    HA   PRO  37           HA       PRO  37  -8.931 -10.615  -0.633
  287    HB2  PRO  37           2HB      PRO  37  -6.345 -12.035  -0.432
  288    HB3  PRO  37           1HB      PRO  37  -7.860 -12.544  -1.184
  289    HG2  PRO  37           2HG      PRO  37  -5.759 -11.820  -2.662
  290    HG3  PRO  37           1HG      PRO  37  -7.416 -11.425  -3.154
  291    HD2  PRO  37           2HD      PRO  37  -5.340  -9.671  -1.899
  292    HD3  PRO  37           1HD      PRO  37  -6.509  -9.295  -3.183
  293    H    VAL  38           HN       VAL  38  -6.060  -9.185   0.750
  294    HA   VAL  38           HA       VAL  38  -6.506 -10.588   3.283
  295    HB   VAL  38           HB       VAL  38  -4.206  -8.756   2.586
  296   HG11  VAL  38          1HG1      VAL  38  -4.590  -9.033   4.984
  297   HG12  VAL  38          2HG1      VAL  38  -3.104  -9.840   4.486
  298   HG13  VAL  38          3HG1      VAL  38  -4.559 -10.787   4.793
  299   HG21  VAL  38          3HG2      VAL  38  -4.249 -10.670   1.070
  300   HG22  VAL  38          1HG2      VAL  38  -4.360 -11.768   2.444
  301   HG23  VAL  38          2HG2      VAL  38  -2.907 -10.798   2.207
  302    H    ILE  39           HN       ILE  39  -5.561  -7.223   2.474
  303    HA   ILE  39           HA       ILE  39  -7.049  -6.375   4.866
  304    HB   ILE  39           HB       ILE  39  -5.687  -4.307   4.764
  305   HG12  ILE  39          2HG1      ILE  39  -4.181  -5.775   2.585
  306   HG13  ILE  39          1HG1      ILE  39  -5.180  -4.345   2.352
  307   HG21  ILE  39          1HG2      ILE  39  -3.587  -5.350   5.536
  308   HG22  ILE  39          2HG2      ILE  39  -4.154  -6.900   4.918
  309   HG23  ILE  39          3HG2      ILE  39  -5.021  -6.105   6.231
  310   HD11  ILE  39          3HD1      ILE  39  -2.690  -4.462   4.036
  311   HD12  ILE  39          1HD1      ILE  39  -3.672  -3.034   3.708
  312   HD13  ILE  39          2HD1      ILE  39  -2.793  -3.819   2.394
  313    H    GLY  40           HN       GLY  40  -7.513  -6.575   1.668
  314    HA2  GLY  40           2HA      GLY  40  -8.343  -4.101   0.748
  315    HA3  GLY  40           1HA      GLY  40  -9.011  -5.636   0.220
  316    HA   PRO  41           HA       PRO  41 -12.841  -4.792   2.164
  317    HB2  PRO  41           2HB      PRO  41 -12.995  -7.235   3.743
  318    HB3  PRO  41           1HB      PRO  41 -13.866  -6.806   2.270
  319    HG2  PRO  41           2HG      PRO  41 -11.958  -8.731   2.336
  320    HG3  PRO  41           1HG      PRO  41 -12.273  -7.739   0.900
  321    HD2  PRO  41           2HD      PRO  41 -10.117  -7.456   2.963
  322    HD3  PRO  41           1HD      PRO  41 -10.010  -7.316   1.195
  323    H    LEU  42           HN       LEU  42 -10.198  -4.798   4.099
  324    HA   LEU  42           HA       LEU  42 -11.614  -4.480   6.620
  325    HB2  LEU  42           2HB      LEU  42  -8.677  -4.259   5.942
  326    HB3  LEU  42           1HB      LEU  42  -9.344  -4.095   7.555
  327    HG   LEU  42           HG       LEU  42  -9.440  -6.595   5.857
  328   HD11  LEU  42          1HD1      LEU  42  -7.836  -5.949   8.328
  329   HD12  LEU  42          2HD1      LEU  42  -7.201  -6.098   6.689
  330   HD13  LEU  42          3HD1      LEU  42  -7.886  -7.506   7.500
  331   HD21  LEU  42          3HD2      LEU  42 -10.374  -6.091   8.680
  332   HD22  LEU  42          1HD2      LEU  42 -10.292  -7.668   7.896
  333   HD23  LEU  42          2HD2      LEU  42 -11.393  -6.435   7.282
  334    H    SER  43           HN       SER  43 -11.823  -2.523   7.700
  335    HA   SER  43           HA       SER  43 -12.034  -0.183   6.222
  336    HB2  SER  43           2HB      SER  43 -11.687  -0.458   9.213
  337    HB3  SER  43           1HB      SER  43 -12.512   0.814   8.338
  338    HG   SER  43           HG       SER  43 -14.011  -0.796   7.599
  339    H    VAL  44           HN       VAL  44 -10.672   1.495   5.886
  340    HA   VAL  44           HA       VAL  44  -7.920   0.989   5.833
  341    HB   VAL  44           HB       VAL  44  -9.035   2.532   4.291
  342   HG11  VAL  44          1HG1      VAL  44 -10.597   3.572   5.827
  343   HG12  VAL  44          2HG1      VAL  44  -9.634   4.787   4.985
  344   HG13  VAL  44          3HG1      VAL  44  -9.264   4.374   6.660
  345   HG21  VAL  44          3HG2      VAL  44  -6.864   3.866   5.908
  346   HG22  VAL  44          1HG2      VAL  44  -7.341   4.298   4.265
  347   HG23  VAL  44          2HG2      VAL  44  -6.619   2.720   4.588
  348    H    GLN  45           HN       GLN  45  -9.902   2.376   8.321
  349    HA   GLN  45           HA       GLN  45  -7.801   3.653   9.774
  350    HB2  GLN  45           2HB      GLN  45 -10.170   4.292  10.032
  351    HB3  GLN  45           1HB      GLN  45 -10.508   2.718  10.737
  352    HG2  GLN  45           2HG      GLN  45  -9.053   3.207  12.604
  353    HG3  GLN  45           1HG      GLN  45  -8.615   4.755  11.885
  354   HE21  GLN  45          1HE2      GLN  45  -9.332   5.911  13.621
  355   HE22  GLN  45          2HE2      GLN  45 -11.014   6.124  13.956
  356    H    ASP  46           HN       ASP  46  -8.951   0.403   9.522
  357    HA   ASP  46           HA       ASP  46  -7.866  -0.371  12.113
  358    HB2  ASP  46           2HB      ASP  46 -10.064  -1.221  10.865
  359    HB3  ASP  46           1HB      ASP  46  -8.927  -2.387  10.196
  360    H    VAL  47           HN       VAL  47  -6.865  -0.167   8.894
  361    HA   VAL  47           HA       VAL  47  -5.141  -2.351   8.629
  362    HB   VAL  47           HB       VAL  47  -4.776   0.427   7.478
  363   HG11  VAL  47          1HG1      VAL  47  -2.721  -0.880   7.368
  364   HG12  VAL  47          2HG1      VAL  47  -3.424  -0.690   5.763
  365   HG13  VAL  47          3HG1      VAL  47  -3.595  -2.218   6.625
  366   HG21  VAL  47          3HG2      VAL  47  -6.146  -2.014   6.349
  367   HG22  VAL  47          1HG2      VAL  47  -5.851  -0.511   5.473
  368   HG23  VAL  47          2HG2      VAL  47  -6.927  -0.521   6.869
  369    H    ASP  48           HN       ASP  48  -3.528  -2.912   9.874
  370    HA   ASP  48           HA       ASP  48  -1.917  -0.827  11.190
  371    HB2  ASP  48           2HB      ASP  48  -3.232  -1.930  12.869
  372    HB3  ASP  48           1HB      ASP  48  -2.816  -3.514  12.239
  373    H    THR  49           HN       THR  49   0.235  -1.681  11.888
  374    HA   THR  49           HA       THR  49   1.800  -2.382   9.705
  375    HB   THR  49           HB       THR  49   2.471  -2.792  12.627
  376    HG1  THR  49           1HG      THR  49   2.996  -0.506  11.013
  377   HG21  THR  49          3HG2      THR  49   4.062  -3.836  11.064
  378   HG22  THR  49          1HG2      THR  49   4.781  -2.468  11.915
  379   HG23  THR  49          2HG2      THR  49   4.252  -2.287  10.242
  380    H    LYS  50           HN       LYS  50   0.536  -4.424  12.336
  381    HA   LYS  50           HA       LYS  50   1.907  -6.770  11.571
  382    HB2  LYS  50           2HB      LYS  50   0.616  -6.157  13.768
  383    HB3  LYS  50           1HB      LYS  50  -0.765  -6.845  12.929
  384    HG2  LYS  50           2HG      LYS  50   1.814  -8.343  13.292
  385    HG3  LYS  50           1HG      LYS  50   0.509  -8.377  14.476
  386    HD2  LYS  50           2HD      LYS  50  -0.981  -9.396  12.933
  387    HD3  LYS  50           1HD      LYS  50   0.118  -9.104  11.583
  388    HE2  LYS  50           2HE      LYS  50   0.183 -11.439  12.263
  389    HE3  LYS  50           1HE      LYS  50   1.730 -10.653  12.564
  390    HZ1  LYS  50           3HZ      LYS  50  -0.360 -11.113  14.622
  391    HZ2  LYS  50           1HZ      LYS  50   1.189 -10.474  14.888
  392    HZ3  LYS  50           2HZ      LYS  50   1.008 -12.091  14.399
  393    H    LEU  51           HN       LEU  51  -1.227  -5.432  10.678
  394    HA   LEU  51           HA       LEU  51  -2.153  -7.641   9.195
  395    HB2  LEU  51           2HB      LEU  51  -2.784  -4.702   8.951
  396    HB3  LEU  51           1HB      LEU  51  -3.655  -5.971   8.119
  397    HG   LEU  51           HG       LEU  51  -3.518  -5.556  11.099
  398   HD11  LEU  51          1HD1      LEU  51  -4.968  -3.963  10.003
  399   HD12  LEU  51          2HD1      LEU  51  -5.934  -5.149  10.877
  400   HD13  LEU  51          3HD1      LEU  51  -5.775  -5.260   9.124
  401   HD21  LEU  51          3HD2      LEU  51  -5.082  -7.417  11.266
  402   HD22  LEU  51          1HD2      LEU  51  -3.559  -7.936  10.543
  403   HD23  LEU  51          2HD2      LEU  51  -4.976  -7.675   9.526
  404    H    ILE  52           HN       ILE  52  -0.202  -4.828   8.344
  405    HA   ILE  52           HA       ILE  52  -0.050  -5.334   5.565
  406    HB   ILE  52           HB       ILE  52   1.938  -3.908   7.344
  407   HG12  ILE  52          2HG1      ILE  52  -0.323  -2.824   5.648
  408   HG13  ILE  52          1HG1      ILE  52  -0.340  -2.949   7.402
  409   HG21  ILE  52          1HG2      ILE  52   1.604  -3.834   4.344
  410   HG22  ILE  52          2HG2      ILE  52   2.942  -4.567   5.228
  411   HG23  ILE  52          3HG2      ILE  52   2.704  -2.822   5.281
  412   HD11  ILE  52          3HD1      ILE  52   0.133  -0.688   6.747
  413   HD12  ILE  52          1HD1      ILE  52   1.484  -1.226   5.749
  414   HD13  ILE  52          2HD1      ILE  52   1.564  -1.393   7.502
  415    H    MET  53           HN       MET  53   1.913  -6.365   8.313
  416    HA   MET  53           HA       MET  53   3.945  -7.701   6.926
  417    HB2  MET  53           2HB      MET  53   2.714  -8.301   9.619
  418    HB3  MET  53           1HB      MET  53   4.152  -9.103   9.003
  419    HG2  MET  53           2HG      MET  53   5.318  -6.964   8.915
  420    HG3  MET  53           1HG      MET  53   3.872  -6.151   9.522
  421    HE1  MET  53           3HE      MET  53   6.811  -5.944  10.850
  422    HE2  MET  53           1HE      MET  53   6.380  -6.018  12.558
  423    HE3  MET  53           2HE      MET  53   5.400  -5.070  11.440
  424    H    LYS  54           HN       LYS  54   0.711  -8.739   7.842
  425    HA   LYS  54           HA       LYS  54   0.957 -11.455   7.172
  426    HB2  LYS  54           2HB      LYS  54  -1.485  -9.674   7.089
  427    HB3  LYS  54           1HB      LYS  54  -1.515 -11.430   6.996
  428    HG2  LYS  54           2HG      LYS  54  -0.600 -11.599   9.227
  429    HG3  LYS  54           1HG      LYS  54  -0.447  -9.843   9.324
  430    HD2  LYS  54           2HD      LYS  54  -2.421 -10.533  10.524
  431    HD3  LYS  54           1HD      LYS  54  -2.906  -9.665   9.068
  432    HE2  LYS  54           2HE      LYS  54  -3.298 -11.815   7.940
  433    HE3  LYS  54           1HE      LYS  54  -2.840 -12.660   9.416
  434    HZ1  LYS  54           3HZ      LYS  54  -4.700 -11.505  10.541
  435    HZ2  LYS  54           1HZ      LYS  54  -5.205 -12.544   9.297
  436    HZ3  LYS  54           2HZ      LYS  54  -5.179 -10.871   9.042
  437    H    VAL  55           HN       VAL  55   0.198  -8.621   5.228
  438    HA   VAL  55           HA       VAL  55  -0.522 -10.067   2.876
  439    HB   VAL  55           HB       VAL  55   0.445  -7.210   3.068
  440   HG11  VAL  55          1HG1      VAL  55  -1.226  -8.596   0.976
  441   HG12  VAL  55          2HG1      VAL  55   0.458  -8.110   0.800
  442   HG13  VAL  55          3HG1      VAL  55  -0.796  -6.886   0.988
  443   HG21  VAL  55          3HG2      VAL  55  -1.914  -6.575   3.184
  444   HG22  VAL  55          1HG2      VAL  55  -1.449  -7.572   4.562
  445   HG23  VAL  55          2HG2      VAL  55  -2.370  -8.277   3.233
  446    H    LEU  56           HN       LEU  56   2.433  -8.518   4.036
  447    HA   LEU  56           HA       LEU  56   3.862  -8.965   1.587
  448    HB2  LEU  56           2HB      LEU  56   4.868  -8.151   4.311
  449    HB3  LEU  56           1HB      LEU  56   5.797  -8.096   2.825
  450    HG   LEU  56           HG       LEU  56   3.321  -6.466   3.392
  451   HD11  LEU  56          1HD1      LEU  56   6.227  -5.667   3.313
  452   HD12  LEU  56          2HD1      LEU  56   5.219  -5.775   4.755
  453   HD13  LEU  56          3HD1      LEU  56   4.858  -4.574   3.517
  454   HD21  LEU  56          3HD2      LEU  56   5.248  -6.383   1.071
  455   HD22  LEU  56          1HD2      LEU  56   3.900  -5.276   1.340
  456   HD23  LEU  56          2HD2      LEU  56   3.590  -6.983   1.020
  457    H    ASP  57           HN       ASP  57   3.343 -10.724   4.487
  458    HA   ASP  57           HA       ASP  57   5.577 -12.178   4.969
  459    HB2  ASP  57           2HB      ASP  57   3.355 -12.298   6.171
  460    HB3  ASP  57           1HB      ASP  57   2.835 -13.423   4.946
  461    HA   PRO  58           HA       PRO  58   4.591 -15.591   1.746
  462    HB2  PRO  58           2HB      PRO  58   2.694 -15.154  -0.131
  463    HB3  PRO  58           1HB      PRO  58   2.325 -15.860   1.446
  464    HG2  PRO  58           2HG      PRO  58   1.990 -13.036   0.505
  465    HG3  PRO  58           1HG      PRO  58   0.881 -14.036   1.464
  466    HD2  PRO  58           2HD      PRO  58   2.505 -12.163   2.577
  467    HD3  PRO  58           1HD      PRO  58   2.023 -13.641   3.426
  468    H    ILE  59           HN       ILE  59   4.475 -12.234   0.839
  469    HA   ILE  59           HA       ILE  59   5.348 -12.604  -1.859
  470    HB   ILE  59           HB       ILE  59   5.450 -10.061  -0.240
  471   HG12  ILE  59          2HG1      ILE  59   3.200 -11.067  -0.139
  472   HG13  ILE  59          1HG1      ILE  59   3.203  -9.583  -1.079
  473   HG21  ILE  59          1HG2      ILE  59   5.201  -8.979  -2.437
  474   HG22  ILE  59          2HG2      ILE  59   5.261 -10.562  -3.210
  475   HG23  ILE  59          3HG2      ILE  59   6.669  -9.955  -2.339
  476   HD11  ILE  59          3HD1      ILE  59   1.821 -11.279  -2.124
  477   HD12  ILE  59          1HD1      ILE  59   3.194 -12.384  -2.182
  478   HD13  ILE  59          2HD1      ILE  59   3.214 -10.905  -3.140
  479    H    TRP  60           HN       TRP  60   6.923 -12.054   1.230
  480    HA   TRP  60           HA       TRP  60   9.425 -11.195   0.284
  481    HB2  TRP  60           2HB      TRP  60   8.678 -12.698   2.795
  482    HB3  TRP  60           1HB      TRP  60  10.306 -12.115   2.470
  483    HD1  TRP  60           1HD      TRP  60   7.345 -11.121   4.289
  484    HE1  TRP  60           1HE      TRP  60   7.305  -8.588   4.748
  485    HE3  TRP  60           3HE      TRP  60  10.975  -9.640   1.002
  486    HZ2  TRP  60           2HZ      TRP  60   8.631  -6.270   3.834
  487    HZ3  TRP  60           3HZ      TRP  60  11.528  -7.244   0.860
  488    HH2  TRP  60           2HH      TRP  60  10.380  -5.598   2.246
  489    H    GLU  61           HN       GLU  61   8.008 -14.379   0.457
  490    HA   GLU  61           HA       GLU  61  10.477 -15.740  -0.039
  491    HB2  GLU  61           2HB      GLU  61   7.596 -16.641  -0.068
  492    HB3  GLU  61           1HB      GLU  61   8.970 -17.703  -0.265
  493    HG2  GLU  61           2HG      GLU  61   8.362 -16.035   2.155
  494    HG3  GLU  61           1HG      GLU  61   8.133 -17.776   2.008
  495    H    GLN  62           HN       GLN  62   7.721 -14.586  -1.894
  496    HA   GLN  62           HA       GLN  62   8.497 -15.978  -4.293
  497    HB2  GLN  62           2HB      GLN  62   6.397 -13.862  -3.791
  498    HB3  GLN  62           1HB      GLN  62   6.623 -14.695  -5.320
  499    HG2  GLN  62           2HG      GLN  62   6.080 -16.812  -4.288
  500    HG3  GLN  62           1HG      GLN  62   5.940 -16.029  -2.714
  501   HE21  GLN  62          1HE2      GLN  62   4.459 -16.512  -5.822
  502   HE22  GLN  62          2HE2      GLN  62   2.909 -15.872  -5.402
  503    H    LYS  63           HN       LYS  63   8.187 -12.532  -3.434
  504    HA   LYS  63           HA       LYS  63  10.435 -11.876  -5.167
  505    HB2  LYS  63           2HB      LYS  63   7.677 -10.675  -5.501
  506    HB3  LYS  63           1HB      LYS  63   9.134 -10.030  -6.240
  507    HG2  LYS  63           2HG      LYS  63   9.413 -12.014  -7.558
  508    HG3  LYS  63           1HG      LYS  63   8.079 -12.809  -6.721
  509    HD2  LYS  63           2HD      LYS  63   7.321 -12.028  -8.874
  510    HD3  LYS  63           1HD      LYS  63   6.548 -11.078  -7.607
  511    HE2  LYS  63           2HE      LYS  63   7.275  -9.673  -9.468
  512    HE3  LYS  63           1HE      LYS  63   8.131  -9.267  -7.983
  513    HZ1  LYS  63           3HZ      LYS  63  10.036 -10.496  -8.751
  514    HZ2  LYS  63           1HZ      LYS  63   9.597  -9.358  -9.928
  515    HZ3  LYS  63           2HZ      LYS  63   9.210 -10.996 -10.145
  516    HA   PRO  64           HA       PRO  64  10.571  -9.903  -1.013
  517    HB2  PRO  64           2HB      PRO  64  13.399  -9.593  -1.854
  518    HB3  PRO  64           1HB      PRO  64  12.735 -10.239  -0.351
  519    HG2  PRO  64           2HG      PRO  64  13.793 -11.845  -2.208
  520    HG3  PRO  64           1HG      PRO  64  12.391 -12.338  -1.244
  521    HD2  PRO  64           2HD      PRO  64  12.518 -11.424  -4.080
  522    HD3  PRO  64           1HD      PRO  64  11.463 -12.635  -3.327
  523    H    GLU  65           HN       GLU  65  12.429  -8.656  -3.801
  524    HA   GLU  65           HA       GLU  65  12.619  -6.029  -2.904
  525    HB2  GLU  65           2HB      GLU  65  12.600  -7.107  -5.715
  526    HB3  GLU  65           1HB      GLU  65  13.167  -5.526  -5.237
  527    HG2  GLU  65           2HG      GLU  65  14.355  -8.158  -4.425
  528    HG3  GLU  65           1HG      GLU  65  15.030  -7.016  -5.586
  529    H    THR  66           HN       THR  66  10.190  -7.688  -4.821
  530    HA   THR  66           HA       THR  66   8.741  -5.363  -5.567
  531    HB   THR  66           HB       THR  66   7.710  -8.200  -5.356
  532    HG1  THR  66           1HG      THR  66   9.655  -7.839  -6.699
  533   HG21  THR  66          3HG2      THR  66   5.937  -6.531  -5.641
  534   HG22  THR  66          1HG2      THR  66   6.140  -7.490  -7.107
  535   HG23  THR  66          2HG2      THR  66   6.791  -5.855  -7.028
  536    H    ALA  67           HN       ALA  67   8.628  -7.514  -2.797
  537    HA   ALA  67           HA       ALA  67   6.194  -6.652  -1.688
  538    HB1  ALA  67           1HB      ALA  67   8.655  -7.644  -0.252
  539    HB2  ALA  67           2HB      ALA  67   7.377  -8.652  -0.932
  540    HB3  ALA  67           3HB      ALA  67   7.023  -7.567   0.412
  541    H    SER  68           HN       SER  68   9.500  -5.432  -1.287
  542    HA   SER  68           HA       SER  68   8.796  -3.421   0.612
  543    HB2  SER  68           2HB      SER  68  11.108  -4.331   0.338
  544    HB3  SER  68           1HB      SER  68  11.209  -3.523  -1.225
  545    HG   SER  68           HG       SER  68  11.935  -1.907  -0.087
  546    H    ARG  69           HN       ARG  69   9.093  -3.488  -2.910
  547    HA   ARG  69           HA       ARG  69   8.734  -0.701  -3.281
  548    HB2  ARG  69           2HB      ARG  69   8.331  -3.041  -5.147
  549    HB3  ARG  69           1HB      ARG  69   8.313  -1.362  -5.643
  550    HG2  ARG  69           2HG      ARG  69  10.625  -1.112  -4.862
  551    HG3  ARG  69           1HG      ARG  69  10.631  -2.818  -4.415
  552    HD2  ARG  69           2HD      ARG  69  10.085  -3.340  -6.809
  553    HD3  ARG  69           1HD      ARG  69  10.374  -1.638  -7.172
  554    HE   ARG  69           HE       ARG  69  12.498  -3.188  -5.864
  555   HH11  ARG  69          1HH1      ARG  69  11.322  -1.400  -8.634
  556   HH12  ARG  69          2HH1      ARG  69  12.822  -1.503  -9.509
  557   HH21  ARG  69          1HH2      ARG  69  14.480  -3.334  -6.999
  558   HH22  ARG  69          2HH2      ARG  69  14.624  -2.584  -8.564
  559    H    LEU  70           HN       LEU  70   6.551  -3.433  -3.030
  560    HA   LEU  70           HA       LEU  70   4.176  -2.147  -3.837
  561    HB2  LEU  70           2HB      LEU  70   4.387  -4.582  -3.584
  562    HB3  LEU  70           1HB      LEU  70   4.566  -4.389  -1.852
  563    HG   LEU  70           HG       LEU  70   2.256  -3.452  -1.767
  564   HD11  LEU  70          1HD1      LEU  70   2.154  -4.328  -4.647
  565   HD12  LEU  70          2HD1      LEU  70   2.107  -2.662  -4.070
  566   HD13  LEU  70          3HD1      LEU  70   0.786  -3.768  -3.687
  567   HD21  LEU  70          3HD2      LEU  70   2.663  -5.786  -1.236
  568   HD22  LEU  70          1HD2      LEU  70   2.546  -6.214  -2.942
  569   HD23  LEU  70          2HD2      LEU  70   1.128  -5.609  -2.088
  570    H    ARG  71           HN       ARG  71   5.927  -2.244  -0.816
  571    HA   ARG  71           HA       ARG  71   4.038  -1.255   0.957
  572    HB2  ARG  71           2HB      ARG  71   7.024  -0.836   0.863
  573    HB3  ARG  71           1HB      ARG  71   6.021  -0.378   2.219
  574    HG2  ARG  71           2HG      ARG  71   5.321  -2.766   2.411
  575    HG3  ARG  71           1HG      ARG  71   6.542  -3.144   1.191
  576    HD2  ARG  71           2HD      ARG  71   7.032  -1.844   3.869
  577    HD3  ARG  71           1HD      ARG  71   7.412  -3.511   3.437
  578    HE   ARG  71           HE       ARG  71   9.008  -2.560   1.797
  579   HH11  ARG  71          1HH1      ARG  71   7.975  -0.569   4.481
  580   HH12  ARG  71          2HH1      ARG  71   9.412   0.399   4.476
  581   HH21  ARG  71          1HH2      ARG  71  10.913  -1.312   1.804
  582   HH22  ARG  71          2HH2      ARG  71  11.100  -0.044   2.983
  583    H    GLY  72           HN       GLY  72   6.059   0.444  -1.373
  584    HA2  GLY  72           2HA      GLY  72   5.709   3.062  -0.422
  585    HA3  GLY  72           1HA      GLY  72   6.076   2.625  -2.085
  586    H    ARG  73           HN       ARG  73   3.680   1.092  -2.527
  587    HA   ARG  73           HA       ARG  73   1.933   3.193  -3.314
  588    HB2  ARG  73           2HB      ARG  73   1.281   0.244  -3.151
  589    HB3  ARG  73           1HB      ARG  73   0.455   1.454  -4.122
  590    HG2  ARG  73           2HG      ARG  73   2.588   1.781  -5.378
  591    HG3  ARG  73           1HG      ARG  73   3.243   0.402  -4.493
  592    HD2  ARG  73           2HD      ARG  73   1.358  -0.972  -5.377
  593    HD3  ARG  73           1HD      ARG  73   0.876   0.408  -6.362
  594    HE   ARG  73           HE       ARG  73   3.138  -1.340  -6.788
  595   HH11  ARG  73          1HH1      ARG  73   1.598   1.688  -7.591
  596   HH12  ARG  73          2HH1      ARG  73   2.503   1.916  -9.057
  597   HH21  ARG  73          1HH2      ARG  73   4.313  -1.058  -8.752
  598   HH22  ARG  73          2HH2      ARG  73   4.022   0.352  -9.718
  599    H    ILE  74           HN       ILE  74   1.773   0.697  -0.822
  600    HA   ILE  74           HA       ILE  74  -0.743   1.372   0.230
  601    HB   ILE  74           HB       ILE  74   1.602   0.145   1.699
  602   HG12  ILE  74          2HG1      ILE  74  -0.641  -1.215   0.183
  603   HG13  ILE  74          1HG1      ILE  74   1.017  -1.062  -0.389
  604   HG21  ILE  74          1HG2      ILE  74  -0.147   0.909   3.203
  605   HG22  ILE  74          2HG2      ILE  74  -0.113  -0.854   3.142
  606   HG23  ILE  74          3HG2      ILE  74  -1.360   0.034   2.267
  607   HD11  ILE  74          3HD1      ILE  74   0.116  -2.569   2.053
  608   HD12  ILE  74          1HD1      ILE  74   1.786  -2.398   1.512
  609   HD13  ILE  74          2HD1      ILE  74   0.622  -3.267   0.513
  610    H    GLU  75           HN       GLU  75   2.531   2.414   1.096
  611    HA   GLU  75           HA       GLU  75   1.866   3.933   3.360
  612    HB2  GLU  75           2HB      GLU  75   4.159   3.156   2.543
  613    HB3  GLU  75           1HB      GLU  75   4.136   4.538   1.460
  614    HG2  GLU  75           2HG      GLU  75   3.685   4.976   4.369
  615    HG3  GLU  75           1HG      GLU  75   5.316   4.650   3.793
  616    H    SER  76           HN       SER  76   2.145   4.849  -0.063
  617    HA   SER  76           HA       SER  76   1.696   7.593   0.241
  618    HB2  SER  76           2HB      SER  76   1.020   5.808  -2.092
  619    HB3  SER  76           1HB      SER  76   1.077   7.567  -2.148
  620    HG   SER  76           HG       SER  76   3.222   5.758  -1.692
  621    H    VAL  77           HN       VAL  77  -0.586   4.928  -0.239
  622    HA   VAL  77           HA       VAL  77  -2.885   6.595  -0.484
  623    HB   VAL  77           HB       VAL  77  -2.714   3.659   0.250
  624   HG11  VAL  77          1HG1      VAL  77  -4.840   4.636   0.937
  625   HG12  VAL  77          2HG1      VAL  77  -5.054   3.539  -0.426
  626   HG13  VAL  77          3HG1      VAL  77  -5.077   5.283  -0.687
  627   HG21  VAL  77          3HG2      VAL  77  -3.272   3.272  -2.100
  628   HG22  VAL  77          1HG2      VAL  77  -1.751   4.146  -1.930
  629   HG23  VAL  77          2HG2      VAL  77  -3.215   5.009  -2.401
  630    H    LEU  78           HN       LEU  78  -1.437   4.822   2.231
  631    HA   LEU  78           HA       LEU  78  -3.514   5.317   4.073
  632    HB2  LEU  78           2HB      LEU  78  -0.589   4.746   4.533
  633    HB3  LEU  78           1HB      LEU  78  -1.791   4.801   5.808
  634    HG   LEU  78           HG       LEU  78  -1.802   2.865   3.492
  635   HD11  LEU  78          1HD1      LEU  78  -1.137   2.438   6.398
  636   HD12  LEU  78          2HD1      LEU  78   0.014   2.430   5.060
  637   HD13  LEU  78          3HD1      LEU  78  -1.233   1.186   5.161
  638   HD21  LEU  78          3HD2      LEU  78  -4.051   3.356   4.246
  639   HD22  LEU  78          1HD2      LEU  78  -3.577   3.081   5.921
  640   HD23  LEU  78          2HD2      LEU  78  -3.581   1.740   4.774
  641    H    ASP  79           HN       ASP  79  -0.645   7.180   3.208
  642    HA   ASP  79           HA       ASP  79  -0.820   9.064   5.317
  643    HB2  ASP  79           2HB      ASP  79   1.179   8.748   3.854
  644    HB3  ASP  79           1HB      ASP  79   0.291   9.500   2.532
  645    H    TRP  80           HN       TRP  80  -2.056   9.058   2.010
  646    HA   TRP  80           HA       TRP  80  -3.377  11.529   2.039
  647    HB2  TRP  80           2HB      TRP  80  -2.944  10.252  -0.004
  648    HB3  TRP  80           1HB      TRP  80  -4.023   8.977   0.544
  649    HD1  TRP  80           1HD      TRP  80  -4.098  12.567  -0.830
  650    HE1  TRP  80           1HE      TRP  80  -6.445  13.020  -1.794
  651    HE3  TRP  80           3HE      TRP  80  -6.438   8.273   0.684
  652    HZ2  TRP  80           2HZ      TRP  80  -8.951  11.721  -1.887
  653    HZ3  TRP  80           3HZ      TRP  80  -8.808   7.962   0.114
  654    HH2  TRP  80           2HH      TRP  80 -10.036   9.652  -1.145
  655    H    ALA  81           HN       ALA  81  -4.479   8.274   2.900
  656    HA   ALA  81           HA       ALA  81  -7.158   8.909   3.452
  657    HB1  ALA  81           1HB      ALA  81  -6.345   6.618   3.145
  658    HB2  ALA  81           2HB      ALA  81  -7.235   6.802   4.657
  659    HB3  ALA  81           3HB      ALA  81  -5.472   6.730   4.675
  660    H    THR  82           HN       THR  82  -4.274   9.035   5.465
  661    HA   THR  82           HA       THR  82  -5.575   9.475   7.923
  662    HB   THR  82           HB       THR  82  -2.802  10.331   7.069
  663    HG1  THR  82           1HG      THR  82  -2.567   8.215   7.074
  664   HG21  THR  82          3HG2      THR  82  -3.519  11.511   9.088
  665   HG22  THR  82          1HG2      THR  82  -2.291  10.306   9.476
  666   HG23  THR  82          2HG2      THR  82  -3.988   9.981   9.831
  667    H    VAL  83           HN       VAL  83  -4.354  11.726   5.472
  668    HA   VAL  83           HA       VAL  83  -4.953  14.076   6.969
  669    HB   VAL  83           HB       VAL  83  -4.607  13.787   3.975
  670   HG11  VAL  83          1HG1      VAL  83  -4.412  16.216   5.753
  671   HG12  VAL  83          2HG1      VAL  83  -5.682  15.882   4.577
  672   HG13  VAL  83          3HG1      VAL  83  -4.030  16.171   4.033
  673   HG21  VAL  83          3HG2      VAL  83  -2.287  14.473   4.388
  674   HG22  VAL  83          1HG2      VAL  83  -2.673  12.943   5.175
  675   HG23  VAL  83          2HG2      VAL  83  -2.590  14.428   6.125
  676    H    ARG  84           HN       ARG  84  -6.727  12.113   4.648
  677    HA   ARG  84           HA       ARG  84  -8.909  13.978   4.469
  678    HB2  ARG  84           2HB      ARG  84  -8.318  11.285   3.329
  679    HB3  ARG  84           1HB      ARG  84  -9.988  11.834   3.360
  680    HG2  ARG  84           2HG      ARG  84  -8.885  12.322   1.229
  681    HG3  ARG  84           1HG      ARG  84  -9.413  13.782   2.058
  682    HD2  ARG  84           2HD      ARG  84  -7.118  14.119   2.877
  683    HD3  ARG  84           1HD      ARG  84  -6.608  12.689   1.984
  684    HE   ARG  84           HE       ARG  84  -7.092  13.865  -0.060
  685   HH11  ARG  84          1HH1      ARG  84  -7.094  15.829   2.832
  686   HH12  ARG  84          2HH1      ARG  84  -6.765  17.315   1.994
  687   HH21  ARG  84          1HH2      ARG  84  -6.640  15.811  -1.187
  688   HH22  ARG  84          2HH2      ARG  84  -6.483  17.300  -0.294
  689    H    GLY  85           HN       GLY  85  -7.970  11.818   6.824
  690    HA2  GLY  85           2HA      GLY  85  -9.032  11.732   8.905
  691    HA3  GLY  85           1HA      GLY  85 -10.513  12.290   8.151
  692    H    TYR  86           HN       TYR  86  -9.331   9.772   6.322
  693    HA   TYR  86           HA       TYR  86 -11.427   8.024   7.168
  694    HB2  TYR  86           2HB      TYR  86  -9.085   7.501   5.317
  695    HB3  TYR  86           1HB      TYR  86 -10.464   6.428   5.529
  696    HD1  TYR  86           2HD      TYR  86 -12.794   7.987   5.381
  697    HD2  TYR  86           1HD      TYR  86  -9.143   8.591   3.291
  698    HE1  TYR  86           2HE      TYR  86 -14.009   9.207   3.627
  699    HE2  TYR  86           1HE      TYR  86 -10.347   9.815   1.532
  700    HH   TYR  86           HH       TYR  86 -13.452  10.988   1.913
  701    H    ARG  87           HN       ARG  87  -8.142   8.472   7.989
  702    HA   ARG  87           HA       ARG  87  -8.474   6.763  10.290
  703    HB2  ARG  87           2HB      ARG  87  -6.308   5.594   9.961
  704    HB3  ARG  87           1HB      ARG  87  -7.497   5.149   8.745
  705    HG2  ARG  87           2HG      ARG  87  -6.426   6.490   7.094
  706    HG3  ARG  87           1HG      ARG  87  -5.352   7.209   8.296
  707    HD2  ARG  87           2HD      ARG  87  -5.406   4.264   7.665
  708    HD3  ARG  87           1HD      ARG  87  -4.330   5.405   6.862
  709    HE   ARG  87           HE       ARG  87  -3.416   5.888   9.120
  710   HH11  ARG  87          1HH1      ARG  87  -5.075   2.855   8.540
  711   HH12  ARG  87          2HH1      ARG  87  -4.186   1.987   9.756
  712   HH21  ARG  87          1HH2      ARG  87  -2.253   4.755  10.739
  713   HH22  ARG  87          2HH2      ARG  87  -2.609   3.075  11.040
  714    H    GLU  88           HN       GLU  88  -7.077   7.450  12.006
  715    HA   GLU  88           HA       GLU  88  -5.322   9.697  11.326
  716    HB2  GLU  88           2HB      GLU  88  -7.356   9.711  13.559
  717    HB3  GLU  88           1HB      GLU  88  -6.097  10.921  13.346
  718    HG2  GLU  88           2HG      GLU  88  -7.102  11.234  10.995
  719    HG3  GLU  88           1HG      GLU  88  -8.502  10.388  11.650
  720    H    GLY  89           HN       GLY  89  -3.847  10.279  13.124
  721    HA2  GLY  89           2HA      GLY  89  -2.747   9.434  15.166
  722    HA3  GLY  89           1HA      GLY  89  -3.028   7.820  14.543
  723    H    ASP  90           HN       ASP  90  -1.597   6.932  13.216
  724    HA   ASP  90           HA       ASP  90   0.440   8.549  11.902
  725    HB2  ASP  90           2HB      ASP  90   1.219   7.834  14.263
  726    HB3  ASP  90           1HB      ASP  90   1.283   6.202  13.612
  727    H    ASN  91           HN       ASN  91   1.700   7.180  10.324
  728    HA   ASN  91           HA       ASN  91  -0.048   5.248   9.076
  729    HB2  ASN  91           2HB      ASN  91   2.461   6.681   8.355
  730    HB3  ASN  91           1HB      ASN  91   2.163   5.137   7.574
  731   HD21  ASN  91          1HD2      ASN  91   2.022   6.279   5.586
  732   HD22  ASN  91          2HD2      ASN  91   0.569   7.110   5.158
  733    HA   PRO  92           HA       PRO  92   2.118   1.822  10.900
  734    HB2  PRO  92           2HB      PRO  92   0.658  -0.144   9.845
  735    HB3  PRO  92           1HB      PRO  92  -0.054   1.009  10.981
  736    HG2  PRO  92           2HG      PRO  92  -0.346   0.835   8.024
  737    HG3  PRO  92           1HG      PRO  92  -1.522   1.350   9.244
  738    HD2  PRO  92           2HD      PRO  92   0.095   3.021   7.640
  739    HD3  PRO  92           1HD      PRO  92  -0.891   3.512   9.031
  740    H    ALA  93           HN       ALA  93   2.597   2.831   7.840
  741    HA   ALA  93           HA       ALA  93   3.797   0.357   6.843
  742    HB1  ALA  93           1HB      ALA  93   3.274   2.953   5.408
  743    HB2  ALA  93           2HB      ALA  93   2.250   1.517   5.359
  744    HB3  ALA  93           3HB      ALA  93   3.877   1.466   4.680
  745    H    ARG  94           HN       ARG  94   4.796   2.861   8.678
  746    HA   ARG  94           HA       ARG  94   7.405   3.086   7.399
  747    HB2  ARG  94           2HB      ARG  94   7.802   4.790   9.274
  748    HB3  ARG  94           1HB      ARG  94   6.700   5.225   7.982
  749    HG2  ARG  94           2HG      ARG  94   5.641   5.963   9.912
  750    HG3  ARG  94           1HG      ARG  94   4.842   4.433   9.555
  751    HD2  ARG  94           2HD      ARG  94   6.301   3.321  11.194
  752    HD3  ARG  94           1HD      ARG  94   7.036   4.877  11.573
  753    HE   ARG  94           HE       ARG  94   4.437   5.380  12.016
  754   HH11  ARG  94          1HH1      ARG  94   6.509   2.742  13.010
  755   HH12  ARG  94          2HH1      ARG  94   5.644   2.445  14.487
  756   HH21  ARG  94          1HH2      ARG  94   3.305   5.014  13.940
  757   HH22  ARG  94          2HH2      ARG  94   3.811   3.756  15.020
  758    H    TRP  95           HN       TRP  95   9.300   2.510   8.393
  759    HA   TRP  95           HA       TRP  95   9.090   0.807  10.776
  760    HB2  TRP  95           2HB      TRP  95   9.879   0.011   8.026
  761    HB3  TRP  95           1HB      TRP  95  10.838  -0.639   9.354
  762    HD1  TRP  95           1HD      TRP  95   9.270  -1.860  11.349
  763    HE1  TRP  95           1HE      TRP  95   7.326  -3.501  10.999
  764    HE3  TRP  95           3HE      TRP  95   8.033  -0.617   6.551
  765    HZ2  TRP  95           2HZ      TRP  95   5.483  -4.168   8.952
  766    HZ3  TRP  95           3HZ      TRP  95   6.164  -1.793   5.470
  767    HH2  TRP  95           2HH      TRP  95   4.914  -3.531   6.646
  768    H    ARG  96           HN       ARG  96  11.097   0.401  11.830
  769    HA   ARG  96           HA       ARG  96  13.107   2.446  11.378
  770    HB2  ARG  96           2HB      ARG  96  12.590   0.479  13.582
  771    HB3  ARG  96           1HB      ARG  96  14.135   1.308  13.462
  772    HG2  ARG  96           2HG      ARG  96  11.440   2.626  13.726
  773    HG3  ARG  96           1HG      ARG  96  12.643   2.447  15.007
  774    HD2  ARG  96           2HD      ARG  96  14.233   3.763  13.663
  775    HD3  ARG  96           1HD      ARG  96  12.989   3.983  12.436
  776    HE   ARG  96           HE       ARG  96  11.987   4.881  14.898
  777   HH11  ARG  96          1HH1      ARG  96  14.377   5.721  12.484
  778   HH12  ARG  96          2HH1      ARG  96  14.379   7.415  12.869
  779   HH21  ARG  96          1HH2      ARG  96  11.946   7.125  15.393
  780   HH22  ARG  96          2HH2      ARG  96  12.987   8.214  14.525
  781    H    GLY  97           HN       GLY  97  12.946  -1.072  11.666
  782    HA2  GLY  97           2HA      GLY  97  14.993  -1.345   9.627
  783    HA3  GLY  97           1HA      GLY  97  15.478  -1.866  11.236
  784    H    TYR  98           HN       TYR  98  12.459  -2.185   9.370
  785    HA   TYR  98           HA       TYR  98  11.718  -4.711  10.202
  786    HB2  TYR  98           2HB      TYR  98  10.308  -3.198   8.831
  787    HB3  TYR  98           1HB      TYR  98  11.318  -3.551   7.434
  788    HD1  TYR  98           1HD      TYR  98   8.915  -5.012   9.829
  789    HD2  TYR  98           2HD      TYR  98  10.988  -5.525   6.153
  790    HE1  TYR  98           1HE      TYR  98   7.476  -6.931   9.294
  791    HE2  TYR  98           2HE      TYR  98   9.555  -7.446   5.607
  792    HH   TYR  98           HH       TYR  98   8.169  -9.140   6.906
  793    H    LEU  99           HN       LEU  99  13.532  -3.891   7.253
  794    HA   LEU  99           HA       LEU  99  14.414  -6.649   6.987
  795    HB2  LEU  99           2HB      LEU  99  14.887  -4.222   5.253
  796    HB3  LEU  99           1HB      LEU  99  15.488  -5.827   4.899
  797    HG   LEU  99           HG       LEU  99  12.573  -5.069   5.082
  798   HD11  LEU  99          1HD1      LEU  99  14.321  -5.633   2.689
  799   HD12  LEU  99          2HD1      LEU  99  13.612  -4.079   3.130
  800   HD13  LEU  99          3HD1      LEU  99  12.571  -5.418   2.649
  801   HD21  LEU  99          3HD2      LEU  99  12.189  -7.306   4.134
  802   HD22  LEU  99          1HD2      LEU  99  12.944  -7.376   5.726
  803   HD23  LEU  99          2HD2      LEU  99  13.914  -7.650   4.279
  804    H    GLU 100           HN       GLU 100  16.181  -3.595   6.561
  805    HA   GLU 100           HA       GLU 100  17.990  -4.177   8.707
  806    HB2  GLU 100           2HB      GLU 100  18.945  -5.665   7.056
  807    HB3  GLU 100           1HB      GLU 100  18.933  -4.394   5.842
  808    HG2  GLU 100           2HG      GLU 100  20.688  -3.243   6.864
  809    HG3  GLU 100           1HG      GLU 100  20.497  -4.119   8.380
  810    H    HIS 101           HN       HIS 101  18.773  -2.333   9.512
  811    HA   HIS 101           HA       HIS 101  18.708   0.054   7.777
  812    HB2  HIS 101           2HB      HIS 101  16.991   0.061   9.620
  813    HB3  HIS 101           1HB      HIS 101  18.314   0.013  10.782
  814    HD1  HIS 101           1HD      HIS 101  16.048   2.341   9.776
  815    HD2  HIS 101           2HD      HIS 101  20.204   2.391   9.761
  816    HE1  HIS 101           1HE      HIS 101  16.700   4.773   9.738
  817    HE2  HIS 101           2HE      HIS 101  19.215   4.772   9.926
  818    H    HIS 102           HN       HIS 102  20.894  -0.493   7.190
  819    HA   HIS 102           HA       HIS 102  22.787   0.402   9.262
  820    HB2  HIS 102           2HB      HIS 102  23.196  -1.611   7.050
  821    HB3  HIS 102           1HB      HIS 102  24.548  -0.810   7.840
  822    HD1  HIS 102           1HD      HIS 102  24.022  -3.902   7.969
  823    HD2  HIS 102           2HD      HIS 102  22.961  -1.135  10.890
  824    HE1  HIS 102           1HE      HIS 102  23.829  -5.211  10.111
  825    HE2  HIS 102           2HE      HIS 102  23.001  -3.548  11.818
  826    H    HIS 103           HN       HIS 103  23.349   2.396   8.905
  827    HA   HIS 103           HA       HIS 103  22.621   3.829   6.619
  828    HB2  HIS 103           2HB      HIS 103  23.066   4.687   8.983
  829    HB3  HIS 103           1HB      HIS 103  24.769   4.694   8.548
  830    HD1  HIS 103           1HD      HIS 103  25.391   7.068   8.168
  831    HD2  HIS 103           2HD      HIS 103  21.678   6.146   6.538
  832    HE1  HIS 103           1HE      HIS 103  24.605   9.173   7.038
  833    HE2  HIS 103           2HE      HIS 103  22.427   8.544   5.931
  834    H    HIS 104           HN       HIS 104  25.912   2.939   7.705
  835    HA   HIS 104           HA       HIS 104  27.879   2.689   6.572
  836    HB2  HIS 104           2HB      HIS 104  26.418   1.000   5.370
  837    HB3  HIS 104           1HB      HIS 104  26.138   2.217   4.135
  838    HD1  HIS 104           1HD      HIS 104  27.607   1.986   2.171
  839    HD2  HIS 104           2HD      HIS 104  29.397   0.492   5.626
  840    HE1  HIS 104           1HE      HIS 104  29.837   1.066   1.445
  841    HE2  HIS 104           2HE      HIS 104  30.939   0.243   3.554
  842    H    HIS 105           HN       HIS 105  28.815   3.481   4.104
  843    HA   HIS 105           HA       HIS 105  29.242   5.163   2.640
  844    HB2  HIS 105           2HB      HIS 105  26.711   5.337   2.531
  845    HB3  HIS 105           1HB      HIS 105  26.823   6.614   3.732
  846    HD1  HIS 105           1HD      HIS 105  25.943   6.601   0.549
  847    HD2  HIS 105           2HD      HIS 105  29.245   8.368   2.358
  848    HE1  HIS 105           1HE      HIS 105  26.629   8.481  -0.975
  849    HE2  HIS 105           2HE      HIS 105  28.462   9.682   0.269
  850    H    HIS 106           HN       HIS 106  31.019   6.258   3.098
  851    HA   HIS 106           HA       HIS 106  31.498   7.511   5.597
  852    HB2  HIS 106           2HB      HIS 106  33.327   6.643   4.191
  853    HB3  HIS 106           1HB      HIS 106  32.970   7.864   2.974
  854    HD1  HIS 106           1HD      HIS 106  34.504   9.800   3.090
  855    HD2  HIS 106           2HD      HIS 106  33.945   8.046   6.824
  856    HE1  HIS 106           1HE      HIS 106  35.940  11.112   4.678
  857    HE2  HIS 106           2HE      HIS 106  35.705   9.949   6.899
  Start of MODEL   14
    1    H1   MET   1           H1       MET   1 -15.300   2.254   5.541
    2    H2   MET   1           H2       MET   1 -15.446   3.930   5.342
    3    H3   MET   1           H3       MET   1 -14.093   3.285   6.135
    4    HA   MET   1           HA       MET   1 -14.784   2.894   3.277
    5    HB2  MET   1           2HB      MET   1 -13.917   5.179   3.951
    6    HB3  MET   1           1HB      MET   1 -12.446   4.381   4.489
    7    HG2  MET   1           2HG      MET   1 -11.980   5.211   2.346
    8    HG3  MET   1           1HG      MET   1 -12.223   3.477   2.152
    9    HE1  MET   1           2HE      MET   1 -15.366   6.658   1.018
   10    HE2  MET   1           3HE      MET   1 -13.750   7.046   1.604
   11    HE3  MET   1           1HE      MET   1 -14.919   6.283   2.683
   12    H    THR   2           HN       THR   2 -13.848   1.155   2.362
   13    HA   THR   2           HA       THR   2 -12.109  -0.468   4.040
   14    HB   THR   2           HB       THR   2 -12.250  -2.128   2.190
   15    HG1  THR   2           1HG      THR   2 -14.177  -0.385   1.024
   16   HG21  THR   2          3HG2      THR   2 -14.891  -1.042   3.167
   17   HG22  THR   2          1HG2      THR   2 -13.870  -2.211   4.001
   18   HG23  THR   2          2HG2      THR   2 -14.644  -2.646   2.477
   19    H    PHE   3           HN       PHE   3 -10.115  -1.417   3.075
   20    HA   PHE   3           HA       PHE   3  -8.348   0.619   2.299
   21    HB2  PHE   3           2HB      PHE   3  -7.660  -1.450   3.469
   22    HB3  PHE   3           1HB      PHE   3  -7.982  -2.369   2.003
   23    HD1  PHE   3           1HD      PHE   3  -5.898   0.380   3.363
   24    HD2  PHE   3           2HD      PHE   3  -6.326  -2.625   0.383
   25    HE1  PHE   3           1HE      PHE   3  -3.592   0.799   2.613
   26    HE2  PHE   3           2HE      PHE   3  -4.023  -2.209  -0.375
   27    HZ   PHE   3           HZ       PHE   3  -2.653  -0.497   0.741
   28    H    SER   4           HN       SER   4  -9.990  -1.887   0.406
   29    HA   SER   4           HA       SER   4  -8.750  -1.375  -2.058
   30    HB2  SER   4           2HB      SER   4 -11.543  -2.404  -1.498
   31    HB3  SER   4           1HB      SER   4 -10.734  -2.481  -3.065
   32    HG   SER   4           HG       SER   4  -9.037  -3.518  -1.408
   33    H    GLU   5           HN       GLU   5 -11.604   0.061  -0.554
   34    HA   GLU   5           HA       GLU   5 -12.346   1.693  -2.738
   35    HB2  GLU   5           2HB      GLU   5 -12.882   1.853   0.219
   36    HB3  GLU   5           1HB      GLU   5 -13.563   2.988  -0.925
   37    HG2  GLU   5           2HG      GLU   5 -14.685   1.169  -2.081
   38    HG3  GLU   5           1HG      GLU   5 -13.987   0.018  -0.943
   39    H    CYS   6           HN       CYS   6 -10.446   2.320   0.187
   40    HA   CYS   6           HA       CYS   6 -10.028   5.067  -0.271
   41    HB2  CYS   6           2HB      CYS   6  -9.671   3.707   1.873
   42    HB3  CYS   6           1HB      CYS   6  -8.109   3.279   1.206
   43    HG   CYS   6           HG       CYS   6  -7.671   6.233   0.846
   44    H    ALA   7           HN       ALA   7  -8.056   2.229  -1.016
   45    HA   ALA   7           HA       ALA   7  -5.887   3.555  -2.199
   46    HB1  ALA   7           1HB      ALA   7  -5.826   1.189  -1.601
   47    HB2  ALA   7           2HB      ALA   7  -5.382   1.426  -3.292
   48    HB3  ALA   7           3HB      ALA   7  -6.990   0.829  -2.875
   49    H    ALA   8           HN       ALA   8  -8.938   2.402  -3.584
   50    HA   ALA   8           HA       ALA   8  -8.390   3.107  -6.254
   51    HB1  ALA   8           1HB      ALA   8 -10.218   1.609  -5.626
   52    HB2  ALA   8           2HB      ALA   8 -10.795   2.952  -6.613
   53    HB3  ALA   8           3HB      ALA   8 -11.066   2.957  -4.870
   54    H    LEU   9           HN       LEU   9  -9.872   4.910  -3.589
   55    HA   LEU   9           HA       LEU   9 -10.547   7.207  -5.069
   56    HB2  LEU   9           2HB      LEU   9  -9.874   6.950  -2.136
   57    HB3  LEU   9           1HB      LEU   9 -10.594   8.363  -2.878
   58    HG   LEU   9           HG       LEU   9 -11.869   5.634  -2.667
   59   HD11  LEU   9          1HD1      LEU   9 -13.423   6.743  -1.143
   60   HD12  LEU   9          2HD1      LEU   9 -12.516   8.247  -1.303
   61   HD13  LEU   9          3HD1      LEU   9 -11.767   6.844  -0.545
   62   HD21  LEU   9          3HD2      LEU   9 -13.855   6.719  -3.598
   63   HD22  LEU   9          1HD2      LEU   9 -12.505   6.763  -4.732
   64   HD23  LEU   9          2HD2      LEU   9 -12.938   8.208  -3.819
   65    H    TYR  10           HN       TYR  10  -7.591   6.267  -3.378
   66    HA   TYR  10           HA       TYR  10  -6.190   8.668  -3.610
   67    HB2  TYR  10           2HB      TYR  10  -5.405   6.676  -2.332
   68    HB3  TYR  10           1HB      TYR  10  -5.040   5.879  -3.859
   69    HD1  TYR  10           2HD      TYR  10  -4.158   8.784  -1.742
   70    HD2  TYR  10           1HD      TYR  10  -2.989   6.297  -4.989
   71    HE1  TYR  10           2HE      TYR  10  -1.940   9.843  -1.747
   72    HE2  TYR  10           1HE      TYR  10  -0.763   7.349  -5.001
   73    HH   TYR  10           HH       TYR  10   0.223   9.588  -4.261
   74    H    ILE  11           HN       ILE  11  -6.500   5.978  -5.866
   75    HA   ILE  11           HA       ILE  11  -4.858   7.105  -7.895
   76    HB   ILE  11           HB       ILE  11  -7.020   5.001  -8.130
   77   HG12  ILE  11          2HG1      ILE  11  -4.028   4.681  -7.812
   78   HG13  ILE  11          1HG1      ILE  11  -5.194   4.467  -6.513
   79   HG21  ILE  11          1HG2      ILE  11  -5.915   4.347 -10.186
   80   HG22  ILE  11          2HG2      ILE  11  -4.721   5.628  -9.979
   81   HG23  ILE  11          3HG2      ILE  11  -6.414   6.035 -10.277
   82   HD11  ILE  11          3HD1      ILE  11  -4.475   2.340  -7.433
   83   HD12  ILE  11          1HD1      ILE  11  -5.040   2.826  -9.032
   84   HD13  ILE  11          2HD1      ILE  11  -6.195   2.602  -7.716
   85    H    LYS  12           HN       LYS  12  -8.380   6.924  -7.431
   86    HA   LYS  12           HA       LYS  12  -9.179   8.213  -9.768
   87    HB2  LYS  12           2HB      LYS  12 -10.444   8.108  -7.036
   88    HB3  LYS  12           1HB      LYS  12 -11.226   8.867  -8.415
   89    HG2  LYS  12           2HG      LYS  12 -11.284   6.769  -9.592
   90    HG3  LYS  12           1HG      LYS  12 -10.365   5.983  -8.304
   91    HD2  LYS  12           2HD      LYS  12 -12.158   6.311  -6.742
   92    HD3  LYS  12           1HD      LYS  12 -13.048   7.298  -7.902
   93    HE2  LYS  12           2HE      LYS  12 -13.322   5.363  -9.353
   94    HE3  LYS  12           1HE      LYS  12 -12.386   4.373  -8.232
   95    HZ1  LYS  12           3HZ      LYS  12 -14.799   5.786  -7.304
   96    HZ2  LYS  12           1HZ      LYS  12 -14.073   4.390  -6.671
   97    HZ3  LYS  12           2HZ      LYS  12 -14.951   4.310  -8.124
   98    H    ALA  13           HN       ALA  13  -8.397   9.610  -6.593
   99    HA   ALA  13           HA       ALA  13  -9.129  12.264  -7.321
  100    HB1  ALA  13           1HB      ALA  13  -9.115  11.497  -5.001
  101    HB2  ALA  13           2HB      ALA  13  -8.102  12.926  -5.215
  102    HB3  ALA  13           3HB      ALA  13  -7.361  11.332  -5.063
  103    H    HIS  14           HN       HIS  14  -6.564  10.444  -8.362
  104    HA   HIS  14           HA       HIS  14  -5.029  12.882  -8.959
  105    HB2  HIS  14           2HB      HIS  14  -3.902  10.192  -8.152
  106    HB3  HIS  14           1HB      HIS  14  -2.940  11.500  -8.834
  107    HD1  HIS  14           1HD      HIS  14  -4.429  10.278  -5.697
  108    HD2  HIS  14           2HD      HIS  14  -2.674  13.775  -7.106
  109    HE1  HIS  14           1HE      HIS  14  -3.852  11.622  -3.650
  110    HE2  HIS  14           2HE      HIS  14  -2.664  13.672  -4.514
  111    H    ARG  15           HN       ARG  15  -6.945  10.711 -10.338
  112    HA   ARG  15           HA       ARG  15  -5.254   9.600 -12.357
  113    HB2  ARG  15           2HB      ARG  15  -7.259   8.743 -13.367
  114    HB3  ARG  15           1HB      ARG  15  -7.357   8.527 -11.630
  115    HG2  ARG  15           2HG      ARG  15  -8.875  10.396 -11.446
  116    HG3  ARG  15           1HG      ARG  15  -8.718  10.720 -13.175
  117    HD2  ARG  15           2HD      ARG  15  -9.683   8.548 -13.688
  118    HD3  ARG  15           1HD      ARG  15  -9.793   8.172 -11.969
  119    HE   ARG  15           HE       ARG  15 -11.351  10.175 -11.885
  120   HH11  ARG  15          1HH1      ARG  15 -10.988   8.151 -14.723
  121   HH12  ARG  15          2HH1      ARG  15 -12.601   8.437 -15.293
  122   HH21  ARG  15          1HH2      ARG  15 -13.468  10.580 -12.645
  123   HH22  ARG  15          2HH2      ARG  15 -14.000   9.863 -14.141
  124    H    SER  16           HN       SER  16  -6.789  12.614 -11.980
  125    HA   SER  16           HA       SER  16  -6.533  13.285 -14.800
  126    HB2  SER  16           2HB      SER  16  -8.442  14.208 -13.521
  127    HB3  SER  16           1HB      SER  16  -7.315  15.031 -12.444
  128    HG   SER  16           HG       SER  16  -6.521  15.899 -14.650
  129    H    SER  17           HN       SER  17  -4.881  13.741 -11.764
  130    HA   SER  17           HA       SER  17  -2.883  15.521 -12.756
  131    HB2  SER  17           2HB      SER  17  -2.532  13.611 -10.451
  132    HB3  SER  17           1HB      SER  17  -1.856  15.223 -10.654
  133    HG   SER  17           HG       SER  17  -4.265  15.823 -10.650
  134    H    TRP  18           HN       TRP  18  -3.589  12.257 -13.058
  135    HA   TRP  18           HA       TRP  18  -0.901  11.565 -13.992
  136    HB2  TRP  18           2HB      TRP  18  -3.117   9.752 -13.013
  137    HB3  TRP  18           1HB      TRP  18  -1.614   9.194 -13.718
  138    HD1  TRP  18           1HD      TRP  18  -0.352  11.772 -11.601
  139    HE1  TRP  18           1HE      TRP  18   0.249  10.859  -9.255
  140    HE3  TRP  18           3HE      TRP  18  -2.907   7.381 -11.802
  141    HZ2  TRP  18           2HZ      TRP  18  -0.310   8.534  -7.706
  142    HZ3  TRP  18           3HZ      TRP  18  -2.829   5.844  -9.888
  143    HH2  TRP  18           2HH      TRP  18  -1.559   6.418  -7.869
  144    H    LYS  19           HN       LYS  19  -1.868  12.752 -16.003
  145    HA   LYS  19           HA       LYS  19  -3.392  11.169 -17.758
  146    HB2  LYS  19           2HB      LYS  19  -1.005  12.917 -18.424
  147    HB3  LYS  19           1HB      LYS  19  -2.182  12.310 -19.586
  148    HG2  LYS  19           2HG      LYS  19  -3.945  13.562 -18.472
  149    HG3  LYS  19           1HG      LYS  19  -2.783  14.159 -17.288
  150    HD2  LYS  19           2HD      LYS  19  -1.572  15.322 -19.041
  151    HD3  LYS  19           1HD      LYS  19  -2.672  14.670 -20.259
  152    HE2  LYS  19           2HE      LYS  19  -3.422  16.498 -17.981
  153    HE3  LYS  19           1HE      LYS  19  -3.271  16.961 -19.676
  154    HZ1  LYS  19           3HZ      LYS  19  -5.063  15.406 -20.204
  155    HZ2  LYS  19           1HZ      LYS  19  -5.576  16.586 -19.101
  156    HZ3  LYS  19           2HZ      LYS  19  -5.231  15.018 -18.563
  157    H    ASN  20           HN       ASN  20  -1.533   8.570 -16.866
  158    HA   ASN  20           HA       ASN  20  -3.702   7.915 -17.105
  159    HB2  ASN  20           2HB      ASN  20  -4.639  10.172 -17.283
  160    HB3  ASN  20           1HB      ASN  20  -4.074  10.296 -18.944
  161   HD21  ASN  20          1HD2      ASN  20  -6.110  10.647 -19.755
  162   HD22  ASN  20          2HD2      ASN  20  -7.309   9.401 -19.843
  163    H    THR  21           HN       THR  21  -2.831   6.284 -17.829
  164    HA   THR  21           HA       THR  21  -2.996   5.377 -20.511
  165    HB   THR  21           HB       THR  21  -0.492   4.686 -20.443
  166    HG1  THR  21           1HG      THR  21   0.486   6.826 -19.312
  167   HG21  THR  21          3HG2      THR  21  -1.317   6.222 -22.127
  168   HG22  THR  21          1HG2      THR  21   0.256   6.768 -21.541
  169   HG23  THR  21          2HG2      THR  21  -1.217   7.565 -20.990
  170    H    LYS  22           HN       LYS  22  -1.271   3.138 -20.061
  171    HA   LYS  22           HA       LYS  22  -2.739   1.589 -18.232
  172    HB2  LYS  22           2HB      LYS  22  -0.898  -0.069 -18.532
  173    HB3  LYS  22           1HB      LYS  22  -1.619   0.533 -20.015
  174    HG2  LYS  22           2HG      LYS  22   0.275   2.113 -20.243
  175    HG3  LYS  22           1HG      LYS  22   1.015   1.344 -18.838
  176    HD2  LYS  22           2HD      LYS  22   1.200  -0.740 -19.978
  177    HD3  LYS  22           1HD      LYS  22   0.209  -0.163 -21.318
  178    HE2  LYS  22           2HE      LYS  22   1.974   1.536 -21.796
  179    HE3  LYS  22           1HE      LYS  22   2.979   0.763 -20.570
  180    HZ1  LYS  22           3HZ      LYS  22   1.898  -0.586 -22.985
  181    HZ2  LYS  22           1HZ      LYS  22   2.940  -1.272 -21.834
  182    HZ3  LYS  22           2HZ      LYS  22   3.487  -0.009 -22.828
  183    H    HIS  23           HN       HIS  23  -0.565   3.975 -17.527
  184    HA   HIS  23           HA       HIS  23   0.852   3.096 -15.285
  185    HB2  HIS  23           2HB      HIS  23  -0.056   5.690 -16.324
  186    HB3  HIS  23           1HB      HIS  23   0.136   5.654 -14.576
  187    HD1  HIS  23           1HD      HIS  23   2.363   6.445 -13.891
  188    HD2  HIS  23           2HD      HIS  23   2.486   4.453 -17.546
  189    HE1  HIS  23           1HE      HIS  23   4.766   6.524 -14.631
  190    HE2  HIS  23           2HE      HIS  23   4.800   5.422 -16.899
  191    H    ALA  24           HN       ALA  24  -2.487   4.341 -15.424
  192    HA   ALA  24           HA       ALA  24  -2.917   4.218 -12.610
  193    HB1  ALA  24           1HB      ALA  24  -4.298   5.606 -14.059
  194    HB2  ALA  24           2HB      ALA  24  -5.297   4.447 -13.182
  195    HB3  ALA  24           3HB      ALA  24  -4.914   4.172 -14.881
  196    H    ASP  25           HN       ASP  25  -3.377   1.977 -15.275
  197    HA   ASP  25           HA       ASP  25  -4.738  -0.062 -13.887
  198    HB2  ASP  25           2HB      ASP  25  -4.392   0.179 -16.417
  199    HB3  ASP  25           1HB      ASP  25  -2.794  -0.509 -16.155
  200    H    GLN  26           HN       GLN  26  -1.297   0.553 -14.458
  201    HA   GLN  26           HA       GLN  26  -0.210  -1.695 -13.237
  202    HB2  GLN  26           2HB      GLN  26   0.790   1.129 -13.557
  203    HB3  GLN  26           1HB      GLN  26   1.772  -0.131 -12.839
  204    HG2  GLN  26           2HG      GLN  26   1.727  -1.412 -14.860
  205    HG3  GLN  26           1HG      GLN  26   0.577  -0.291 -15.588
  206   HE21  GLN  26          1HE2      GLN  26   1.961   0.119 -17.314
  207   HE22  GLN  26          2HE2      GLN  26   3.386   1.091 -17.148
  208    H    TRP  27           HN       TRP  27  -1.113   1.428 -11.850
  209    HA   TRP  27           HA       TRP  27  -0.316   0.872  -9.196
  210    HB2  TRP  27           2HB      TRP  27  -2.054   2.873 -10.544
  211    HB3  TRP  27           1HB      TRP  27  -2.275   2.659  -8.812
  212    HD1  TRP  27           1HD      TRP  27   0.445   3.722 -11.355
  213    HE1  TRP  27           1HE      TRP  27   2.147   5.204 -10.101
  214    HE3  TRP  27           3HE      TRP  27  -1.376   3.222  -6.601
  215    HZ2  TRP  27           2HZ      TRP  27   2.649   6.037  -7.438
  216    HZ3  TRP  27           3HZ      TRP  27  -0.235   4.385  -4.765
  217    HH2  TRP  27           2HH      TRP  27   1.733   5.763  -5.170
  218    H    THR  28           HN       THR  28  -3.439   0.564 -10.848
  219    HA   THR  28           HA       THR  28  -4.865  -0.236  -8.533
  220    HB   THR  28           HB       THR  28  -5.637  -0.752 -11.415
  221    HG1  THR  28           1HG      THR  28  -5.239   1.481 -11.087
  222   HG21  THR  28          3HG2      THR  28  -6.989  -1.969  -9.777
  223   HG22  THR  28          1HG2      THR  28  -7.928  -0.685 -10.536
  224   HG23  THR  28          2HG2      THR  28  -7.296  -0.466  -8.905
  225    H    ASN  29           HN       ASN  29  -3.494  -2.048 -11.261
  226    HA   ASN  29           HA       ASN  29  -4.707  -4.504 -10.743
  227    HB2  ASN  29           2HB      ASN  29  -3.256  -3.606 -12.768
  228    HB3  ASN  29           1HB      ASN  29  -1.962  -4.437 -11.910
  229   HD21  ASN  29          1HD2      ASN  29  -4.733  -4.758 -13.871
  230   HD22  ASN  29          2HD2      ASN  29  -4.712  -6.489 -14.018
  231    H    THR  30           HN       THR  30  -1.545  -3.286  -9.695
  232    HA   THR  30           HA       THR  30  -0.669  -5.704  -8.555
  233    HB   THR  30           HB       THR  30   0.931  -4.187  -7.263
  234    HG1  THR  30           1HG      THR  30   0.164  -2.129  -9.027
  235   HG21  THR  30          3HG2      THR  30   2.242  -3.676  -9.257
  236   HG22  THR  30          1HG2      THR  30   0.819  -3.910 -10.272
  237   HG23  THR  30          2HG2      THR  30   1.510  -5.274  -9.393
  238    H    ILE  31           HN       ILE  31  -2.038  -2.804  -6.995
  239    HA   ILE  31           HA       ILE  31  -2.017  -3.898  -4.388
  240    HB   ILE  31           HB       ILE  31  -3.737  -1.666  -5.480
  241   HG12  ILE  31          2HG1      ILE  31  -1.072  -1.544  -4.044
  242   HG13  ILE  31          1HG1      ILE  31  -1.300  -1.306  -5.778
  243   HG21  ILE  31          1HG2      ILE  31  -2.995  -2.331  -2.633
  244   HG22  ILE  31          2HG2      ILE  31  -4.585  -2.546  -3.366
  245   HG23  ILE  31          3HG2      ILE  31  -3.921  -0.926  -3.160
  246   HD11  ILE  31          3HD1      ILE  31  -1.052   0.806  -4.585
  247   HD12  ILE  31          1HD1      ILE  31  -2.460   0.422  -3.596
  248   HD13  ILE  31          2HD1      ILE  31  -2.643   0.674  -5.332
  249    H    LYS  32           HN       LYS  32  -4.468  -3.777  -6.906
  250    HA   LYS  32           HA       LYS  32  -6.660  -4.696  -5.425
  251    HB2  LYS  32           2HB      LYS  32  -6.330  -3.831  -7.945
  252    HB3  LYS  32           1HB      LYS  32  -6.375  -5.557  -8.263
  253    HG2  LYS  32           2HG      LYS  32  -8.518  -4.035  -6.798
  254    HG3  LYS  32           1HG      LYS  32  -8.555  -4.420  -8.517
  255    HD2  LYS  32           2HD      LYS  32  -8.432  -6.823  -7.928
  256    HD3  LYS  32           1HD      LYS  32  -8.532  -6.374  -6.222
  257    HE2  LYS  32           2HE      LYS  32 -10.685  -5.231  -6.720
  258    HE3  LYS  32           1HE      LYS  32 -10.593  -5.869  -8.361
  259    HZ1  LYS  32           3HZ      LYS  32 -10.733  -7.469  -5.864
  260    HZ2  LYS  32           1HZ      LYS  32 -10.581  -8.114  -7.427
  261    HZ3  LYS  32           2HZ      LYS  32 -11.982  -7.261  -6.991
  262    H    THR  33           HN       THR  33  -4.034  -6.409  -7.017
  263    HA   THR  33           HA       THR  33  -5.317  -8.982  -6.749
  264    HB   THR  33           HB       THR  33  -2.486  -8.371  -7.610
  265    HG1  THR  33           1HG      THR  33  -3.733  -7.365  -9.103
  266   HG21  THR  33          3HG2      THR  33  -2.859 -10.715  -6.999
  267   HG22  THR  33          1HG2      THR  33  -2.628 -10.546  -8.740
  268   HG23  THR  33          2HG2      THR  33  -4.248 -10.782  -8.085
  269    H    TYR  34           HN       TYR  34  -2.445  -7.406  -5.329
  270    HA   TYR  34           HA       TYR  34  -1.900  -9.720  -3.706
  271    HB2  TYR  34           2HB      TYR  34  -0.597  -7.004  -3.870
  272    HB3  TYR  34           1HB      TYR  34  -0.065  -8.264  -2.757
  273    HD1  TYR  34           2HD      TYR  34   0.901 -10.367  -3.644
  274    HD2  TYR  34           1HD      TYR  34  -0.082  -7.119  -6.206
  275    HE1  TYR  34           2HE      TYR  34   2.280 -11.360  -5.421
  276    HE2  TYR  34           1HE      TYR  34   1.290  -8.104  -7.993
  277    HH   TYR  34           HH       TYR  34   2.516 -11.308  -7.818
  278    H    CYS  35           HN       CYS  35  -3.058  -6.416  -3.040
  279    HA   CYS  35           HA       CYS  35  -3.215  -7.041  -0.205
  280    HB2  CYS  35           2HB      CYS  35  -3.941  -4.501  -1.672
  281    HB3  CYS  35           1HB      CYS  35  -3.803  -4.688   0.073
  282    HG   CYS  35           HG       CYS  35  -0.982  -5.538  -0.373
  283    H    GLY  36           HN       GLY  36  -5.317  -6.782  -2.936
  284    HA2  GLY  36           2HA      GLY  36  -7.744  -6.081  -1.857
  285    HA3  GLY  36           1HA      GLY  36  -7.554  -7.166  -3.219
  286    HA   PRO  37           HA       PRO  37  -9.097 -10.680  -1.159
  287    HB2  PRO  37           2HB      PRO  37  -6.465 -12.051  -1.026
  288    HB3  PRO  37           1HB      PRO  37  -7.980 -12.588  -1.758
  289    HG2  PRO  37           2HG      PRO  37  -5.967 -11.753  -3.279
  290    HG3  PRO  37           1HG      PRO  37  -7.643 -11.342  -3.686
  291    HD2  PRO  37           2HD      PRO  37  -5.527  -9.647  -2.418
  292    HD3  PRO  37           1HD      PRO  37  -6.747  -9.210  -3.632
  293    H    VAL  38           HN       VAL  38  -6.315  -9.248   0.371
  294    HA   VAL  38           HA       VAL  38  -6.833 -10.774   2.824
  295    HB   VAL  38           HB       VAL  38  -4.490  -8.946   2.292
  296   HG11  VAL  38          1HG1      VAL  38  -3.462 -10.178   4.162
  297   HG12  VAL  38          2HG1      VAL  38  -4.970 -11.062   4.389
  298   HG13  VAL  38          3HG1      VAL  38  -4.923  -9.318   4.651
  299   HG21  VAL  38          3HG2      VAL  38  -4.651 -11.942   1.986
  300   HG22  VAL  38          1HG2      VAL  38  -3.188 -10.970   1.845
  301   HG23  VAL  38          2HG2      VAL  38  -4.495 -10.775   0.673
  302    H    ILE  39           HN       ILE  39  -5.618  -7.452   2.384
  303    HA   ILE  39           HA       ILE  39  -7.278  -6.672   4.668
  304    HB   ILE  39           HB       ILE  39  -5.871  -4.632   4.744
  305   HG12  ILE  39          2HG1      ILE  39  -4.288  -6.011   2.561
  306   HG13  ILE  39          1HG1      ILE  39  -5.260  -4.553   2.356
  307   HG21  ILE  39          1HG2      ILE  39  -5.320  -6.560   6.111
  308   HG22  ILE  39          2HG2      ILE  39  -3.849  -5.754   5.567
  309   HG23  ILE  39          3HG2      ILE  39  -4.374  -7.249   4.793
  310   HD11  ILE  39          3HD1      ILE  39  -2.881  -4.053   2.536
  311   HD12  ILE  39          1HD1      ILE  39  -2.834  -4.811   4.127
  312   HD13  ILE  39          2HD1      ILE  39  -3.791  -3.350   3.872
  313    H    GLY  40           HN       GLY  40  -7.732  -6.770   1.507
  314    HA2  GLY  40           2HA      GLY  40  -8.390  -4.232   0.597
  315    HA3  GLY  40           1HA      GLY  40  -9.134  -5.719   0.039
  316    HA   PRO  41           HA       PRO  41 -12.936  -4.654   1.962
  317    HB2  PRO  41           2HB      PRO  41 -13.280  -7.108   3.482
  318    HB3  PRO  41           1HB      PRO  41 -14.096  -6.591   2.007
  319    HG2  PRO  41           2HG      PRO  41 -12.331  -8.649   2.074
  320    HG3  PRO  41           1HG      PRO  41 -12.570  -7.628   0.646
  321    HD2  PRO  41           2HD      PRO  41 -10.396  -7.522   2.704
  322    HD3  PRO  41           1HD      PRO  41 -10.286  -7.350   0.939
  323    H    LEU  42           HN       LEU  42 -10.312  -4.863   3.896
  324    HA   LEU  42           HA       LEU  42 -11.702  -4.571   6.434
  325    HB2  LEU  42           2HB      LEU  42  -8.767  -4.469   5.739
  326    HB3  LEU  42           1HB      LEU  42  -9.406  -4.299   7.362
  327    HG   LEU  42           HG       LEU  42  -9.634  -6.754   5.620
  328   HD11  LEU  42          1HD1      LEU  42  -7.390  -6.416   6.493
  329   HD12  LEU  42          2HD1      LEU  42  -8.177  -7.779   7.290
  330   HD13  LEU  42          3HD1      LEU  42  -8.041  -6.230   8.122
  331   HD21  LEU  42          3HD2      LEU  42 -11.604  -6.489   7.025
  332   HD22  LEU  42          1HD2      LEU  42 -10.575  -6.269   8.443
  333   HD23  LEU  42          2HD2      LEU  42 -10.597  -7.817   7.600
  334    H    SER  43           HN       SER  43 -11.209  -2.683   7.810
  335    HA   SER  43           HA       SER  43 -11.806  -0.293   6.379
  336    HB2  SER  43           2HB      SER  43 -12.672  -0.753   8.652
  337    HB3  SER  43           1HB      SER  43 -11.033  -0.646   9.284
  338    HG   SER  43           HG       SER  43 -12.728   1.307   8.991
  339    H    VAL  44           HN       VAL  44 -10.529   1.400   5.838
  340    HA   VAL  44           HA       VAL  44  -7.709   1.106   5.753
  341    HB   VAL  44           HB       VAL  44  -8.999   2.491   4.143
  342   HG11  VAL  44          1HG1      VAL  44  -9.683   4.762   4.781
  343   HG12  VAL  44          2HG1      VAL  44  -9.286   4.398   6.460
  344   HG13  VAL  44          3HG1      VAL  44 -10.587   3.524   5.654
  345   HG21  VAL  44          3HG2      VAL  44  -6.600   2.809   4.350
  346   HG22  VAL  44          1HG2      VAL  44  -6.843   3.966   5.659
  347   HG23  VAL  44          2HG2      VAL  44  -7.391   4.352   4.026
  348    H    GLN  45           HN       GLN  45  -9.908   2.266   8.119
  349    HA   GLN  45           HA       GLN  45  -8.038   3.847   9.608
  350    HB2  GLN  45           2HB      GLN  45 -10.619   3.978   9.617
  351    HB3  GLN  45           1HB      GLN  45 -10.557   2.599  10.702
  352    HG2  GLN  45           2HG      GLN  45  -9.108   5.164  11.285
  353    HG3  GLN  45           1HG      GLN  45 -10.787   4.899  11.744
  354   HE21  GLN  45          1HE2      GLN  45  -8.416   5.352  13.389
  355   HE22  GLN  45          2HE2      GLN  45  -8.309   3.999  14.462
  356    H    ASP  46           HN       ASP  46  -9.147   0.505   9.612
  357    HA   ASP  46           HA       ASP  46  -7.772  -0.122  12.071
  358    HB2  ASP  46           2HB      ASP  46  -9.453  -1.669  10.146
  359    HB3  ASP  46           1HB      ASP  46  -8.421  -2.537  11.275
  360    H    VAL  47           HN       VAL  47  -6.754   0.199   8.895
  361    HA   VAL  47           HA       VAL  47  -5.052  -1.981   8.531
  362    HB   VAL  47           HB       VAL  47  -4.634   0.855   7.565
  363   HG11  VAL  47          1HG1      VAL  47  -3.383  -1.731   6.637
  364   HG12  VAL  47          2HG1      VAL  47  -2.559  -0.420   7.479
  365   HG13  VAL  47          3HG1      VAL  47  -3.195  -0.161   5.854
  366   HG21  VAL  47          3HG2      VAL  47  -5.906  -1.541   6.247
  367   HG22  VAL  47          1HG2      VAL  47  -5.585   0.006   5.461
  368   HG23  VAL  47          2HG2      VAL  47  -6.734  -0.085   6.796
  369    H    ASP  48           HN       ASP  48  -3.714  -2.653  10.034
  370    HA   ASP  48           HA       ASP  48  -1.857  -0.727  11.266
  371    HB2  ASP  48           2HB      ASP  48  -3.268  -1.654  12.971
  372    HB3  ASP  48           1HB      ASP  48  -3.037  -3.284  12.360
  373    H    THR  49           HN       THR  49   0.214  -1.823  11.964
  374    HA   THR  49           HA       THR  49   1.599  -2.645   9.683
  375    HB   THR  49           HB       THR  49   2.596  -3.311  12.429
  376    HG1  THR  49           1HG      THR  49   2.609  -1.267  13.002
  377   HG21  THR  49          3HG2      THR  49   4.714  -2.512  11.501
  378   HG22  THR  49          1HG2      THR  49   3.902  -2.088   9.993
  379   HG23  THR  49          2HG2      THR  49   4.022  -3.778  10.486
  380    H    LYS  50           HN       LYS  50   0.197  -4.528  12.339
  381    HA   LYS  50           HA       LYS  50   1.437  -6.989  11.763
  382    HB2  LYS  50           2HB      LYS  50   0.181  -6.314  13.856
  383    HB3  LYS  50           1HB      LYS  50  -1.302  -6.594  12.963
  384    HG2  LYS  50           2HG      LYS  50  -0.801  -8.503  14.318
  385    HG3  LYS  50           1HG      LYS  50  -0.632  -8.929  12.615
  386    HD2  LYS  50           2HD      LYS  50   1.809  -8.623  12.810
  387    HD3  LYS  50           1HD      LYS  50   1.611  -8.271  14.528
  388    HE2  LYS  50           2HE      LYS  50   0.666 -10.500  14.879
  389    HE3  LYS  50           1HE      LYS  50   0.845 -10.852  13.160
  390    HZ1  LYS  50           3HZ      LYS  50   2.661 -11.817  14.378
  391    HZ2  LYS  50           1HZ      LYS  50   3.042 -10.328  15.096
  392    HZ3  LYS  50           2HZ      LYS  50   3.261 -10.550  13.430
  393    H    LEU  51           HN       LEU  51  -1.555  -5.507  10.641
  394    HA   LEU  51           HA       LEU  51  -2.523  -7.707   9.160
  395    HB2  LEU  51           2HB      LEU  51  -3.003  -4.748   8.812
  396    HB3  LEU  51           1HB      LEU  51  -3.900  -6.004   7.993
  397    HG   LEU  51           HG       LEU  51  -3.848  -5.515  10.960
  398   HD11  LEU  51          1HD1      LEU  51  -6.197  -4.922  10.648
  399   HD12  LEU  51          2HD1      LEU  51  -6.013  -5.136   8.907
  400   HD13  LEU  51          3HD1      LEU  51  -5.125  -3.859   9.737
  401   HD21  LEU  51          3HD2      LEU  51  -5.380  -7.569   9.365
  402   HD22  LEU  51          1HD2      LEU  51  -5.562  -7.256  11.093
  403   HD23  LEU  51          2HD2      LEU  51  -4.044  -7.900  10.466
  404    H    ILE  52           HN       ILE  52  -0.409  -5.006   8.356
  405    HA   ILE  52           HA       ILE  52  -0.181  -5.538   5.590
  406    HB   ILE  52           HB       ILE  52   1.836  -4.218   7.417
  407   HG12  ILE  52          2HG1      ILE  52  -0.352  -2.997   5.723
  408   HG13  ILE  52          1HG1      ILE  52  -0.392  -3.151   7.475
  409   HG21  ILE  52          1HG2      ILE  52   2.823  -4.893   5.298
  410   HG22  ILE  52          2HG2      ILE  52   2.655  -3.138   5.370
  411   HG23  ILE  52          3HG2      ILE  52   1.518  -4.093   4.421
  412   HD11  ILE  52          3HD1      ILE  52   0.202  -0.901   6.834
  413   HD12  ILE  52          1HD1      ILE  52   1.558  -1.505   5.881
  414   HD13  ILE  52          2HD1      ILE  52   1.564  -1.685   7.635
  415    H    MET  53           HN       MET  53   1.609  -6.644   8.422
  416    HA   MET  53           HA       MET  53   3.660  -8.044   7.131
  417    HB2  MET  53           2HB      MET  53   2.301  -8.629   9.766
  418    HB3  MET  53           1HB      MET  53   3.785  -9.397   9.225
  419    HG2  MET  53           2HG      MET  53   4.909  -7.239   9.195
  420    HG3  MET  53           1HG      MET  53   3.417  -6.450   9.702
  421    HE1  MET  53           3HE      MET  53   4.612  -5.286  11.767
  422    HE2  MET  53           1HE      MET  53   6.136  -5.999  11.230
  423    HE3  MET  53           2HE      MET  53   5.631  -6.158  12.911
  424    H    LYS  54           HN       LYS  54   0.361  -8.986   7.907
  425    HA   LYS  54           HA       LYS  54   0.548 -11.715   7.280
  426    HB2  LYS  54           2HB      LYS  54  -1.824  -9.850   7.044
  427    HB3  LYS  54           1HB      LYS  54  -1.913 -11.603   6.952
  428    HG2  LYS  54           2HG      LYS  54  -1.004 -11.723   9.255
  429    HG3  LYS  54           1HG      LYS  54  -1.072  -9.961   9.330
  430    HD2  LYS  54           2HD      LYS  54  -3.027 -10.921  10.399
  431    HD3  LYS  54           1HD      LYS  54  -3.505 -10.060   8.932
  432    HE2  LYS  54           2HE      LYS  54  -3.610 -12.176   7.719
  433    HE3  LYS  54           1HE      LYS  54  -3.094 -13.041   9.167
  434    HZ1  LYS  54           3HZ      LYS  54  -5.616 -11.494   8.860
  435    HZ2  LYS  54           1HZ      LYS  54  -5.113 -12.283  10.277
  436    HZ3  LYS  54           2HZ      LYS  54  -5.471 -13.184   8.890
  437    H    VAL  55           HN       VAL  55  -0.035  -8.888   5.281
  438    HA   VAL  55           HA       VAL  55  -0.648 -10.367   2.907
  439    HB   VAL  55           HB       VAL  55   0.242  -7.484   3.107
  440   HG11  VAL  55          1HG1      VAL  55  -1.361  -8.920   0.996
  441   HG12  VAL  55          2HG1      VAL  55   0.319  -8.405   0.847
  442   HG13  VAL  55          3HG1      VAL  55  -0.963  -7.203   1.003
  443   HG21  VAL  55          3HG2      VAL  55  -2.123  -6.896   3.178
  444   HG22  VAL  55          1HG2      VAL  55  -1.671  -7.880   4.571
  445   HG23  VAL  55          2HG2      VAL  55  -2.554  -8.606   3.226
  446    H    LEU  56           HN       LEU  56   2.228  -8.786   4.211
  447    HA   LEU  56           HA       LEU  56   3.712  -9.058   1.777
  448    HB2  LEU  56           2HB      LEU  56   4.542  -8.248   4.554
  449    HB3  LEU  56           1HB      LEU  56   5.623  -8.243   3.175
  450    HG   LEU  56           HG       LEU  56   3.145  -6.545   3.496
  451   HD11  LEU  56          1HD1      LEU  56   4.723  -4.687   3.588
  452   HD12  LEU  56          2HD1      LEU  56   6.073  -5.816   3.482
  453   HD13  LEU  56          3HD1      LEU  56   5.018  -5.835   4.895
  454   HD21  LEU  56          3HD2      LEU  56   3.507  -7.215   1.164
  455   HD22  LEU  56          1HD2      LEU  56   5.163  -6.618   1.252
  456   HD23  LEU  56          2HD2      LEU  56   3.812  -5.494   1.404
  457    H    ASP  57           HN       ASP  57   3.256 -11.041   4.570
  458    HA   ASP  57           HA       ASP  57   5.623 -12.376   4.891
  459    HB2  ASP  57           2HB      ASP  57   3.374 -12.690   6.121
  460    HB3  ASP  57           1HB      ASP  57   3.036 -13.905   4.905
  461    HA   PRO  58           HA       PRO  58   4.752 -15.514   1.390
  462    HB2  PRO  58           2HB      PRO  58   2.646 -15.226  -0.255
  463    HB3  PRO  58           1HB      PRO  58   2.504 -16.033   1.311
  464    HG2  PRO  58           2HG      PRO  58   1.778 -13.229   0.555
  465    HG3  PRO  58           1HG      PRO  58   0.869 -14.392   1.538
  466    HD2  PRO  58           2HD      PRO  58   2.389 -12.395   2.607
  467    HD3  PRO  58           1HD      PRO  58   2.096 -13.941   3.423
  468    H    ILE  59           HN       ILE  59   4.290 -12.117   0.839
  469    HA   ILE  59           HA       ILE  59   4.864 -12.204  -1.975
  470    HB   ILE  59           HB       ILE  59   4.790  -9.827  -0.111
  471   HG12  ILE  59          2HG1      ILE  59   2.708 -10.948  -2.004
  472   HG13  ILE  59          1HG1      ILE  59   2.632 -10.987  -0.245
  473   HG21  ILE  59          1HG2      ILE  59   4.566  -8.500  -2.172
  474   HG22  ILE  59          2HG2      ILE  59   4.797  -9.966  -3.128
  475   HG23  ILE  59          3HG2      ILE  59   6.102  -9.364  -2.106
  476   HD11  ILE  59          3HD1      ILE  59   1.208  -9.248  -1.149
  477   HD12  ILE  59          1HD1      ILE  59   2.589  -8.516  -1.966
  478   HD13  ILE  59          2HD1      ILE  59   2.519  -8.547  -0.203
  479    H    TRP  60           HN       TRP  60   6.677 -11.398   0.967
  480    HA   TRP  60           HA       TRP  60   9.042 -10.504  -0.238
  481    HB2  TRP  60           2HB      TRP  60   8.545 -11.913   2.381
  482    HB3  TRP  60           1HB      TRP  60  10.154 -11.403   1.888
  483    HD1  TRP  60           1HD      TRP  60   7.412 -10.242   3.921
  484    HE1  TRP  60           1HE      TRP  60   7.506  -7.696   4.291
  485    HE3  TRP  60           3HE      TRP  60  10.753  -9.020   0.254
  486    HZ2  TRP  60           2HZ      TRP  60   8.821  -5.462   3.169
  487    HZ3  TRP  60           3HZ      TRP  60  11.375  -6.655  -0.033
  488    HH2  TRP  60           2HH      TRP  60  10.428  -4.917   1.393
  489    H    GLU  61           HN       GLU  61   7.771 -13.694   0.166
  490    HA   GLU  61           HA       GLU  61  10.222 -15.082  -0.260
  491    HB2  GLU  61           2HB      GLU  61   7.327 -15.919  -0.230
  492    HB3  GLU  61           1HB      GLU  61   8.666 -17.030  -0.382
  493    HG2  GLU  61           2HG      GLU  61   8.285 -15.163   1.934
  494    HG3  GLU  61           1HG      GLU  61   7.742 -16.839   1.915
  495    H    GLN  62           HN       GLN  62   7.660 -13.828  -2.222
  496    HA   GLN  62           HA       GLN  62   8.468 -15.406  -4.532
  497    HB2  GLN  62           2HB      GLN  62   6.207 -13.428  -4.203
  498    HB3  GLN  62           1HB      GLN  62   6.495 -14.430  -5.616
  499    HG2  GLN  62           2HG      GLN  62   6.183 -16.437  -4.198
  500    HG3  GLN  62           1HG      GLN  62   5.765 -15.370  -2.856
  501   HE21  GLN  62          1HE2      GLN  62   3.678 -16.175  -2.674
  502   HE22  GLN  62          2HE2      GLN  62   2.453 -15.847  -3.848
  503    H    LYS  63           HN       LYS  63   7.831 -11.952  -3.837
  504    HA   LYS  63           HA       LYS  63   9.944 -11.235  -5.736
  505    HB2  LYS  63           2HB      LYS  63   7.091 -10.254  -5.937
  506    HB3  LYS  63           1HB      LYS  63   8.439  -9.576  -6.835
  507    HG2  LYS  63           2HG      LYS  63   8.756 -11.652  -8.015
  508    HG3  LYS  63           1HG      LYS  63   7.510 -12.434  -7.039
  509    HD2  LYS  63           2HD      LYS  63   5.841 -10.879  -7.943
  510    HD3  LYS  63           1HD      LYS  63   7.092 -10.112  -8.925
  511    HE2  LYS  63           2HE      LYS  63   6.323 -13.022  -9.112
  512    HE3  LYS  63           1HE      LYS  63   5.686 -11.757 -10.162
  513    HZ1  LYS  63           3HZ      LYS  63   7.883 -11.329 -10.986
  514    HZ2  LYS  63           1HZ      LYS  63   7.558 -12.985 -11.146
  515    HZ3  LYS  63           2HZ      LYS  63   8.568 -12.438  -9.898
  516    HA   PRO  64           HA       PRO  64  10.210  -8.648  -1.911
  517    HB2  PRO  64           2HB      PRO  64  12.991  -8.516  -2.932
  518    HB3  PRO  64           1HB      PRO  64  12.407  -8.841  -1.296
  519    HG2  PRO  64           2HG      PRO  64  13.396 -10.799  -2.815
  520    HG3  PRO  64           1HG      PRO  64  12.016 -11.081  -1.737
  521    HD2  PRO  64           2HD      PRO  64  12.061 -10.701  -4.701
  522    HD3  PRO  64           1HD      PRO  64  11.062 -11.792  -3.720
  523    H    GLU  65           HN       GLU  65  11.379  -8.145  -5.206
  524    HA   GLU  65           HA       GLU  65  11.788  -5.365  -5.056
  525    HB2  GLU  65           2HB      GLU  65  11.530  -7.412  -7.146
  526    HB3  GLU  65           1HB      GLU  65  11.009  -5.817  -7.644
  527    HG2  GLU  65           2HG      GLU  65  13.342  -6.219  -8.207
  528    HG3  GLU  65           1HG      GLU  65  13.171  -4.893  -7.060
  529    H    THR  66           HN       THR  66   8.967  -7.311  -5.938
  530    HA   THR  66           HA       THR  66   7.280  -5.088  -6.522
  531    HB   THR  66           HB       THR  66   6.432  -7.898  -5.779
  532    HG1  THR  66           1HG      THR  66   6.930  -6.879  -8.398
  533   HG21  THR  66          3HG2      THR  66   4.607  -6.273  -5.831
  534   HG22  THR  66          1HG2      THR  66   4.483  -7.392  -7.189
  535   HG23  THR  66          2HG2      THR  66   5.098  -5.759  -7.444
  536    H    ALA  67           HN       ALA  67   7.896  -7.088  -3.696
  537    HA   ALA  67           HA       ALA  67   5.857  -6.090  -2.038
  538    HB1  ALA  67           1HB      ALA  67   8.590  -7.084  -1.230
  539    HB2  ALA  67           2HB      ALA  67   7.168  -8.090  -1.507
  540    HB3  ALA  67           3HB      ALA  67   7.182  -6.932  -0.178
  541    H    SER  68           HN       SER  68   9.159  -4.970  -2.633
  542    HA   SER  68           HA       SER  68   9.134  -2.847  -0.768
  543    HB2  SER  68           2HB      SER  68  10.725  -3.104  -3.334
  544    HB3  SER  68           1HB      SER  68  11.083  -2.002  -2.003
  545    HG   SER  68           HG       SER  68  11.216  -4.831  -2.039
  546    H    ARG  69           HN       ARG  69   8.248  -3.029  -4.198
  547    HA   ARG  69           HA       ARG  69   7.659  -0.279  -4.493
  548    HB2  ARG  69           2HB      ARG  69   6.860  -2.746  -6.018
  549    HB3  ARG  69           1HB      ARG  69   6.291  -1.155  -6.472
  550    HG2  ARG  69           2HG      ARG  69   8.784  -0.508  -6.478
  551    HG3  ARG  69           1HG      ARG  69   9.058  -2.248  -6.538
  552    HD2  ARG  69           2HD      ARG  69   7.709  -2.399  -8.569
  553    HD3  ARG  69           1HD      ARG  69   7.405  -0.663  -8.501
  554    HE   ARG  69           HE       ARG  69   9.753  -1.970  -9.488
  555   HH11  ARG  69          1HH1      ARG  69   8.542   0.997  -8.037
  556   HH12  ARG  69          2HH1      ARG  69   9.898   1.948  -8.568
  557   HH21  ARG  69          1HH2      ARG  69  11.515  -0.694 -10.199
  558   HH22  ARG  69          2HH2      ARG  69  11.577   0.991  -9.774
  559    H    LEU  70           HN       LEU  70   5.737  -3.085  -3.569
  560    HA   LEU  70           HA       LEU  70   3.228  -1.808  -3.492
  561    HB2  LEU  70           2HB      LEU  70   3.645  -4.278  -3.414
  562    HB3  LEU  70           1HB      LEU  70   4.181  -4.088  -1.757
  563    HG   LEU  70           HG       LEU  70   1.922  -3.255  -1.151
  564   HD11  LEU  70          1HD1      LEU  70   1.231  -4.023  -3.984
  565   HD12  LEU  70          2HD1      LEU  70   1.273  -2.383  -3.335
  566   HD13  LEU  70          3HD1      LEU  70   0.085  -3.540  -2.734
  567   HD21  LEU  70          3HD2      LEU  70   2.517  -5.609  -0.858
  568   HD22  LEU  70          1HD2      LEU  70   1.968  -5.954  -2.499
  569   HD23  LEU  70          2HD2      LEU  70   0.813  -5.422  -1.277
  570    H    ARG  71           HN       ARG  71   5.794  -2.191  -1.105
  571    HA   ARG  71           HA       ARG  71   4.616  -1.093   1.148
  572    HB2  ARG  71           2HB      ARG  71   7.407  -1.189   0.088
  573    HB3  ARG  71           1HB      ARG  71   7.071  -0.202   1.499
  574    HG2  ARG  71           2HG      ARG  71   6.556  -2.028   2.818
  575    HG3  ARG  71           1HG      ARG  71   6.217  -3.063   1.428
  576    HD2  ARG  71           2HD      ARG  71   8.444  -3.345   2.778
  577    HD3  ARG  71           1HD      ARG  71   8.440  -3.480   1.022
  578    HE   ARG  71           HE       ARG  71   8.979  -0.863   1.411
  579   HH11  ARG  71          1HH1      ARG  71  10.389  -3.765   2.787
  580   HH12  ARG  71          2HH1      ARG  71  11.982  -3.089   2.879
  581   HH21  ARG  71          1HH2      ARG  71  11.072   0.011   1.527
  582   HH22  ARG  71          2HH2      ARG  71  12.374  -0.947   2.182
  583    H    GLY  72           HN       GLY  72   6.388   0.579  -1.442
  584    HA2  GLY  72           2HA      GLY  72   6.137   3.170  -0.370
  585    HA3  GLY  72           1HA      GLY  72   6.466   2.791  -2.055
  586    H    ARG  73           HN       ARG  73   4.119   1.389  -2.659
  587    HA   ARG  73           HA       ARG  73   2.419   3.578  -3.257
  588    HB2  ARG  73           2HB      ARG  73   1.998   0.597  -3.576
  589    HB3  ARG  73           1HB      ARG  73   0.914   1.826  -4.218
  590    HG2  ARG  73           2HG      ARG  73   2.685   2.710  -5.610
  591    HG3  ARG  73           1HG      ARG  73   3.827   1.555  -4.928
  592    HD2  ARG  73           2HD      ARG  73   2.494  -0.290  -5.853
  593    HD3  ARG  73           1HD      ARG  73   1.374   0.881  -6.548
  594    HE   ARG  73           HE       ARG  73   3.527   1.719  -7.719
  595   HH11  ARG  73          1HH1      ARG  73   2.725  -1.627  -7.065
  596   HH12  ARG  73          2HH1      ARG  73   3.673  -2.245  -8.384
  597   HH21  ARG  73          1HH2      ARG  73   4.752   0.916  -9.468
  598   HH22  ARG  73          2HH2      ARG  73   4.782  -0.798  -9.781
  599    H    ILE  74           HN       ILE  74   2.146   0.874  -0.966
  600    HA   ILE  74           HA       ILE  74  -0.409   1.554   0.021
  601    HB   ILE  74           HB       ILE  74   1.866   0.073   1.357
  602   HG12  ILE  74          2HG1      ILE  74  -0.682  -0.919   0.056
  603   HG13  ILE  74          1HG1      ILE  74   0.919  -0.985  -0.674
  604   HG21  ILE  74          1HG2      ILE  74   0.204  -0.745   2.961
  605   HG22  ILE  74          2HG2      ILE  74  -1.010   0.303   2.232
  606   HG23  ILE  74          3HG2      ILE  74   0.381   1.009   3.053
  607   HD11  ILE  74          3HD1      ILE  74   1.658  -2.472   1.124
  608   HD12  ILE  74          1HD1      ILE  74   0.289  -3.137   0.232
  609   HD13  ILE  74          2HD1      ILE  74   0.040  -2.415   1.822
  610    H    GLU  75           HN       GLU  75   2.856   2.530   0.974
  611    HA   GLU  75           HA       GLU  75   2.280   3.946   3.301
  612    HB2  GLU  75           2HB      GLU  75   4.568   3.506   2.514
  613    HB3  GLU  75           1HB      GLU  75   4.326   4.614   1.172
  614    HG2  GLU  75           2HG      GLU  75   3.858   6.386   2.949
  615    HG3  GLU  75           1HG      GLU  75   4.553   5.241   4.095
  616    H    SER  76           HN       SER  76   2.325   5.071  -0.051
  617    HA   SER  76           HA       SER  76   1.713   7.755   0.450
  618    HB2  SER  76           2HB      SER  76   1.106   6.117  -2.004
  619    HB3  SER  76           1HB      SER  76   1.190   7.875  -1.932
  620    HG   SER  76           HG       SER  76   3.429   7.353  -1.020
  621    H    VAL  77           HN       VAL  77  -0.401   5.003  -0.259
  622    HA   VAL  77           HA       VAL  77  -2.798   6.490  -0.402
  623    HB   VAL  77           HB       VAL  77  -2.411   3.577   0.314
  624   HG11  VAL  77          1HG1      VAL  77  -4.751   3.301  -0.384
  625   HG12  VAL  77          2HG1      VAL  77  -4.892   5.049  -0.572
  626   HG13  VAL  77          3HG1      VAL  77  -4.603   4.354   1.023
  627   HG21  VAL  77          3HG2      VAL  77  -1.492   4.131  -1.875
  628   HG22  VAL  77          1HG2      VAL  77  -3.011   4.904  -2.330
  629   HG23  VAL  77          2HG2      VAL  77  -2.960   3.165  -2.047
  630    H    LEU  78           HN       LEU  78  -1.315   4.662   2.273
  631    HA   LEU  78           HA       LEU  78  -3.367   5.201   4.136
  632    HB2  LEU  78           2HB      LEU  78  -0.466   4.480   4.547
  633    HB3  LEU  78           1HB      LEU  78  -1.645   4.569   5.843
  634    HG   LEU  78           HG       LEU  78  -1.767   2.673   3.496
  635   HD11  LEU  78          1HD1      LEU  78  -1.185   2.149   6.403
  636   HD12  LEU  78          2HD1      LEU  78   0.014   2.160   5.111
  637   HD13  LEU  78          3HD1      LEU  78  -1.268   0.948   5.117
  638   HD21  LEU  78          3HD2      LEU  78  -3.623   1.646   4.728
  639   HD22  LEU  78          1HD2      LEU  78  -3.988   3.306   4.262
  640   HD23  LEU  78          2HD2      LEU  78  -3.536   2.937   5.926
  641    H    ASP  79           HN       ASP  79  -0.341   6.870   3.382
  642    HA   ASP  79           HA       ASP  79  -0.488   8.758   5.486
  643    HB2  ASP  79           2HB      ASP  79   1.594   8.377   4.291
  644    HB3  ASP  79           1HB      ASP  79   0.871   8.948   2.791
  645    H    TRP  80           HN       TRP  80  -1.632   8.785   2.152
  646    HA   TRP  80           HA       TRP  80  -2.615  11.397   2.033
  647    HB2  TRP  80           2HB      TRP  80  -2.453  10.072   0.038
  648    HB3  TRP  80           1HB      TRP  80  -3.528   8.846   0.698
  649    HD1  TRP  80           1HD      TRP  80  -3.686  12.520  -0.535
  650    HE1  TRP  80           1HE      TRP  80  -6.051  12.940  -1.469
  651    HE3  TRP  80           3HE      TRP  80  -5.830   8.029   0.636
  652    HZ2  TRP  80           2HZ      TRP  80  -8.498  11.538  -1.690
  653    HZ3  TRP  80           3HZ      TRP  80  -8.182   7.650   0.026
  654    HH2  TRP  80           2HH      TRP  80  -9.487   9.367  -1.110
  655    H    ALA  81           HN       ALA  81  -4.293   8.390   2.959
  656    HA   ALA  81           HA       ALA  81  -6.775   9.574   3.539
  657    HB1  ALA  81           1HB      ALA  81  -5.577   7.082   4.751
  658    HB2  ALA  81           2HB      ALA  81  -6.469   7.156   3.232
  659    HB3  ALA  81           3HB      ALA  81  -7.284   7.524   4.753
  660    H    THR  82           HN       THR  82  -3.954   8.962   5.595
  661    HA   THR  82           HA       THR  82  -5.145   9.747   8.025
  662    HB   THR  82           HB       THR  82  -2.212   9.904   7.284
  663    HG1  THR  82           1HG      THR  82  -2.806   7.799   6.987
  664   HG21  THR  82          3HG2      THR  82  -1.856   9.596   9.711
  665   HG22  THR  82          1HG2      THR  82  -3.598   9.695   9.967
  666   HG23  THR  82          2HG2      THR  82  -2.715  11.093   9.354
  667    H    VAL  83           HN       VAL  83  -3.265  11.581   5.615
  668    HA   VAL  83           HA       VAL  83  -3.336  14.037   7.042
  669    HB   VAL  83           HB       VAL  83  -2.932  13.519   4.091
  670   HG11  VAL  83          1HG1      VAL  83  -1.975  15.782   4.002
  671   HG12  VAL  83          2HG1      VAL  83  -2.456  16.040   5.680
  672   HG13  VAL  83          3HG1      VAL  83  -3.684  15.805   4.437
  673   HG21  VAL  83          3HG2      VAL  83  -1.219  12.502   5.470
  674   HG22  VAL  83          1HG2      VAL  83  -0.971  14.026   6.325
  675   HG23  VAL  83          2HG2      VAL  83  -0.556  13.894   4.616
  676    H    ARG  84           HN       ARG  84  -5.419  12.607   4.568
  677    HA   ARG  84           HA       ARG  84  -7.070  14.897   4.214
  678    HB2  ARG  84           2HB      ARG  84  -7.539  11.980   3.608
  679    HB3  ARG  84           1HB      ARG  84  -8.665  13.251   3.162
  680    HG2  ARG  84           2HG      ARG  84  -5.815  12.975   2.226
  681    HG3  ARG  84           1HG      ARG  84  -7.267  12.635   1.284
  682    HD2  ARG  84           2HD      ARG  84  -6.605  15.336   2.445
  683    HD3  ARG  84           1HD      ARG  84  -6.192  14.845   0.804
  684    HE   ARG  84           HE       ARG  84  -8.941  14.423   1.195
  685   HH11  ARG  84          1HH1      ARG  84  -6.671  17.090   1.034
  686   HH12  ARG  84          2HH1      ARG  84  -7.821  18.195   0.337
  687   HH21  ARG  84          1HH2      ARG  84 -10.468  15.888   0.307
  688   HH22  ARG  84          2HH2      ARG  84  -9.968  17.503  -0.092
  689    H    GLY  85           HN       GLY  85  -6.876  12.573   6.691
  690    HA2  GLY  85           2HA      GLY  85  -7.925  12.843   8.772
  691    HA3  GLY  85           1HA      GLY  85  -9.141  13.852   8.006
  692    H    TYR  86           HN       TYR  86  -8.203  10.707   6.776
  693    HA   TYR  86           HA       TYR  86 -10.907   9.738   7.144
  694    HB2  TYR  86           2HB      TYR  86  -8.484   8.735   5.707
  695    HB3  TYR  86           1HB      TYR  86  -9.754   7.591   6.129
  696    HD1  TYR  86           2HD      TYR  86 -11.956   7.746   5.125
  697    HD2  TYR  86           1HD      TYR  86  -8.861  10.447   4.017
  698    HE1  TYR  86           2HE      TYR  86 -13.252   8.405   3.146
  699    HE2  TYR  86           1HE      TYR  86 -10.153  11.119   2.033
  700    HH   TYR  86           HH       TYR  86 -13.423  10.343   1.628
  701    H    ARG  87           HN       ARG  87  -8.004   9.668   8.879
  702    HA   ARG  87           HA       ARG  87  -9.196   8.161  10.982
  703    HB2  ARG  87           2HB      ARG  87  -7.775   6.266  11.045
  704    HB3  ARG  87           1HB      ARG  87  -8.357   6.372   9.391
  705    HG2  ARG  87           2HG      ARG  87  -6.230   7.417   8.731
  706    HG3  ARG  87           1HG      ARG  87  -5.645   7.229  10.386
  707    HD2  ARG  87           2HD      ARG  87  -6.398   4.717   9.947
  708    HD3  ARG  87           1HD      ARG  87  -6.088   5.189   8.277
  709    HE   ARG  87           HE       ARG  87  -3.860   6.013   9.578
  710   HH11  ARG  87          1HH1      ARG  87  -5.551   2.957   9.330
  711   HH12  ARG  87          2HH1      ARG  87  -4.156   1.999   9.730
  712   HH21  ARG  87          1HH2      ARG  87  -2.014   4.745  10.111
  713   HH22  ARG  87          2HH2      ARG  87  -2.162   3.017  10.170
  714    H    GLU  88           HN       GLU  88  -7.669   8.003  12.867
  715    HA   GLU  88           HA       GLU  88  -6.030  10.422  12.949
  716    HB2  GLU  88           2HB      GLU  88  -6.979   8.616  15.179
  717    HB3  GLU  88           1HB      GLU  88  -6.095  10.120  15.391
  718    HG2  GLU  88           2HG      GLU  88  -8.841   9.830  14.197
  719    HG3  GLU  88           1HG      GLU  88  -8.462  10.419  15.816
  720    H    GLY  89           HN       GLY  89  -4.090  10.167  14.543
  721    HA2  GLY  89           2HA      GLY  89  -2.225   8.995  15.296
  722    HA3  GLY  89           1HA      GLY  89  -2.808   7.569  14.452
  723    H    ASP  90           HN       ASP  90  -1.445   6.944  12.966
  724    HA   ASP  90           HA       ASP  90  -0.371   8.761  10.996
  725    HB2  ASP  90           2HB      ASP  90   1.163   8.707  13.143
  726    HB3  ASP  90           1HB      ASP  90   1.653   7.137  12.517
  727    H    ASN  91           HN       ASN  91   1.102   7.307   9.434
  728    HA   ASN  91           HA       ASN  91  -0.425   4.874   9.044
  729    HB2  ASN  91           2HB      ASN  91   0.606   4.829   6.833
  730    HB3  ASN  91           1HB      ASN  91  -0.168   6.367   7.134
  731   HD21  ASN  91          1HD2      ASN  91   1.889   5.660   5.218
  732   HD22  ASN  91          2HD2      ASN  91   3.230   6.692   5.554
  733    HA   PRO  92           HA       PRO  92   2.784   2.381  10.656
  734    HB2  PRO  92           2HB      PRO  92   1.803  -0.024  10.037
  735    HB3  PRO  92           1HB      PRO  92   0.964   1.052  11.159
  736    HG2  PRO  92           2HG      PRO  92   0.345   0.420   8.319
  737    HG3  PRO  92           1HG      PRO  92  -0.759   0.768   9.658
  738    HD2  PRO  92           2HD      PRO  92   0.081   2.566   7.671
  739    HD3  PRO  92           1HD      PRO  92  -0.761   2.979   9.175
  740    H    ALA  93           HN       ALA  93   2.615   2.987   7.454
  741    HA   ALA  93           HA       ALA  93   4.247   0.829   6.461
  742    HB1  ALA  93           1HB      ALA  93   3.490   3.447   5.166
  743    HB2  ALA  93           2HB      ALA  93   2.619   1.920   5.000
  744    HB3  ALA  93           3HB      ALA  93   4.256   2.078   4.362
  745    H    ARG  94           HN       ARG  94   4.806   3.655   8.192
  746    HA   ARG  94           HA       ARG  94   7.491   4.076   7.192
  747    HB2  ARG  94           2HB      ARG  94   5.979   5.344   9.472
  748    HB3  ARG  94           1HB      ARG  94   7.592   5.807   8.971
  749    HG2  ARG  94           2HG      ARG  94   6.784   6.573   6.848
  750    HG3  ARG  94           1HG      ARG  94   5.167   5.960   7.197
  751    HD2  ARG  94           2HD      ARG  94   4.831   7.572   8.907
  752    HD3  ARG  94           1HD      ARG  94   6.533   8.033   8.899
  753    HE   ARG  94           HE       ARG  94   5.908   8.728   6.449
  754   HH11  ARG  94          1HH1      ARG  94   3.850   9.050   9.270
  755   HH12  ARG  94          2HH1      ARG  94   3.171  10.559   8.745
  756   HH21  ARG  94          1HH2      ARG  94   5.017  10.690   5.766
  757   HH22  ARG  94          2HH2      ARG  94   3.797  11.475   6.725
  758    H    TRP  95           HN       TRP  95   9.223   3.136   8.007
  759    HA   TRP  95           HA       TRP  95   8.962   1.691  10.553
  760    HB2  TRP  95           2HB      TRP  95  10.130   0.861   7.954
  761    HB3  TRP  95           1HB      TRP  95  10.942   0.313   9.419
  762    HD1  TRP  95           1HD      TRP  95   9.108  -0.858  11.272
  763    HE1  TRP  95           1HE      TRP  95   7.307  -2.619  10.743
  764    HE3  TRP  95           3HE      TRP  95   8.655  -0.045   6.242
  765    HZ2  TRP  95           2HZ      TRP  95   5.886  -3.538   8.477
  766    HZ3  TRP  95           3HZ      TRP  95   7.050  -1.409   4.967
  767    HH2  TRP  95           2HH      TRP  95   5.695  -3.118   6.063
  768    H    ARG  96           HN       ARG  96  10.074   2.581  12.098
  769    HA   ARG  96           HA       ARG  96  12.238   4.377  11.659
  770    HB2  ARG  96           2HB      ARG  96  12.429   4.299  14.161
  771    HB3  ARG  96           1HB      ARG  96  10.839   4.741  13.562
  772    HG2  ARG  96           2HG      ARG  96  10.094   2.407  13.940
  773    HG3  ARG  96           1HG      ARG  96  11.672   2.052  14.642
  774    HD2  ARG  96           2HD      ARG  96  11.298   3.678  16.390
  775    HD3  ARG  96           1HD      ARG  96   9.768   4.157  15.657
  776    HE   ARG  96           HE       ARG  96   9.785   1.368  16.237
  777   HH11  ARG  96          1HH1      ARG  96   9.476   4.519  17.742
  778   HH12  ARG  96          2HH1      ARG  96   8.525   3.931  19.073
  779   HH21  ARG  96          1HH2      ARG  96   8.523   0.586  18.001
  780   HH22  ARG  96          2HH2      ARG  96   7.980   1.706  19.221
  781    H    GLY  97           HN       GLY  97  11.986   1.023  12.629
  782    HA2  GLY  97           2HA      GLY  97  14.919   0.812  12.379
  783    HA3  GLY  97           1HA      GLY  97  13.995  -0.115  13.556
  784    H    TYR  98           HN       TYR  98  11.849  -0.372  11.412
  785    HA   TYR  98           HA       TYR  98  11.152  -1.888   9.886
  786    HB2  TYR  98           2HB      TYR  98  12.919  -0.824   8.502
  787    HB3  TYR  98           1HB      TYR  98  14.068  -2.013   9.091
  788    HD1  TYR  98           2HD      TYR  98  10.645  -2.059   7.558
  789    HD2  TYR  98           1HD      TYR  98  14.583  -3.673   7.587
  790    HE1  TYR  98           2HE      TYR  98  10.038  -3.560   5.705
  791    HE2  TYR  98           1HE      TYR  98  13.988  -5.173   5.733
  792    HH   TYR  98           HH       TYR  98  12.027  -6.165   4.716
  793    H    LEU  99           HN       LEU  99  11.600  -4.287   9.143
  794    HA   LEU  99           HA       LEU  99  11.643  -5.914  11.438
  795    HB2  LEU  99           2HB      LEU  99  12.064  -6.721   8.557
  796    HB3  LEU  99           1HB      LEU  99  11.640  -7.801   9.873
  797    HG   LEU  99           HG       LEU  99   9.897  -5.551   8.855
  798   HD11  LEU  99          1HD1      LEU  99  10.108  -7.311   7.196
  799   HD12  LEU  99          2HD1      LEU  99   8.504  -7.346   7.928
  800   HD13  LEU  99          3HD1      LEU  99   9.720  -8.528   8.412
  801   HD21  LEU  99          3HD2      LEU  99   8.169  -6.584  10.237
  802   HD22  LEU  99          1HD2      LEU  99   9.539  -6.063  11.217
  803   HD23  LEU  99          2HD2      LEU  99   9.335  -7.770  10.823
  804    H    GLU 100           HN       GLU 100  14.103  -4.934   9.192
  805    HA   GLU 100           HA       GLU 100  16.113  -6.715  10.297
  806    HB2  GLU 100           2HB      GLU 100  15.845  -5.896   7.823
  807    HB3  GLU 100           1HB      GLU 100  16.645  -4.444   8.403
  808    HG2  GLU 100           2HG      GLU 100  18.472  -6.000   9.262
  809    HG3  GLU 100           1HG      GLU 100  17.721  -7.235   8.251
  810    H    HIS 101           HN       HIS 101  18.237  -4.647  10.013
  811    HA   HIS 101           HA       HIS 101  17.488  -2.747  12.108
  812    HB2  HIS 101           2HB      HIS 101  18.608  -4.585  13.277
  813    HB3  HIS 101           1HB      HIS 101  19.983  -4.461  12.186
  814    HD1  HIS 101           1HD      HIS 101  21.878  -3.216  13.127
  815    HD2  HIS 101           2HD      HIS 101  18.252  -1.933  14.722
  816    HE1  HIS 101           1HE      HIS 101  22.466  -1.445  14.814
  817    HE2  HIS 101           2HE      HIS 101  20.270  -0.759  15.845
  818    H    HIS 102           HN       HIS 102  17.384  -1.343  10.271
  819    HA   HIS 102           HA       HIS 102  18.156   0.316   8.935
  820    HB2  HIS 102           2HB      HIS 102  19.098   0.975  11.189
  821    HB3  HIS 102           1HB      HIS 102  20.626   0.271  10.678
  822    HD1  HIS 102           1HD      HIS 102  18.454   3.248  10.242
  823    HD2  HIS 102           2HD      HIS 102  22.007   1.741   8.689
  824    HE1  HIS 102           1HE      HIS 102  19.521   5.162   9.004
  825    HE2  HIS 102           2HE      HIS 102  21.568   4.170   7.911
  826    H    HIS 103           HN       HIS 103  18.339  -1.081   7.104
  827    HA   HIS 103           HA       HIS 103  20.713  -2.568   6.597
  828    HB2  HIS 103           2HB      HIS 103  18.369  -3.045   5.686
  829    HB3  HIS 103           1HB      HIS 103  18.688  -1.777   4.507
  830    HD1  HIS 103           1HD      HIS 103  19.364  -2.761   2.348
  831    HD2  HIS 103           2HD      HIS 103  20.792  -4.983   5.565
  832    HE1  HIS 103           1HE      HIS 103  20.629  -4.693   1.340
  833    HE2  HIS 103           2HE      HIS 103  21.284  -6.135   3.303
  834    H    HIS 104           HN       HIS 104  22.574  -1.625   6.235
  835    HA   HIS 104           HA       HIS 104  22.699   0.784   4.545
  836    HB2  HIS 104           2HB      HIS 104  23.672   0.901   6.849
  837    HB3  HIS 104           1HB      HIS 104  24.800  -0.371   6.407
  838    HD1  HIS 104           1HD      HIS 104  26.933   0.322   5.264
  839    HD2  HIS 104           2HD      HIS 104  24.126   3.398   5.453
  840    HE1  HIS 104           1HE      HIS 104  28.132   2.393   4.495
  841    HE2  HIS 104           2HE      HIS 104  26.456   4.260   4.727
  842    H    HIS 105           HN       HIS 105  22.440  -2.104   3.729
  843    HA   HIS 105           HA       HIS 105  23.362  -3.737   2.447
  844    HB2  HIS 105           2HB      HIS 105  25.119  -1.444   1.534
  845    HB3  HIS 105           1HB      HIS 105  25.279  -3.074   0.897
  846    HD1  HIS 105           1HD      HIS 105  24.738  -1.726  -1.397
  847    HD2  HIS 105           2HD      HIS 105  21.601  -2.206   1.296
  848    HE1  HIS 105           1HE      HIS 105  22.636  -1.315  -2.719
  849    HE2  HIS 105           2HE      HIS 105  20.750  -1.790  -1.113
  850    H    HIS 106           HN       HIS 106  26.450  -2.141   2.710
  851    HA   HIS 106           HA       HIS 106  27.144  -3.342   5.223
  852    HB2  HIS 106           2HB      HIS 106  28.390  -4.307   2.656
  853    HB3  HIS 106           1HB      HIS 106  29.314  -4.303   4.153
  854    HD1  HIS 106           1HD      HIS 106  27.549  -6.585   2.207
  855    HD2  HIS 106           2HD      HIS 106  27.479  -5.678   6.265
  856    HE1  HIS 106           1HE      HIS 106  26.550  -8.594   3.333
  857    HE2  HIS 106           2HE      HIS 106  26.273  -7.906   5.744
  Start of MODEL   15
    1    H1   MET   1           H1       MET   1 -14.570   2.841   6.261
    2    H2   MET   1           H2       MET   1 -15.589   1.677   5.567
    3    H3   MET   1           H3       MET   1 -15.927   3.327   5.367
    4    HA   MET   1           HA       MET   1 -15.004   2.527   3.354
    5    HB2  MET   1           2HB      MET   1 -14.289   4.775   4.134
    6    HB3  MET   1           1HB      MET   1 -12.903   4.043   4.932
    7    HG2  MET   1           2HG      MET   1 -12.113   4.923   2.885
    8    HG3  MET   1           1HG      MET   1 -12.198   3.176   2.688
    9    HE1  MET   1           2HE      MET   1 -13.947   6.606   1.871
   10    HE2  MET   1           3HE      MET   1 -15.215   5.697   2.689
   11    HE3  MET   1           1HE      MET   1 -15.367   6.068   0.972
   12    H    THR   2           HN       THR   2 -13.998   0.848   2.429
   13    HA   THR   2           HA       THR   2 -12.176  -0.728   4.080
   14    HB   THR   2           HB       THR   2 -12.307  -2.419   2.272
   15    HG1  THR   2           1HG      THR   2 -14.347  -0.783   1.144
   16   HG21  THR   2          3HG2      THR   2 -14.970  -1.437   3.302
   17   HG22  THR   2          1HG2      THR   2 -13.867  -2.531   4.135
   18   HG23  THR   2          2HG2      THR   2 -14.657  -3.043   2.643
   19    H    PHE   3           HN       PHE   3 -10.253  -1.710   2.875
   20    HA   PHE   3           HA       PHE   3  -8.549   0.430   2.165
   21    HB2  PHE   3           2HB      PHE   3  -7.767  -1.652   3.256
   22    HB3  PHE   3           1HB      PHE   3  -8.111  -2.543   1.778
   23    HD1  PHE   3           1HD      PHE   3  -6.061   0.247   3.121
   24    HD2  PHE   3           2HD      PHE   3  -6.487  -2.748   0.128
   25    HE1  PHE   3           1HE      PHE   3  -3.792   0.743   2.307
   26    HE2  PHE   3           2HE      PHE   3  -4.223  -2.256  -0.692
   27    HZ   PHE   3           HZ       PHE   3  -2.870  -0.514   0.396
   28    H    SER   4           HN       SER   4 -10.229  -2.028   0.266
   29    HA   SER   4           HA       SER   4  -9.039  -1.410  -2.216
   30    HB2  SER   4           2HB      SER   4 -10.337  -3.492  -1.732
   31    HB3  SER   4           1HB      SER   4 -11.812  -2.530  -1.734
   32    HG   SER   4           HG       SER   4 -10.718  -3.669  -3.789
   33    H    GLU   5           HN       GLU   5 -11.932  -0.180  -0.590
   34    HA   GLU   5           HA       GLU   5 -12.835   1.490  -2.677
   35    HB2  GLU   5           2HB      GLU   5 -13.211   1.623   0.315
   36    HB3  GLU   5           1HB      GLU   5 -14.018   2.695  -0.811
   37    HG2  GLU   5           2HG      GLU   5 -15.137   0.825  -1.847
   38    HG3  GLU   5           1HG      GLU   5 -14.282  -0.291  -0.780
   39    H    CYS   6           HN       CYS   6 -10.845   2.126   0.185
   40    HA   CYS   6           HA       CYS   6 -10.498   4.883  -0.212
   41    HB2  CYS   6           2HB      CYS   6  -9.974   3.505   1.864
   42    HB3  CYS   6           1HB      CYS   6  -8.476   3.050   1.080
   43    HG   CYS   6           HG       CYS   6  -7.823   5.893   0.754
   44    H    ALA   7           HN       ALA   7  -8.495   2.129  -1.156
   45    HA   ALA   7           HA       ALA   7  -6.452   3.539  -2.447
   46    HB1  ALA   7           1HB      ALA   7  -6.302   1.152  -1.920
   47    HB2  ALA   7           2HB      ALA   7  -5.961   1.460  -3.625
   48    HB3  ALA   7           3HB      ALA   7  -7.526   0.807  -3.141
   49    H    ALA   8           HN       ALA   8  -9.489   2.230  -3.755
   50    HA   ALA   8           HA       ALA   8  -9.072   3.021  -6.422
   51    HB1  ALA   8           1HB      ALA   8 -10.758   1.378  -5.760
   52    HB2  ALA   8           2HB      ALA   8 -11.465   2.677  -6.719
   53    HB3  ALA   8           3HB      ALA   8 -11.689   2.649  -4.970
   54    H    LEU   9           HN       LEU   9 -10.306   4.752  -3.629
   55    HA   LEU   9           HA       LEU   9 -11.223   7.029  -5.094
   56    HB2  LEU   9           2HB      LEU   9 -10.481   6.684  -2.192
   57    HB3  LEU   9           1HB      LEU   9 -11.165   8.155  -2.854
   58    HG   LEU   9           HG       LEU   9 -12.509   5.455  -2.768
   59   HD11  LEU   9          1HD1      LEU   9 -13.074   8.016  -1.284
   60   HD12  LEU   9          2HD1      LEU   9 -12.385   6.545  -0.597
   61   HD13  LEU   9          3HD1      LEU   9 -14.038   6.541  -1.209
   62   HD21  LEU   9          3HD2      LEU   9 -14.467   6.593  -3.649
   63   HD22  LEU   9          1HD2      LEU   9 -13.118   6.719  -4.780
   64   HD23  LEU   9          2HD2      LEU   9 -13.558   8.099  -3.774
   65    H    TYR  10           HN       TYR  10  -8.257   6.245  -3.327
   66    HA   TYR  10           HA       TYR  10  -6.869   8.635  -3.654
   67    HB2  TYR  10           2HB      TYR  10  -5.986   6.942  -2.205
   68    HB3  TYR  10           1HB      TYR  10  -5.897   5.776  -3.516
   69    HD1  TYR  10           2HD      TYR  10  -4.552   9.161  -2.640
   70    HD2  TYR  10           1HD      TYR  10  -3.851   5.392  -4.475
   71    HE1  TYR  10           2HE      TYR  10  -2.229   9.823  -3.099
   72    HE2  TYR  10           1HE      TYR  10  -1.526   6.039  -4.934
   73    HH   TYR  10           HH       TYR  10  -0.174   8.006  -5.170
   74    H    ILE  11           HN       ILE  11  -6.945   5.776  -5.710
   75    HA   ILE  11           HA       ILE  11  -5.187   6.648  -7.692
   76    HB   ILE  11           HB       ILE  11  -7.538   4.761  -7.934
   77   HG12  ILE  11          2HG1      ILE  11  -4.584   4.203  -7.580
   78   HG13  ILE  11          1HG1      ILE  11  -5.762   4.181  -6.274
   79   HG21  ILE  11          1HG2      ILE  11  -6.888   5.573 -10.136
   80   HG22  ILE  11          2HG2      ILE  11  -6.410   3.886  -9.935
   81   HG23  ILE  11          3HG2      ILE  11  -5.204   5.166  -9.806
   82   HD11  ILE  11          3HD1      ILE  11  -5.757   2.372  -8.672
   83   HD12  ILE  11          1HD1      ILE  11  -6.946   2.357  -7.369
   84   HD13  ILE  11          2HD1      ILE  11  -5.265   1.941  -7.035
   85    H    LYS  12           HN       LYS  12  -8.687   7.152  -7.384
   86    HA   LYS  12           HA       LYS  12  -8.980   8.437  -9.917
   87    HB2  LYS  12           2HB      LYS  12 -10.720   8.520  -7.447
   88    HB3  LYS  12           1HB      LYS  12 -11.164   9.221  -8.995
   89    HG2  LYS  12           2HG      LYS  12 -11.123   7.029 -10.031
   90    HG3  LYS  12           1HG      LYS  12 -10.609   6.303  -8.506
   91    HD2  LYS  12           2HD      LYS  12 -12.689   7.074  -7.455
   92    HD3  LYS  12           1HD      LYS  12 -13.203   7.760  -8.995
   93    HE2  LYS  12           2HE      LYS  12 -14.247   5.582  -8.572
   94    HE3  LYS  12           1HE      LYS  12 -13.215   5.548 -10.002
   95    HZ1  LYS  12           3HZ      LYS  12 -11.716   4.183  -9.010
   96    HZ2  LYS  12           1HZ      LYS  12 -13.107   3.682  -8.169
   97    HZ3  LYS  12           2HZ      LYS  12 -12.023   4.770  -7.449
   98    H    ALA  13           HN       ALA  13  -8.565   9.643  -6.609
   99    HA   ALA  13           HA       ALA  13  -8.896  12.380  -7.299
  100    HB1  ALA  13           1HB      ALA  13  -9.277  11.553  -5.034
  101    HB2  ALA  13           2HB      ALA  13  -8.077  12.845  -5.047
  102    HB3  ALA  13           3HB      ALA  13  -7.563  11.167  -4.883
  103    H    HIS  14           HN       HIS  14  -6.174  10.222  -7.312
  104    HA   HIS  14           HA       HIS  14  -4.337  12.490  -7.707
  105    HB2  HIS  14           2HB      HIS  14  -4.075  10.507  -5.927
  106    HB3  HIS  14           1HB      HIS  14  -3.329   9.713  -7.305
  107    HD1  HIS  14           1HD      HIS  14  -1.128  10.841  -8.257
  108    HD2  HIS  14           2HD      HIS  14  -2.526  12.376  -4.655
  109    HE1  HIS  14           1HE      HIS  14   0.785  12.162  -7.294
  110    HE2  HIS  14           2HE      HIS  14  -0.012  12.881  -5.012
  111    H    ARG  15           HN       ARG  15  -6.173  10.670  -9.596
  112    HA   ARG  15           HA       ARG  15  -4.360   9.358 -11.333
  113    HB2  ARG  15           2HB      ARG  15  -6.204   8.940 -12.781
  114    HB3  ARG  15           1HB      ARG  15  -6.825   8.832 -11.141
  115    HG2  ARG  15           2HG      ARG  15  -7.842  10.993 -11.322
  116    HG3  ARG  15           1HG      ARG  15  -7.079  11.268 -12.884
  117    HD2  ARG  15           2HD      ARG  15  -8.394   8.922 -13.320
  118    HD3  ARG  15           1HD      ARG  15  -9.486   9.743 -12.204
  119    HE   ARG  15           HE       ARG  15  -8.515  11.043 -14.672
  120   HH11  ARG  15          1HH1      ARG  15 -11.159  10.037 -12.586
  121   HH12  ARG  15          2HH1      ARG  15 -12.368  10.880 -13.507
  122   HH21  ARG  15          1HH2      ARG  15 -10.100  12.104 -15.904
  123   HH22  ARG  15          2HH2      ARG  15 -11.761  12.082 -15.387
  124    H    SER  16           HN       SER  16  -5.784  12.569 -11.331
  125    HA   SER  16           HA       SER  16  -5.060  13.283 -13.949
  126    HB2  SER  16           2HB      SER  16  -5.400  15.158 -11.614
  127    HB3  SER  16           1HB      SER  16  -5.763  15.450 -13.312
  128    HG   SER  16           HG       SER  16  -7.719  14.918 -12.660
  129    H    SER  17           HN       SER  17  -3.369  13.300 -10.911
  130    HA   SER  17           HA       SER  17  -1.222  14.986 -11.685
  131    HB2  SER  17           2HB      SER  17  -1.815  14.526  -9.320
  132    HB3  SER  17           1HB      SER  17  -1.305  12.853  -9.530
  133    HG   SER  17           HG       SER  17   0.352  15.147  -9.849
  134    H    TRP  18           HN       TRP  18  -1.851  11.543 -11.984
  135    HA   TRP  18           HA       TRP  18   0.882  11.005 -12.848
  136    HB2  TRP  18           2HB      TRP  18  -1.490   9.134 -12.796
  137    HB3  TRP  18           1HB      TRP  18   0.190   8.684 -13.031
  138    HD1  TRP  18           1HD      TRP  18   1.418  10.316 -10.550
  139    HE1  TRP  18           1HE      TRP  18   0.984   9.416  -8.164
  140    HE3  TRP  18           3HE      TRP  18  -2.715   7.475 -11.515
  141    HZ2  TRP  18           2HZ      TRP  18  -0.882   7.726  -6.883
  142    HZ3  TRP  18           3HZ      TRP  18  -3.764   6.241  -9.665
  143    HH2  TRP  18           2HH      TRP  18  -2.864   6.366  -7.395
  144    H    LYS  19           HN       LYS  19  -2.326  11.399 -14.174
  145    HA   LYS  19           HA       LYS  19  -3.344  10.822 -16.104
  146    HB2  LYS  19           2HB      LYS  19  -1.121  12.043 -17.029
  147    HB3  LYS  19           1HB      LYS  19  -0.822  10.417 -17.631
  148    HG2  LYS  19           2HG      LYS  19  -2.802  10.431 -18.928
  149    HG3  LYS  19           1HG      LYS  19  -3.388  11.895 -18.136
  150    HD2  LYS  19           2HD      LYS  19  -1.349  13.063 -19.079
  151    HD3  LYS  19           1HD      LYS  19  -1.095  11.618 -20.063
  152    HE2  LYS  19           2HE      LYS  19  -2.303  13.298 -21.330
  153    HE3  LYS  19           1HE      LYS  19  -3.333  11.901 -21.032
  154    HZ1  LYS  19           3HZ      LYS  19  -4.532  13.063 -19.391
  155    HZ2  LYS  19           1HZ      LYS  19  -4.386  14.141 -20.691
  156    HZ3  LYS  19           2HZ      LYS  19  -3.404  14.326 -19.326
  157    H    ASN  20           HN       ASN  20  -3.411   7.565 -15.358
  158    HA   ASN  20           HA       ASN  20  -5.498   8.107 -15.967
  159    HB2  ASN  20           2HB      ASN  20  -4.739  10.558 -15.414
  160    HB3  ASN  20           1HB      ASN  20  -4.647  10.738 -17.157
  161   HD21  ASN  20          1HD2      ASN  20  -6.913   9.177 -17.863
  162   HD22  ASN  20          2HD2      ASN  20  -8.319  10.032 -17.312
  163    H    THR  21           HN       THR  21  -2.921   7.494 -17.648
  164    HA   THR  21           HA       THR  21  -4.457   6.962 -20.094
  165    HB   THR  21           HB       THR  21  -2.147   6.283 -20.988
  166    HG1  THR  21           1HG      THR  21  -0.391   6.864 -19.864
  167   HG21  THR  21          3HG2      THR  21  -1.547   8.599 -21.551
  168   HG22  THR  21          1HG2      THR  21  -2.638   9.187 -20.296
  169   HG23  THR  21          2HG2      THR  21  -3.283   8.335 -21.699
  170    H    LYS  22           HN       LYS  22  -1.619   5.215 -18.945
  171    HA   LYS  22           HA       LYS  22  -3.290   2.842 -18.454
  172    HB2  LYS  22           2HB      LYS  22  -0.328   3.073 -19.022
  173    HB3  LYS  22           1HB      LYS  22  -1.146   1.574 -18.631
  174    HG2  LYS  22           2HG      LYS  22  -2.564   1.923 -20.665
  175    HG3  LYS  22           1HG      LYS  22  -1.506   3.275 -21.078
  176    HD2  LYS  22           2HD      LYS  22  -0.664   0.398 -20.704
  177    HD3  LYS  22           1HD      LYS  22  -0.811   1.247 -22.244
  178    HE2  LYS  22           2HE      LYS  22   0.988   2.728 -21.666
  179    HE3  LYS  22           1HE      LYS  22   1.046   2.089 -20.024
  180    HZ1  LYS  22           3HZ      LYS  22   1.765   0.637 -22.518
  181    HZ2  LYS  22           1HZ      LYS  22   1.695  -0.075 -20.980
  182    HZ3  LYS  22           2HZ      LYS  22   2.822   1.146 -21.300
  183    H    HIS  23           HN       HIS  23  -1.360   5.230 -16.996
  184    HA   HIS  23           HA       HIS  23  -0.034   3.875 -14.967
  185    HB2  HIS  23           2HB      HIS  23  -1.098   6.690 -15.052
  186    HB3  HIS  23           1HB      HIS  23  -0.157   6.078 -13.698
  187    HD1  HIS  23           1HD      HIS  23   2.275   6.455 -13.872
  188    HD2  HIS  23           2HD      HIS  23   0.428   6.472 -17.598
  189    HE1  HIS  23           1HE      HIS  23   4.080   7.049 -15.525
  190    HE2  HIS  23           2HE      HIS  23   2.969   6.908 -17.788
  191    H    ALA  24           HN       ALA  24  -3.371   4.948 -15.060
  192    HA   ALA  24           HA       ALA  24  -3.920   4.677 -12.296
  193    HB1  ALA  24           1HB      ALA  24  -6.284   4.687 -12.969
  194    HB2  ALA  24           2HB      ALA  24  -5.802   4.497 -14.656
  195    HB3  ALA  24           3HB      ALA  24  -5.371   5.965 -13.774
  196    H    ASP  25           HN       ASP  25  -4.133   2.442 -15.033
  197    HA   ASP  25           HA       ASP  25  -5.344   0.339 -13.518
  198    HB2  ASP  25           2HB      ASP  25  -5.385   0.645 -16.076
  199    HB3  ASP  25           1HB      ASP  25  -3.776  -0.057 -16.067
  200    H    GLN  26           HN       GLN  26  -2.082   1.254 -14.429
  201    HA   GLN  26           HA       GLN  26  -0.681  -1.001 -13.594
  202    HB2  GLN  26           2HB      GLN  26   0.089   1.916 -13.619
  203    HB3  GLN  26           1HB      GLN  26   1.220   0.616 -13.295
  204    HG2  GLN  26           2HG      GLN  26  -0.390   0.782 -15.820
  205    HG3  GLN  26           1HG      GLN  26   1.202   1.518 -15.643
  206   HE21  GLN  26          1HE2      GLN  26   2.052   0.200 -17.265
  207   HE22  GLN  26          2HE2      GLN  26   2.382  -1.477 -17.003
  208    H    TRP  27           HN       TRP  27  -1.688   1.862 -11.763
  209    HA   TRP  27           HA       TRP  27  -0.553   0.982  -9.302
  210    HB2  TRP  27           2HB      TRP  27  -2.369   3.165 -10.167
  211    HB3  TRP  27           1HB      TRP  27  -2.434   2.704  -8.469
  212    HD1  TRP  27           1HD      TRP  27   0.159   3.929 -11.081
  213    HE1  TRP  27           1HE      TRP  27   2.008   5.216  -9.822
  214    HE3  TRP  27           3HE      TRP  27  -1.428   3.125  -6.288
  215    HZ2  TRP  27           2HZ      TRP  27   2.690   5.808  -7.150
  216    HZ3  TRP  27           3HZ      TRP  27  -0.123   4.086  -4.437
  217    HH2  TRP  27           2HH      TRP  27   1.892   5.398  -4.857
  218    H    THR  28           HN       THR  28  -3.823   0.873 -10.660
  219    HA   THR  28           HA       THR  28  -5.116  -0.232  -8.435
  220    HB   THR  28           HB       THR  28  -5.837  -0.591 -11.352
  221    HG1  THR  28           1HG      THR  28  -5.792   1.596 -10.913
  222   HG21  THR  28          3HG2      THR  28  -8.126  -0.889 -10.516
  223   HG22  THR  28          1HG2      THR  28  -7.530  -0.794  -8.859
  224   HG23  THR  28          2HG2      THR  28  -7.043  -2.136  -9.896
  225    H    ASN  29           HN       ASN  29  -3.681  -1.800 -11.278
  226    HA   ASN  29           HA       ASN  29  -4.726  -4.344 -10.926
  227    HB2  ASN  29           2HB      ASN  29  -3.456  -3.386 -12.920
  228    HB3  ASN  29           1HB      ASN  29  -1.978  -3.772 -12.050
  229   HD21  ASN  29          1HD2      ASN  29  -4.647  -4.973 -13.842
  230   HD22  ASN  29          2HD2      ASN  29  -4.105  -6.603 -13.981
  231    H    THR  30           HN       THR  30  -1.570  -3.128  -9.830
  232    HA   THR  30           HA       THR  30  -0.659  -5.516  -8.689
  233    HB   THR  30           HB       THR  30   0.034  -2.756  -7.702
  234    HG1  THR  30           1HG      THR  30   1.070  -4.157  -9.974
  235   HG21  THR  30          3HG2      THR  30   1.647  -5.299  -7.905
  236   HG22  THR  30          1HG2      THR  30   0.979  -4.618  -6.422
  237   HG23  THR  30          2HG2      THR  30   2.237  -3.750  -7.303
  238    H    ILE  31           HN       ILE  31  -2.216  -2.708  -7.149
  239    HA   ILE  31           HA       ILE  31  -2.129  -3.797  -4.542
  240    HB   ILE  31           HB       ILE  31  -3.903  -1.602  -5.626
  241   HG12  ILE  31          2HG1      ILE  31  -1.246  -1.451  -4.184
  242   HG13  ILE  31          1HG1      ILE  31  -1.483  -1.174  -5.908
  243   HG21  ILE  31          1HG2      ILE  31  -4.776  -2.475  -3.541
  244   HG22  ILE  31          2HG2      ILE  31  -4.076  -0.879  -3.281
  245   HG23  ILE  31          3HG2      ILE  31  -3.192  -2.319  -2.783
  246   HD11  ILE  31          3HD1      ILE  31  -2.632   0.482  -3.668
  247   HD12  ILE  31          1HD1      ILE  31  -2.891   0.758  -5.391
  248   HD13  ILE  31          2HD1      ILE  31  -1.275   0.919  -4.707
  249    H    LYS  32           HN       LYS  32  -4.638  -3.695  -7.026
  250    HA   LYS  32           HA       LYS  32  -6.715  -4.764  -5.450
  251    HB2  LYS  32           2HB      LYS  32  -6.801  -3.624  -7.791
  252    HB3  LYS  32           1HB      LYS  32  -6.475  -5.235  -8.410
  253    HG2  LYS  32           2HG      LYS  32  -8.480  -6.091  -7.383
  254    HG3  LYS  32           1HG      LYS  32  -8.803  -4.523  -6.641
  255    HD2  LYS  32           2HD      LYS  32  -9.018  -3.521  -8.869
  256    HD3  LYS  32           1HD      LYS  32  -8.709  -5.097  -9.602
  257    HE2  LYS  32           2HE      LYS  32 -11.016  -4.434  -7.773
  258    HE3  LYS  32           1HE      LYS  32 -11.107  -4.563  -9.529
  259    HZ1  LYS  32           3HZ      LYS  32 -10.527  -6.875  -9.396
  260    HZ2  LYS  32           1HZ      LYS  32 -11.854  -6.582  -8.382
  261    HZ3  LYS  32           2HZ      LYS  32 -10.305  -6.783  -7.718
  262    H    THR  33           HN       THR  33  -4.096  -6.220  -7.233
  263    HA   THR  33           HA       THR  33  -5.256  -8.860  -7.162
  264    HB   THR  33           HB       THR  33  -2.514  -7.951  -8.062
  265    HG1  THR  33           1HG      THR  33  -3.879  -7.152  -9.539
  266   HG21  THR  33          3HG2      THR  33  -2.398 -10.120  -9.207
  267   HG22  THR  33          1HG2      THR  33  -3.940 -10.586  -8.491
  268   HG23  THR  33          2HG2      THR  33  -2.532 -10.332  -7.462
  269    H    TYR  34           HN       TYR  34  -2.390  -7.311  -5.661
  270    HA   TYR  34           HA       TYR  34  -1.824  -9.703  -4.162
  271    HB2  TYR  34           2HB      TYR  34  -0.590  -6.950  -4.098
  272    HB3  TYR  34           1HB      TYR  34  -0.040  -8.286  -3.093
  273    HD1  TYR  34           1HD      TYR  34   1.010 -10.275  -4.151
  274    HD2  TYR  34           2HD      TYR  34  -0.018  -6.825  -6.414
  275    HE1  TYR  34           1HE      TYR  34   2.479 -11.038  -5.973
  276    HE2  TYR  34           2HE      TYR  34   1.439  -7.582  -8.239
  277    HH   TYR  34           HH       TYR  34   2.746 -10.727  -8.391
  278    H    CYS  35           HN       CYS  35  -2.987  -6.441  -3.311
  279    HA   CYS  35           HA       CYS  35  -3.202  -7.197  -0.519
  280    HB2  CYS  35           2HB      CYS  35  -3.994  -4.617  -1.884
  281    HB3  CYS  35           1HB      CYS  35  -3.860  -4.876  -0.148
  282    HG   CYS  35           HG       CYS  35  -1.462  -4.007  -0.044
  283    H    GLY  36           HN       GLY  36  -5.277  -6.798  -3.269
  284    HA2  GLY  36           2HA      GLY  36  -7.731  -6.224  -2.180
  285    HA3  GLY  36           1HA      GLY  36  -7.503  -7.213  -3.610
  286    HA   PRO  37           HA       PRO  37  -8.991 -10.900  -1.788
  287    HB2  PRO  37           2HB      PRO  37  -6.304 -12.177  -1.724
  288    HB3  PRO  37           1HB      PRO  37  -7.805 -12.743  -2.464
  289    HG2  PRO  37           2HG      PRO  37  -5.852 -11.767  -3.972
  290    HG3  PRO  37           1HG      PRO  37  -7.547 -11.391  -4.336
  291    HD2  PRO  37           2HD      PRO  37  -5.468  -9.693  -3.019
  292    HD3  PRO  37           1HD      PRO  37  -6.723  -9.234  -4.188
  293    H    VAL  38           HN       VAL  38  -6.273  -9.458  -0.174
  294    HA   VAL  38           HA       VAL  38  -6.750 -11.101   2.210
  295    HB   VAL  38           HB       VAL  38  -4.480  -9.170   1.732
  296   HG11  VAL  38          1HG1      VAL  38  -4.830 -11.353   3.787
  297   HG12  VAL  38          2HG1      VAL  38  -4.963  -9.622   4.094
  298   HG13  VAL  38          3HG1      VAL  38  -3.416 -10.315   3.604
  299   HG21  VAL  38          3HG2      VAL  38  -4.584 -12.162   1.358
  300   HG22  VAL  38          1HG2      VAL  38  -3.114 -11.189   1.331
  301   HG23  VAL  38          2HG2      VAL  38  -4.350 -10.947   0.099
  302    H    ILE  39           HN       ILE  39  -5.799  -7.681   1.751
  303    HA   ILE  39           HA       ILE  39  -7.471  -7.049   4.089
  304    HB   ILE  39           HB       ILE  39  -6.089  -4.998   4.305
  305   HG12  ILE  39          2HG1      ILE  39  -4.418  -6.272   2.130
  306   HG13  ILE  39          1HG1      ILE  39  -5.389  -4.816   1.949
  307   HG21  ILE  39          1HG2      ILE  39  -4.065  -6.145   5.128
  308   HG22  ILE  39          2HG2      ILE  39  -4.598  -7.617   4.318
  309   HG23  ILE  39          3HG2      ILE  39  -5.555  -6.940   5.636
  310   HD11  ILE  39          3HD1      ILE  39  -3.982  -3.660   3.557
  311   HD12  ILE  39          1HD1      ILE  39  -3.025  -4.307   2.225
  312   HD13  ILE  39          2HD1      ILE  39  -3.025  -5.125   3.787
  313    H    GLY  40           HN       GLY  40  -7.781  -6.991   0.891
  314    HA2  GLY  40           2HA      GLY  40  -8.437  -4.414   0.097
  315    HA3  GLY  40           1HA      GLY  40  -9.159  -5.872  -0.562
  316    HA   PRO  41           HA       PRO  41 -12.996  -4.893   1.391
  317    HB2  PRO  41           2HB      PRO  41 -13.394  -7.485   2.645
  318    HB3  PRO  41           1HB      PRO  41 -14.178  -6.814   1.216
  319    HG2  PRO  41           2HG      PRO  41 -12.436  -8.891   1.101
  320    HG3  PRO  41           1HG      PRO  41 -12.640  -7.730  -0.222
  321    HD2  PRO  41           2HD      PRO  41 -10.513  -7.849   1.886
  322    HD3  PRO  41           1HD      PRO  41 -10.357  -7.518   0.147
  323    H    LEU  42           HN       LEU  42 -10.384  -5.370   3.333
  324    HA   LEU  42           HA       LEU  42 -11.814  -5.229   5.857
  325    HB2  LEU  42           2HB      LEU  42  -8.870  -5.073   5.205
  326    HB3  LEU  42           1HB      LEU  42  -9.521  -4.979   6.830
  327    HG   LEU  42           HG       LEU  42  -9.702  -7.356   4.975
  328   HD11  LEU  42          1HD1      LEU  42  -8.176  -6.947   7.542
  329   HD12  LEU  42          2HD1      LEU  42  -7.478  -7.011   5.922
  330   HD13  LEU  42          3HD1      LEU  42  -8.251  -8.440   6.607
  331   HD21  LEU  42          3HD2      LEU  42 -10.701  -7.020   7.800
  332   HD22  LEU  42          1HD2      LEU  42 -10.710  -8.519   6.873
  333   HD23  LEU  42          2HD2      LEU  42 -11.704  -7.155   6.358
  334    H    SER  43           HN       SER  43 -11.621  -3.419   7.288
  335    HA   SER  43           HA       SER  43 -12.132  -0.961   6.025
  336    HB2  SER  43           2HB      SER  43 -12.974  -1.561   8.281
  337    HB3  SER  43           1HB      SER  43 -11.334  -1.443   8.905
  338    HG   SER  43           HG       SER  43 -13.121   0.562   8.162
  339    H    VAL  44           HN       VAL  44 -10.901   0.844   5.694
  340    HA   VAL  44           HA       VAL  44  -8.107   0.501   5.368
  341    HB   VAL  44           HB       VAL  44  -9.460   2.079   4.012
  342   HG11  VAL  44          1HG1      VAL  44 -10.874   3.003   5.772
  343   HG12  VAL  44          2HG1      VAL  44 -10.032   4.283   4.897
  344   HG13  VAL  44          3HG1      VAL  44  -9.471   3.792   6.496
  345   HG21  VAL  44          3HG2      VAL  44  -7.135   3.321   5.477
  346   HG22  VAL  44          1HG2      VAL  44  -7.806   3.897   3.952
  347   HG23  VAL  44          2HG2      VAL  44  -7.050   2.306   4.036
  348    H    GLN  45           HN       GLN  45 -10.072   1.476   8.014
  349    HA   GLN  45           HA       GLN  45  -7.964   2.780   9.489
  350    HB2  GLN  45           2HB      GLN  45 -10.533   3.158   9.662
  351    HB3  GLN  45           1HB      GLN  45 -10.524   1.722  10.676
  352    HG2  GLN  45           2HG      GLN  45  -8.780   4.090  11.256
  353    HG3  GLN  45           1HG      GLN  45 -10.443   3.991  11.820
  354   HE21  GLN  45          1HE2      GLN  45  -7.978   4.133  13.338
  355   HE22  GLN  45          2HE2      GLN  45  -7.940   2.727  14.348
  356    H    ASP  46           HN       ASP  46  -9.400  -0.410   9.246
  357    HA   ASP  46           HA       ASP  46  -8.128  -1.515  11.532
  358    HB2  ASP  46           2HB      ASP  46  -9.537  -2.655   9.155
  359    HB3  ASP  46           1HB      ASP  46  -8.578  -3.721  10.173
  360    H    VAL  47           HN       VAL  47  -7.090  -0.905   8.292
  361    HA   VAL  47           HA       VAL  47  -5.005  -2.722   7.998
  362    HB   VAL  47           HB       VAL  47  -5.062   0.154   7.050
  363   HG11  VAL  47          1HG1      VAL  47  -2.809  -0.793   6.984
  364   HG12  VAL  47          2HG1      VAL  47  -3.451  -0.584   5.354
  365   HG13  VAL  47          3HG1      VAL  47  -3.412  -2.188   6.089
  366   HG21  VAL  47          3HG2      VAL  47  -5.877  -0.794   4.933
  367   HG22  VAL  47          1HG2      VAL  47  -6.992  -1.112   6.260
  368   HG23  VAL  47          2HG2      VAL  47  -5.931  -2.392   5.675
  369    H    ASP  48           HN       ASP  48  -3.439  -3.122   9.361
  370    HA   ASP  48           HA       ASP  48  -2.056  -0.904  10.694
  371    HB2  ASP  48           2HB      ASP  48  -3.613  -1.849  12.309
  372    HB3  ASP  48           1HB      ASP  48  -3.026  -3.470  11.982
  373    H    THR  49           HN       THR  49  -0.039  -1.881  11.826
  374    HA   THR  49           HA       THR  49   1.786  -2.443   9.848
  375    HB   THR  49           HB       THR  49   2.286  -3.368  12.652
  376    HG1  THR  49           1HG      THR  49   1.398  -1.478  13.207
  377   HG21  THR  49          3HG2      THR  49   4.465  -2.319  12.260
  378   HG22  THR  49          1HG2      THR  49   3.923  -1.776  10.672
  379   HG23  THR  49          2HG2      THR  49   4.095  -3.500  11.003
  380    H    LYS  50           HN       LYS  50   0.319  -4.773  12.138
  381    HA   LYS  50           HA       LYS  50   1.916  -6.925  11.224
  382    HB2  LYS  50           2HB      LYS  50  -0.468  -6.684  13.024
  383    HB3  LYS  50           1HB      LYS  50   0.190  -8.241  12.582
  384    HG2  LYS  50           2HG      LYS  50   2.377  -7.548  13.489
  385    HG3  LYS  50           1HG      LYS  50   1.637  -6.032  14.008
  386    HD2  LYS  50           2HD      LYS  50   0.730  -8.772  14.886
  387    HD3  LYS  50           1HD      LYS  50   1.814  -7.732  15.810
  388    HE2  LYS  50           2HE      LYS  50   0.061  -6.016  15.906
  389    HE3  LYS  50           1HE      LYS  50  -1.017  -7.080  15.004
  390    HZ1  LYS  50           3HZ      LYS  50  -1.039  -8.627  16.785
  391    HZ2  LYS  50           1HZ      LYS  50  -1.344  -7.102  17.457
  392    HZ3  LYS  50           2HZ      LYS  50   0.188  -7.811  17.616
  393    H    LEU  51           HN       LEU  51  -1.343  -5.778  10.454
  394    HA   LEU  51           HA       LEU  51  -2.164  -7.986   8.925
  395    HB2  LEU  51           2HB      LEU  51  -2.869  -5.064   8.668
  396    HB3  LEU  51           1HB      LEU  51  -3.657  -6.341   7.773
  397    HG   LEU  51           HG       LEU  51  -3.747  -5.873  10.741
  398   HD11  LEU  51          1HD1      LEU  51  -6.151  -5.693  10.330
  399   HD12  LEU  51          2HD1      LEU  51  -5.871  -5.944   8.608
  400   HD13  LEU  51          3HD1      LEU  51  -5.243  -4.501   9.402
  401   HD21  LEU  51          3HD2      LEU  51  -3.517  -8.277  10.296
  402   HD22  LEU  51          1HD2      LEU  51  -4.887  -8.193   9.190
  403   HD23  LEU  51          2HD2      LEU  51  -5.123  -7.873  10.906
  404    H    ILE  52           HN       ILE  52  -0.362  -5.066   8.066
  405    HA   ILE  52           HA       ILE  52  -0.116  -5.600   5.310
  406    HB   ILE  52           HB       ILE  52   1.827  -4.115   7.098
  407   HG12  ILE  52          2HG1      ILE  52  -0.484  -3.065   5.442
  408   HG13  ILE  52          1HG1      ILE  52  -0.478  -3.220   7.196
  409   HG21  ILE  52          1HG2      ILE  52   1.448  -4.002   4.104
  410   HG22  ILE  52          2HG2      ILE  52   2.813  -4.732   4.952
  411   HG23  ILE  52          3HG2      ILE  52   2.547  -2.991   5.045
  412   HD11  ILE  52          3HD1      ILE  52   1.378  -1.469   5.601
  413   HD12  ILE  52          1HD1      ILE  52   1.296  -1.584   7.359
  414   HD13  ILE  52          2HD1      ILE  52  -0.067  -0.926   6.452
  415    H    MET  53           HN       MET  53   1.872  -6.505   8.092
  416    HA   MET  53           HA       MET  53   3.952  -7.763   6.701
  417    HB2  MET  53           2HB      MET  53   2.848  -8.240   9.466
  418    HB3  MET  53           1HB      MET  53   4.277  -9.057   8.853
  419    HG2  MET  53           2HG      MET  53   5.378  -6.895   8.547
  420    HG3  MET  53           1HG      MET  53   3.944  -6.084   9.172
  421    HE1  MET  53           3HE      MET  53   5.541  -4.823  10.911
  422    HE2  MET  53           1HE      MET  53   6.953  -5.711  10.327
  423    HE3  MET  53           2HE      MET  53   6.595  -5.659  12.052
  424    H    LYS  54           HN       LYS  54   0.831  -9.015   7.825
  425    HA   LYS  54           HA       LYS  54   1.298 -11.722   7.277
  426    HB2  LYS  54           2HB      LYS  54  -1.301 -10.188   7.204
  427    HB3  LYS  54           1HB      LYS  54  -1.181 -11.938   7.100
  428    HG2  LYS  54           2HG      LYS  54   0.089 -11.766   9.332
  429    HG3  LYS  54           1HG      LYS  54  -0.607 -10.146   9.424
  430    HD2  LYS  54           2HD      LYS  54  -2.110 -12.755   9.188
  431    HD3  LYS  54           1HD      LYS  54  -2.029 -11.711  10.607
  432    HE2  LYS  54           2HE      LYS  54  -3.164  -9.936   9.338
  433    HE3  LYS  54           1HE      LYS  54  -3.276 -11.011   7.946
  434    HZ1  LYS  54           3HZ      LYS  54  -4.590 -12.547   9.348
  435    HZ2  LYS  54           1HZ      LYS  54  -5.341 -11.040   9.133
  436    HZ3  LYS  54           2HZ      LYS  54  -4.566 -11.402  10.598
  437    H    VAL  55           HN       VAL  55   0.228  -9.101   5.195
  438    HA   VAL  55           HA       VAL  55  -0.370 -10.729   2.937
  439    HB   VAL  55           HB       VAL  55   0.413  -7.807   2.936
  440   HG11  VAL  55          1HG1      VAL  55  -0.886  -7.704   0.866
  441   HG12  VAL  55          2HG1      VAL  55  -1.171  -9.441   0.962
  442   HG13  VAL  55          3HG1      VAL  55   0.467  -8.829   0.733
  443   HG21  VAL  55          3HG2      VAL  55  -1.432  -8.156   4.472
  444   HG22  VAL  55          1HG2      VAL  55  -2.318  -9.048   3.235
  445   HG23  VAL  55          2HG2      VAL  55  -1.993  -7.328   3.020
  446    H    LEU  56           HN       LEU  56   2.454  -8.812   3.901
  447    HA   LEU  56           HA       LEU  56   3.865  -9.340   1.464
  448    HB2  LEU  56           2HB      LEU  56   4.823  -8.137   4.061
  449    HB3  LEU  56           1HB      LEU  56   5.718  -8.138   2.552
  450    HG   LEU  56           HG       LEU  56   3.079  -6.747   3.013
  451   HD11  LEU  56          1HD1      LEU  56   5.882  -5.664   2.778
  452   HD12  LEU  56          2HD1      LEU  56   4.884  -5.683   4.232
  453   HD13  LEU  56          3HD1      LEU  56   4.410  -4.693   2.852
  454   HD21  LEU  56          3HD2      LEU  56   3.514  -5.721   0.826
  455   HD22  LEU  56          1HD2      LEU  56   3.334  -7.472   0.707
  456   HD23  LEU  56          2HD2      LEU  56   4.939  -6.743   0.639
  457    H    ASP  57           HN       ASP  57   3.758 -10.830   4.611
  458    HA   ASP  57           HA       ASP  57   6.271 -11.938   4.830
  459    HB2  ASP  57           2HB      ASP  57   4.071 -12.053   6.342
  460    HB3  ASP  57           1HB      ASP  57   4.010 -13.666   5.658
  461    HA   PRO  58           HA       PRO  58   4.885 -15.859   2.274
  462    HB2  PRO  58           2HB      PRO  58   2.650 -14.796   0.681
  463    HB3  PRO  58           1HB      PRO  58   2.796 -16.344   1.516
  464    HG2  PRO  58           2HG      PRO  58   1.178 -14.364   2.379
  465    HG3  PRO  58           1HG      PRO  58   1.961 -15.513   3.477
  466    HD2  PRO  58           2HD      PRO  58   2.643 -12.668   2.916
  467    HD3  PRO  58           1HD      PRO  58   2.788 -13.597   4.411
  468    H    ILE  59           HN       ILE  59   4.387 -12.599   1.058
  469    HA   ILE  59           HA       ILE  59   5.119 -13.186  -1.635
  470    HB   ILE  59           HB       ILE  59   4.954 -10.503  -0.251
  471   HG12  ILE  59          2HG1      ILE  59   2.923 -12.001  -1.925
  472   HG13  ILE  59          1HG1      ILE  59   2.830 -11.735  -0.187
  473   HG21  ILE  59          1HG2      ILE  59   6.279 -10.373  -2.281
  474   HG22  ILE  59          2HG2      ILE  59   4.716  -9.590  -2.525
  475   HG23  ILE  59          3HG2      ILE  59   5.011 -11.198  -3.187
  476   HD11  ILE  59          3HD1      ILE  59   1.372 -10.222  -1.409
  477   HD12  ILE  59          1HD1      ILE  59   2.756  -9.594  -2.302
  478   HD13  ILE  59          2HD1      ILE  59   2.642  -9.339  -0.560
  479    H    TRP  60           HN       TRP  60   6.875 -12.062   1.202
  480    HA   TRP  60           HA       TRP  60   9.186 -11.064   0.040
  481    HB2  TRP  60           2HB      TRP  60   8.756 -12.548   2.623
  482    HB3  TRP  60           1HB      TRP  60  10.342 -11.955   2.155
  483    HD1  TRP  60           1HD      TRP  60   7.772 -10.999   4.378
  484    HE1  TRP  60           1HE      TRP  60   7.674  -8.457   4.770
  485    HE3  TRP  60           3HE      TRP  60  10.509  -9.452   0.346
  486    HZ2  TRP  60           2HZ      TRP  60   8.609  -6.111   3.520
  487    HZ3  TRP  60           3HZ      TRP  60  10.854  -7.038   0.015
  488    HH2  TRP  60           2HH      TRP  60   9.923  -5.403   1.572
  489    H    GLU  61           HN       GLU  61   8.133 -14.361   0.212
  490    HA   GLU  61           HA       GLU  61  10.706 -15.539  -0.101
  491    HB2  GLU  61           2HB      GLU  61   7.959 -16.703  -0.535
  492    HB3  GLU  61           1HB      GLU  61   9.448 -17.593  -0.327
  493    HG2  GLU  61           2HG      GLU  61   9.651 -16.698   1.953
  494    HG3  GLU  61           1HG      GLU  61   8.109 -15.870   1.731
  495    H    GLN  62           HN       GLN  62   8.035 -14.697  -2.265
  496    HA   GLN  62           HA       GLN  62   9.526 -15.846  -4.510
  497    HB2  GLN  62           2HB      GLN  62   6.607 -15.249  -4.106
  498    HB3  GLN  62           1HB      GLN  62   7.271 -15.577  -5.694
  499    HG2  GLN  62           2HG      GLN  62   6.427 -17.619  -4.988
  500    HG3  GLN  62           1HG      GLN  62   8.154 -17.752  -4.689
  501   HE21  GLN  62          1HE2      GLN  62   5.895 -15.939  -2.716
  502   HE22  GLN  62          2HE2      GLN  62   6.021 -16.935  -1.311
  503    H    LYS  63           HN       LYS  63   7.888 -12.881  -3.463
  504    HA   LYS  63           HA       LYS  63   9.031 -11.511  -5.819
  505    HB2  LYS  63           2HB      LYS  63   6.431 -10.687  -4.542
  506    HB3  LYS  63           1HB      LYS  63   7.058 -10.242  -6.119
  507    HG2  LYS  63           2HG      LYS  63   6.496 -13.109  -5.679
  508    HG3  LYS  63           1HG      LYS  63   5.108 -12.025  -5.758
  509    HD2  LYS  63           2HD      LYS  63   5.468 -12.799  -7.957
  510    HD3  LYS  63           1HD      LYS  63   6.082 -11.147  -7.918
  511    HE2  LYS  63           2HE      LYS  63   8.348 -11.960  -7.716
  512    HE3  LYS  63           1HE      LYS  63   7.772 -13.624  -7.626
  513    HZ1  LYS  63           3HZ      LYS  63   8.544 -13.151  -9.834
  514    HZ2  LYS  63           1HZ      LYS  63   7.522 -11.798  -9.953
  515    HZ3  LYS  63           2HZ      LYS  63   6.860 -13.355  -9.869
  516    HA   PRO  64           HA       PRO  64  10.291  -9.561  -1.729
  517    HB2  PRO  64           2HB      PRO  64  12.899  -9.323  -3.075
  518    HB3  PRO  64           1HB      PRO  64  12.514  -9.985  -1.485
  519    HG2  PRO  64           2HG      PRO  64  13.239 -11.559  -3.534
  520    HG3  PRO  64           1HG      PRO  64  12.061 -12.084  -2.316
  521    HD2  PRO  64           2HD      PRO  64  11.591 -11.089  -5.102
  522    HD3  PRO  64           1HD      PRO  64  10.779 -12.398  -4.219
  523    H    GLU  65           HN       GLU  65  11.565  -8.644  -4.917
  524    HA   GLU  65           HA       GLU  65  11.807  -5.904  -4.431
  525    HB2  GLU  65           2HB      GLU  65  12.836  -7.050  -6.336
  526    HB3  GLU  65           1HB      GLU  65  11.246  -7.317  -7.030
  527    HG2  GLU  65           2HG      GLU  65  10.947  -4.857  -7.154
  528    HG3  GLU  65           1HG      GLU  65  12.618  -4.677  -6.619
  529    H    THR  66           HN       THR  66   9.100  -7.804  -5.635
  530    HA   THR  66           HA       THR  66   7.481  -5.573  -6.346
  531    HB   THR  66           HB       THR  66   6.518  -8.362  -5.686
  532    HG1  THR  66           1HG      THR  66   7.905  -7.332  -7.928
  533   HG21  THR  66          3HG2      THR  66   5.460  -6.231  -7.555
  534   HG22  THR  66          1HG2      THR  66   4.750  -6.706  -6.013
  535   HG23  THR  66          2HG2      THR  66   4.783  -7.848  -7.355
  536    H    ALA  67           HN       ALA  67   7.708  -7.646  -3.482
  537    HA   ALA  67           HA       ALA  67   5.577  -6.519  -2.028
  538    HB1  ALA  67           1HB      ALA  67   6.674  -8.602  -1.353
  539    HB2  ALA  67           2HB      ALA  67   6.689  -7.426  -0.039
  540    HB3  ALA  67           3HB      ALA  67   8.149  -7.711  -0.983
  541    H    SER  68           HN       SER  68   8.975  -5.620  -2.339
  542    HA   SER  68           HA       SER  68   8.970  -3.483  -0.502
  543    HB2  SER  68           2HB      SER  68  10.679  -3.800  -2.988
  544    HB3  SER  68           1HB      SER  68  11.045  -2.794  -1.586
  545    HG   SER  68           HG       SER  68  10.869  -5.636  -1.670
  546    H    ARG  69           HN       ARG  69   8.334  -3.606  -4.007
  547    HA   ARG  69           HA       ARG  69   7.900  -0.865  -4.401
  548    HB2  ARG  69           2HB      ARG  69   6.671  -3.239  -5.809
  549    HB3  ARG  69           1HB      ARG  69   6.579  -1.592  -6.374
  550    HG2  ARG  69           2HG      ARG  69   9.130  -1.631  -6.399
  551    HG3  ARG  69           1HG      ARG  69   8.964  -3.379  -6.234
  552    HD2  ARG  69           2HD      ARG  69   7.379  -3.216  -8.256
  553    HD3  ARG  69           1HD      ARG  69   8.069  -1.611  -8.487
  554    HE   ARG  69           HE       ARG  69   9.825  -3.959  -8.353
  555   HH11  ARG  69          1HH1      ARG  69   8.558  -1.219 -10.166
  556   HH12  ARG  69          2HH1      ARG  69   9.628  -1.475 -11.512
  557   HH21  ARG  69          1HH2      ARG  69  11.208  -4.271 -10.115
  558   HH22  ARG  69          2HH2      ARG  69  11.153  -3.173 -11.468
  559    H    LEU  70           HN       LEU  70   5.734  -3.498  -3.508
  560    HA   LEU  70           HA       LEU  70   3.320  -2.086  -3.548
  561    HB2  LEU  70           2HB      LEU  70   3.607  -4.561  -3.432
  562    HB3  LEU  70           1HB      LEU  70   4.060  -4.391  -1.749
  563    HG   LEU  70           HG       LEU  70   1.823  -3.481  -1.244
  564   HD11  LEU  70          1HD1      LEU  70   1.318  -2.497  -3.413
  565   HD12  LEU  70          2HD1      LEU  70   0.058  -3.641  -2.944
  566   HD13  LEU  70          3HD1      LEU  70   1.266  -4.101  -4.144
  567   HD21  LEU  70          3HD2      LEU  70   0.601  -5.582  -1.530
  568   HD22  LEU  70          1HD2      LEU  70   2.259  -5.871  -1.002
  569   HD23  LEU  70          2HD2      LEU  70   1.812  -6.130  -2.689
  570    H    ARG  71           HN       ARG  71   5.735  -2.489  -1.004
  571    HA   ARG  71           HA       ARG  71   4.386  -1.416   1.158
  572    HB2  ARG  71           2HB      ARG  71   7.304  -1.226   0.413
  573    HB3  ARG  71           1HB      ARG  71   6.668  -0.724   1.963
  574    HG2  ARG  71           2HG      ARG  71   5.759  -3.120   2.136
  575    HG3  ARG  71           1HG      ARG  71   6.891  -3.472   0.829
  576    HD2  ARG  71           2HD      ARG  71   7.531  -2.385   3.564
  577    HD3  ARG  71           1HD      ARG  71   7.980  -3.955   2.904
  578    HE   ARG  71           HE       ARG  71   9.248  -2.420   1.199
  579   HH11  ARG  71          1HH1      ARG  71   8.925  -1.963   4.649
  580   HH12  ARG  71          2HH1      ARG  71  10.436  -1.122   4.820
  581   HH21  ARG  71          1HH2      ARG  71  11.254  -1.308   1.407
  582   HH22  ARG  71          2HH2      ARG  71  11.748  -0.743   2.977
  583    H    GLY  72           HN       GLY  72   6.227   0.249  -1.369
  584    HA2  GLY  72           2HA      GLY  72   6.007   2.850  -0.278
  585    HA3  GLY  72           1HA      GLY  72   6.368   2.464  -1.956
  586    H    ARG  73           HN       ARG  73   3.983   1.041  -2.535
  587    HA   ARG  73           HA       ARG  73   2.309   3.224  -3.214
  588    HB2  ARG  73           2HB      ARG  73   1.751   0.257  -3.353
  589    HB3  ARG  73           1HB      ARG  73   0.758   1.509  -4.088
  590    HG2  ARG  73           2HG      ARG  73   2.767   2.193  -5.414
  591    HG3  ARG  73           1HG      ARG  73   3.578   0.750  -4.802
  592    HD2  ARG  73           2HD      ARG  73   1.747  -0.624  -5.752
  593    HD3  ARG  73           1HD      ARG  73   1.048   0.842  -6.440
  594    HE   ARG  73           HE       ARG  73   3.781   0.446  -7.200
  595   HH11  ARG  73          1HH1      ARG  73   0.468  -0.383  -7.939
  596   HH12  ARG  73          2HH1      ARG  73   0.801  -0.834  -9.582
  597   HH21  ARG  73          1HH2      ARG  73   4.240  -0.120  -9.360
  598   HH22  ARG  73          2HH2      ARG  73   2.961  -0.681 -10.390
  599    H    ILE  74           HN       ILE  74   1.990   0.582  -0.857
  600    HA   ILE  74           HA       ILE  74  -0.515   1.342   0.184
  601    HB   ILE  74           HB       ILE  74   1.774  -0.043   1.609
  602   HG12  ILE  74          2HG1      ILE  74  -0.648  -1.192   0.198
  603   HG13  ILE  74          1HG1      ILE  74   0.993  -1.196  -0.441
  604   HG21  ILE  74          1HG2      ILE  74  -1.157   0.126   2.316
  605   HG22  ILE  74          2HG2      ILE  74   0.183   0.849   3.206
  606   HG23  ILE  74          3HG2      ILE  74   0.027  -0.905   3.119
  607   HD11  ILE  74          3HD1      ILE  74   0.425  -3.354   0.487
  608   HD12  ILE  74          1HD1      ILE  74   0.050  -2.612   2.041
  609   HD13  ILE  74          2HD1      ILE  74   1.707  -2.599   1.434
  610    H    GLU  75           HN       GLU  75   2.778   2.318   0.951
  611    HA   GLU  75           HA       GLU  75   2.303   3.842   3.236
  612    HB2  GLU  75           2HB      GLU  75   4.524   3.131   2.210
  613    HB3  GLU  75           1HB      GLU  75   4.346   4.479   1.099
  614    HG2  GLU  75           2HG      GLU  75   4.355   4.835   4.082
  615    HG3  GLU  75           1HG      GLU  75   5.828   4.827   3.117
  616    H    SER  76           HN       SER  76   2.287   4.837  -0.192
  617    HA   SER  76           HA       SER  76   1.722   7.549   0.351
  618    HB2  SER  76           2HB      SER  76   0.980   7.507  -2.132
  619    HB3  SER  76           1HB      SER  76   2.666   7.172  -1.742
  620    HG   SER  76           HG       SER  76   0.859   5.026  -1.886
  621    H    VAL  77           HN       VAL  77  -0.352   4.752  -0.123
  622    HA   VAL  77           HA       VAL  77  -2.768   6.237  -0.440
  623    HB   VAL  77           HB       VAL  77  -2.371   3.362   0.423
  624   HG11  VAL  77          1HG1      VAL  77  -4.718   3.035  -0.184
  625   HG12  VAL  77          2HG1      VAL  77  -4.873   4.756  -0.535
  626   HG13  VAL  77          3HG1      VAL  77  -4.561   4.217   1.116
  627   HG21  VAL  77          3HG2      VAL  77  -2.934   2.824  -1.895
  628   HG22  VAL  77          1HG2      VAL  77  -1.490   3.834  -1.804
  629   HG23  VAL  77          2HG2      VAL  77  -3.035   4.544  -2.271
  630    H    LEU  78           HN       LEU  78  -1.194   4.657   2.323
  631    HA   LEU  78           HA       LEU  78  -3.252   5.165   4.179
  632    HB2  LEU  78           2HB      LEU  78  -0.304   4.673   4.600
  633    HB3  LEU  78           1HB      LEU  78  -1.476   4.762   5.901
  634    HG   LEU  78           HG       LEU  78  -1.482   2.717   3.678
  635   HD11  LEU  78          1HD1      LEU  78  -0.910   1.135   5.454
  636   HD12  LEU  78          2HD1      LEU  78  -0.800   2.470   6.602
  637   HD13  LEU  78          3HD1      LEU  78   0.337   2.369   5.258
  638   HD21  LEU  78          3HD2      LEU  78  -3.241   2.985   6.114
  639   HD22  LEU  78          1HD2      LEU  78  -3.260   1.643   4.973
  640   HD23  LEU  78          2HD2      LEU  78  -3.739   3.254   4.445
  641    H    ASP  79           HN       ASP  79  -0.392   7.038   3.261
  642    HA   ASP  79           HA       ASP  79  -0.648   9.060   5.215
  643    HB2  ASP  79           2HB      ASP  79   1.378   8.796   3.836
  644    HB3  ASP  79           1HB      ASP  79   0.466   9.267   2.406
  645    H    TRP  80           HN       TRP  80  -1.926   8.758   1.937
  646    HA   TRP  80           HA       TRP  80  -3.179  11.240   1.722
  647    HB2  TRP  80           2HB      TRP  80  -2.870   9.795  -0.199
  648    HB3  TRP  80           1HB      TRP  80  -3.900   8.562   0.512
  649    HD1  TRP  80           1HD      TRP  80  -4.155  12.111  -1.002
  650    HE1  TRP  80           1HE      TRP  80  -6.531  12.393  -1.964
  651    HE3  TRP  80           3HE      TRP  80  -6.210   7.694   0.572
  652    HZ2  TRP  80           2HZ      TRP  80  -8.941  10.942  -2.038
  653    HZ3  TRP  80           3HZ      TRP  80  -8.557   7.225   0.010
  654    HH2  TRP  80           2HH      TRP  80  -9.892   8.817  -1.269
  655    H    ALA  81           HN       ALA  81  -4.549   8.125   2.805
  656    HA   ALA  81           HA       ALA  81  -7.119   9.138   3.373
  657    HB1  ALA  81           1HB      ALA  81  -6.635   6.747   3.082
  658    HB2  ALA  81           2HB      ALA  81  -7.478   7.072   4.597
  659    HB3  ALA  81           3HB      ALA  81  -5.744   6.753   4.605
  660    H    THR  82           HN       THR  82  -4.182   8.970   5.284
  661    HA   THR  82           HA       THR  82  -5.300   9.615   7.790
  662    HB   THR  82           HB       THR  82  -2.529  10.131   6.692
  663    HG1  THR  82           1HG      THR  82  -2.877   7.952   6.852
  664   HG21  THR  82          3HG2      THR  82  -3.003  11.634   8.572
  665   HG22  THR  82          1HG2      THR  82  -1.820  10.404   9.017
  666   HG23  THR  82          2HG2      THR  82  -3.492  10.252   9.553
  667    H    VAL  83           HN       VAL  83  -3.820  11.652   5.272
  668    HA   VAL  83           HA       VAL  83  -4.201  14.083   6.698
  669    HB   VAL  83           HB       VAL  83  -3.683  13.649   3.753
  670   HG11  VAL  83          1HG1      VAL  83  -2.887  15.973   3.750
  671   HG12  VAL  83          2HG1      VAL  83  -3.401  16.141   5.428
  672   HG13  VAL  83          3HG1      VAL  83  -4.597  15.862   4.165
  673   HG21  VAL  83          3HG2      VAL  83  -1.927  12.697   5.148
  674   HG22  VAL  83          1HG2      VAL  83  -1.767  14.228   6.014
  675   HG23  VAL  83          2HG2      VAL  83  -1.347  14.131   4.304
  676    H    ARG  84           HN       ARG  84  -6.025  12.369   4.218
  677    HA   ARG  84           HA       ARG  84  -7.887  14.470   3.753
  678    HB2  ARG  84           2HB      ARG  84  -8.053  11.510   3.186
  679    HB3  ARG  84           1HB      ARG  84  -9.270  12.665   2.677
  680    HG2  ARG  84           2HG      ARG  84  -6.461  12.334   1.713
  681    HG3  ARG  84           1HG      ARG  84  -7.961  12.386   0.788
  682    HD2  ARG  84           2HD      ARG  84  -6.524  14.674   2.115
  683    HD3  ARG  84           1HD      ARG  84  -6.805  14.430   0.394
  684    HE   ARG  84           HE       ARG  84  -9.312  14.569   1.428
  685   HH11  ARG  84          1HH1      ARG  84  -6.491  16.639   1.481
  686   HH12  ARG  84          2HH1      ARG  84  -7.394  18.091   1.796
  687   HH21  ARG  84          1HH2      ARG  84 -10.519  16.485   1.833
  688   HH22  ARG  84          2HH2      ARG  84  -9.686  18.011   1.975
  689    H    GLY  85           HN       GLY  85  -7.669  11.945   6.129
  690    HA2  GLY  85           2HA      GLY  85  -8.719  12.156   8.233
  691    HA3  GLY  85           1HA      GLY  85  -9.922  13.206   7.502
  692    H    TYR  86           HN       TYR  86  -8.946  10.025   6.303
  693    HA   TYR  86           HA       TYR  86 -11.711   9.129   6.621
  694    HB2  TYR  86           2HB      TYR  86  -9.339   7.859   5.247
  695    HB3  TYR  86           1HB      TYR  86 -10.918   7.096   5.372
  696    HD1  TYR  86           2HD      TYR  86 -12.917   8.346   4.340
  697    HD2  TYR  86           1HD      TYR  86  -8.863   9.311   3.494
  698    HE1  TYR  86           2HE      TYR  86 -13.623   9.488   2.279
  699    HE2  TYR  86           1HE      TYR  86  -9.555  10.441   1.427
  700    HH   TYR  86           HH       TYR  86 -11.425  10.390  -0.150
  701    H    ARG  87           HN       ARG  87  -8.671   8.856   8.151
  702    HA   ARG  87           HA       ARG  87  -9.727   7.172  10.219
  703    HB2  ARG  87           2HB      ARG  87  -7.995   5.399   9.990
  704    HB3  ARG  87           1HB      ARG  87  -9.156   5.405   8.669
  705    HG2  ARG  87           2HG      ARG  87  -7.616   6.186   7.138
  706    HG3  ARG  87           1HG      ARG  87  -6.577   6.877   8.383
  707    HD2  ARG  87           2HD      ARG  87  -7.012   3.916   8.030
  708    HD3  ARG  87           1HD      ARG  87  -5.689   4.805   7.275
  709    HE   ARG  87           HE       ARG  87  -5.489   5.452   9.912
  710   HH11  ARG  87          1HH1      ARG  87  -5.619   2.390   8.187
  711   HH12  ARG  87          2HH1      ARG  87  -4.599   1.570   9.333
  712   HH21  ARG  87          1HH2      ARG  87  -4.174   4.372  11.396
  713   HH22  ARG  87          2HH2      ARG  87  -3.786   2.699  11.156
  714    H    GLU  88           HN       GLU  88  -8.323   7.054  12.066
  715    HA   GLU  88           HA       GLU  88  -6.497   9.149  12.481
  716    HB2  GLU  88           2HB      GLU  88  -6.462   6.466  13.872
  717    HB3  GLU  88           1HB      GLU  88  -5.848   7.988  14.493
  718    HG2  GLU  88           2HG      GLU  88  -8.735   7.310  13.981
  719    HG3  GLU  88           1HG      GLU  88  -7.946   7.436  15.552
  720    H    GLY  89           HN       GLY  89  -4.143   9.106  12.486
  721    HA2  GLY  89           2HA      GLY  89  -3.270   7.191  10.417
  722    HA3  GLY  89           1HA      GLY  89  -3.057   8.915  10.202
  723    H    ASP  90           HN       ASP  90  -1.047   9.467  10.387
  724    HA   ASP  90           HA       ASP  90   1.171   9.176  10.459
  725    HB2  ASP  90           2HB      ASP  90   0.821   9.716  12.855
  726    HB3  ASP  90           1HB      ASP  90   0.753   7.994  13.191
  727    H    ASN  91           HN       ASN  91   2.292   7.771   9.388
  728    HA   ASN  91           HA       ASN  91   0.802   5.442   8.656
  729    HB2  ASN  91           2HB      ASN  91   2.204   7.098   7.208
  730    HB3  ASN  91           1HB      ASN  91   3.564   6.086   7.662
  731   HD21  ASN  91          1HD2      ASN  91   2.332   6.626   5.072
  732   HD22  ASN  91          2HD2      ASN  91   1.904   5.088   4.424
  733    HA   PRO  92           HA       PRO  92   3.298   2.509  10.991
  734    HB2  PRO  92           2HB      PRO  92   1.923   0.301  10.354
  735    HB3  PRO  92           1HB      PRO  92   1.253   1.520  11.443
  736    HG2  PRO  92           2HG      PRO  92   0.652   1.017   8.566
  737    HG3  PRO  92           1HG      PRO  92  -0.443   1.484   9.879
  738    HD2  PRO  92           2HD      PRO  92   0.642   3.216   7.993
  739    HD3  PRO  92           1HD      PRO  92  -0.048   3.698   9.553
  740    H    ALA  93           HN       ALA  93   2.903   2.739   7.612
  741    HA   ALA  93           HA       ALA  93   4.627   0.499   6.965
  742    HB1  ALA  93           1HB      ALA  93   2.782   1.112   5.466
  743    HB2  ALA  93           2HB      ALA  93   4.342   1.196   4.650
  744    HB3  ALA  93           3HB      ALA  93   3.543   2.677   5.179
  745    H    ARG  94           HN       ARG  94   5.201   3.390   8.287
  746    HA   ARG  94           HA       ARG  94   7.741   3.810   6.897
  747    HB2  ARG  94           2HB      ARG  94   6.349   5.533   8.940
  748    HB3  ARG  94           1HB      ARG  94   7.838   5.929   8.114
  749    HG2  ARG  94           2HG      ARG  94   6.710   5.998   5.991
  750    HG3  ARG  94           1HG      ARG  94   5.207   5.478   6.746
  751    HD2  ARG  94           2HD      ARG  94   5.164   7.545   8.067
  752    HD3  ARG  94           1HD      ARG  94   6.663   8.064   7.288
  753    HE   ARG  94           HE       ARG  94   5.075   7.595   5.177
  754   HH11  ARG  94          1HH1      ARG  94   4.456   9.430   8.120
  755   HH12  ARG  94          2HH1      ARG  94   3.353  10.523   7.326
  756   HH21  ARG  94          1HH2      ARG  94   3.663   8.969   4.181
  757   HH22  ARG  94          2HH2      ARG  94   2.895  10.263   5.068
  758    H    TRP  95           HN       TRP  95   9.410   2.870   7.717
  759    HA   TRP  95           HA       TRP  95   9.360   2.060  10.544
  760    HB2  TRP  95           2HB      TRP  95  10.374   0.674   8.086
  761    HB3  TRP  95           1HB      TRP  95  11.040   0.279   9.668
  762    HD1  TRP  95           1HD      TRP  95   9.092  -0.456  11.546
  763    HE1  TRP  95           1HE      TRP  95   7.071  -2.004  11.184
  764    HE3  TRP  95           3HE      TRP  95   8.726  -0.140   6.464
  765    HZ2  TRP  95           2HZ      TRP  95   5.510  -2.948   9.037
  766    HZ3  TRP  95           3HZ      TRP  95   6.937  -1.391   5.333
  767    HH2  TRP  95           2HH      TRP  95   5.363  -2.766   6.594
  768    H    ARG  96           HN       ARG  96  11.154   2.329  11.788
  769    HA   ARG  96           HA       ARG  96  13.210   4.130  10.940
  770    HB2  ARG  96           2HB      ARG  96  13.119   2.330  13.374
  771    HB3  ARG  96           1HB      ARG  96  14.171   3.713  13.142
  772    HG2  ARG  96           2HG      ARG  96  11.171   3.834  13.360
  773    HG3  ARG  96           1HG      ARG  96  12.309   4.189  14.658
  774    HD2  ARG  96           2HD      ARG  96  13.290   5.962  13.165
  775    HD3  ARG  96           1HD      ARG  96  11.928   5.693  12.078
  776    HE   ARG  96           HE       ARG  96  10.640   6.168  14.341
  777   HH11  ARG  96          1HH1      ARG  96  13.333   7.871  12.868
  778   HH12  ARG  96          2HH1      ARG  96  12.970   9.374  13.666
  779   HH21  ARG  96          1HH2      ARG  96  10.172   8.128  15.392
  780   HH22  ARG  96          2HH2      ARG  96  11.190   9.517  15.113
  781    H    GLY  97           HN       GLY  97  12.642   0.774  10.855
  782    HA2  GLY  97           2HA      GLY  97  14.667   0.083   9.127
  783    HA3  GLY  97           1HA      GLY  97  15.322  -0.174  10.741
  784    H    TYR  98           HN       TYR  98  12.959  -1.204   8.397
  785    HA   TYR  98           HA       TYR  98  11.353  -2.923   9.843
  786    HB2  TYR  98           2HB      TYR  98  11.073  -2.322   7.438
  787    HB3  TYR  98           1HB      TYR  98  12.409  -3.394   7.042
  788    HD1  TYR  98           1HD      TYR  98   9.069  -3.437   8.716
  789    HD2  TYR  98           2HD      TYR  98  11.944  -5.589   6.438
  790    HE1  TYR  98           1HE      TYR  98   7.477  -5.291   8.467
  791    HE2  TYR  98           2HE      TYR  98  10.358  -7.453   6.186
  792    HH   TYR  98           HH       TYR  98   8.355  -8.360   7.386
  793    H    LEU  99           HN       LEU  99  14.344  -3.803   8.104
  794    HA   LEU  99           HA       LEU  99  14.674  -6.021  10.011
  795    HB2  LEU  99           2HB      LEU  99  15.801  -5.708   7.227
  796    HB3  LEU  99           1HB      LEU  99  16.078  -7.068   8.288
  797    HG   LEU  99           HG       LEU  99  13.413  -6.286   7.109
  798   HD11  LEU  99          1HD1      LEU  99  14.912  -7.185   5.428
  799   HD12  LEU  99          2HD1      LEU  99  13.653  -8.359   5.814
  800   HD13  LEU  99          3HD1      LEU  99  15.277  -8.564   6.466
  801   HD21  LEU  99          3HD2      LEU  99  14.180  -8.677   8.774
  802   HD22  LEU  99          1HD2      LEU  99  12.608  -8.395   8.028
  803   HD23  LEU  99          2HD2      LEU  99  13.182  -7.326   9.310
  804    H    GLU 100           HN       GLU 100  15.900  -3.081   8.795
  805    HA   GLU 100           HA       GLU 100  18.654  -3.520   9.544
  806    HB2  GLU 100           2HB      GLU 100  17.483  -0.826   8.930
  807    HB3  GLU 100           1HB      GLU 100  19.107  -1.418   8.623
  808    HG2  GLU 100           2HG      GLU 100  18.271  -1.416   6.511
  809    HG3  GLU 100           1HG      GLU 100  17.847  -3.056   6.999
  810    H    HIS 101           HN       HIS 101  16.494  -3.591  11.658
  811    HA   HIS 101           HA       HIS 101  16.802  -1.219  13.203
  812    HB2  HIS 101           2HB      HIS 101  15.621  -2.374  14.989
  813    HB3  HIS 101           1HB      HIS 101  14.803  -2.607  13.454
  814    HD1  HIS 101           1HD      HIS 101  17.000  -4.497  15.911
  815    HD2  HIS 101           2HD      HIS 101  14.342  -5.217  12.788
  816    HE1  HIS 101           1HE      HIS 101  16.600  -6.974  15.919
  817    HE2  HIS 101           2HE      HIS 101  14.791  -7.339  14.206
  818    H    HIS 102           HN       HIS 102  18.853  -3.825  12.675
  819    HA   HIS 102           HA       HIS 102  20.199  -3.501  15.256
  820    HB2  HIS 102           2HB      HIS 102  19.835  -5.810  14.368
  821    HB3  HIS 102           1HB      HIS 102  20.884  -5.413  13.009
  822    HD1  HIS 102           1HD      HIS 102  23.444  -5.180  13.508
  823    HD2  HIS 102           2HD      HIS 102  21.136  -6.326  16.778
  824    HE1  HIS 102           1HE      HIS 102  25.075  -5.991  15.241
  825    HE2  HIS 102           2HE      HIS 102  23.675  -6.443  17.288
  826    H    HIS 103           HN       HIS 103  21.082  -1.498  15.053
  827    HA   HIS 103           HA       HIS 103  22.624   0.072  14.582
  828    HB2  HIS 103           2HB      HIS 103  24.073  -1.894  15.283
  829    HB3  HIS 103           1HB      HIS 103  24.383  -2.155  13.569
  830    HD1  HIS 103           1HD      HIS 103  26.452  -1.054  12.759
  831    HD2  HIS 103           2HD      HIS 103  24.791   0.947  16.009
  832    HE1  HIS 103           1HE      HIS 103  28.009   0.860  13.250
  833    HE2  HIS 103           2HE      HIS 103  26.917   2.132  15.135
  834    H    HIS 104           HN       HIS 104  21.400   1.040  12.941
  835    HA   HIS 104           HA       HIS 104  22.442   0.560  10.226
  836    HB2  HIS 104           2HB      HIS 104  20.408   1.672   9.383
  837    HB3  HIS 104           1HB      HIS 104  20.018   0.252  10.344
  838    HD1  HIS 104           1HD      HIS 104  19.730   3.991  10.344
  839    HD2  HIS 104           2HD      HIS 104  18.613   0.755  12.703
  840    HE1  HIS 104           1HE      HIS 104  18.094   4.907  12.020
  841    HE2  HIS 104           2HE      HIS 104  17.304   2.895  13.325
  842    H    HIS 105           HN       HIS 105  22.709   2.526   8.881
  843    HA   HIS 105           HA       HIS 105  24.142   4.532  10.339
  844    HB2  HIS 105           2HB      HIS 105  24.403   3.638   7.841
  845    HB3  HIS 105           1HB      HIS 105  23.313   4.977   7.502
  846    HD1  HIS 105           1HD      HIS 105  24.374   7.251   7.274
  847    HD2  HIS 105           2HD      HIS 105  26.883   4.495   9.131
  848    HE1  HIS 105           1HE      HIS 105  26.599   8.397   7.499
  849    HE2  HIS 105           2HE      HIS 105  28.119   6.703   8.582
  850    H    HIS 106           HN       HIS 106  23.539   6.616  10.805
  851    HA   HIS 106           HA       HIS 106  20.754   7.048  11.196
  852    HB2  HIS 106           2HB      HIS 106  22.377   7.923  12.778
  853    HB3  HIS 106           1HB      HIS 106  23.111   8.912  11.522
  854    HD1  HIS 106           1HD      HIS 106  19.885   8.621  13.497
  855    HD2  HIS 106           2HD      HIS 106  21.989  11.385  11.205
  856    HE1  HIS 106           1HE      HIS 106  18.645  10.798  13.747
  857    HE2  HIS 106           2HE      HIS 106  19.866  12.425  12.254
  Start of MODEL   16
    1    H1   MET   1           H1       MET   1 -16.878   2.749   4.234
    2    H2   MET   1           H2       MET   1 -15.928   1.852   5.318
    3    H3   MET   1           H3       MET   1 -16.719   1.073   4.036
    4    HA   MET   1           HA       MET   1 -15.369   2.175   2.431
    5    HB2  MET   1           2HB      MET   1 -15.033   4.285   3.656
    6    HB3  MET   1           1HB      MET   1 -14.018   3.450   4.826
    7    HG2  MET   1           2HG      MET   1 -12.580   4.588   3.305
    8    HG3  MET   1           1HG      MET   1 -12.470   2.866   2.966
    9    HE1  MET   1           2HE      MET   1 -14.009   6.294   1.820
   10    HE2  MET   1           3HE      MET   1 -15.430   5.262   1.970
   11    HE3  MET   1           1HE      MET   1 -14.908   5.818   0.379
   12    H    THR   2           HN       THR   2 -14.067   0.665   1.664
   13    HA   THR   2           HA       THR   2 -12.530  -0.968   3.559
   14    HB   THR   2           HB       THR   2 -12.264  -2.571   1.671
   15    HG1  THR   2           1HG      THR   2 -14.236  -1.022   0.312
   16   HG21  THR   2          3HG2      THR   2 -14.581  -3.388   1.662
   17   HG22  THR   2          1HG2      THR   2 -15.125  -1.843   2.319
   18   HG23  THR   2          2HG2      THR   2 -14.077  -2.888   3.277
   19    H    PHE   3           HN       PHE   3 -10.366  -1.719   2.661
   20    HA   PHE   3           HA       PHE   3  -8.730   0.525   2.241
   21    HB2  PHE   3           2HB      PHE   3  -7.933  -1.560   3.284
   22    HB3  PHE   3           1HB      PHE   3  -8.092  -2.394   1.742
   23    HD1  PHE   3           1HD      PHE   3  -6.326   0.415   3.401
   24    HD2  PHE   3           2HD      PHE   3  -6.322  -2.431   0.241
   25    HE1  PHE   3           1HE      PHE   3  -4.022   1.057   2.838
   26    HE2  PHE   3           2HE      PHE   3  -4.011  -1.798  -0.327
   27    HZ   PHE   3           HZ       PHE   3  -2.861  -0.051   0.973
   28    H    SER   4           HN       SER   4  -9.979  -1.919   0.008
   29    HA   SER   4           HA       SER   4  -8.602  -1.109  -2.284
   30    HB2  SER   4           2HB      SER   4 -11.405  -2.241  -2.181
   31    HB3  SER   4           1HB      SER   4 -10.273  -2.331  -3.531
   32    HG   SER   4           HG       SER   4 -10.067  -4.254  -2.519
   33    H    GLU   5           HN       GLU   5 -11.713  -0.024  -0.968
   34    HA   GLU   5           HA       GLU   5 -12.404   1.663  -3.120
   35    HB2  GLU   5           2HB      GLU   5 -13.236   1.674  -0.220
   36    HB3  GLU   5           1HB      GLU   5 -13.963   2.688  -1.451
   37    HG2  GLU   5           2HG      GLU   5 -14.749   0.763  -2.646
   38    HG3  GLU   5           1HG      GLU   5 -13.919  -0.311  -1.522
   39    H    CYS   6           HN       CYS   6 -10.817   2.284  -0.021
   40    HA   CYS   6           HA       CYS   6 -10.613   5.091  -0.349
   41    HB2  CYS   6           2HB      CYS   6 -10.365   3.724   1.796
   42    HB3  CYS   6           1HB      CYS   6  -8.728   3.388   1.280
   43    HG   CYS   6           HG       CYS   6  -8.395   6.359   1.007
   44    H    ALA   7           HN       ALA   7  -8.413   2.417  -1.016
   45    HA   ALA   7           HA       ALA   7  -6.263   3.897  -2.046
   46    HB1  ALA   7           1HB      ALA   7  -6.130   1.497  -1.561
   47    HB2  ALA   7           2HB      ALA   7  -5.617   1.849  -3.211
   48    HB3  ALA   7           3HB      ALA   7  -7.214   1.165  -2.912
   49    H    ALA   8           HN       ALA   8  -9.174   2.646  -3.627
   50    HA   ALA   8           HA       ALA   8  -8.578   3.466  -6.240
   51    HB1  ALA   8           1HB      ALA   8 -10.361   1.885  -5.733
   52    HB2  ALA   8           2HB      ALA   8 -10.978   3.248  -6.667
   53    HB3  ALA   8           3HB      ALA   8 -11.279   3.159  -4.932
   54    H    LEU   9           HN       LEU   9 -10.017   5.203  -3.524
   55    HA   LEU   9           HA       LEU   9 -10.834   7.504  -4.913
   56    HB2  LEU   9           2HB      LEU   9  -9.778   7.287  -2.088
   57    HB3  LEU   9           1HB      LEU   9 -10.639   8.659  -2.741
   58    HG   LEU   9           HG       LEU   9 -11.804   5.897  -2.405
   59   HD11  LEU   9          1HD1      LEU   9 -12.204   8.426  -0.811
   60   HD12  LEU   9          2HD1      LEU   9 -11.387   6.964  -0.262
   61   HD13  LEU   9          3HD1      LEU   9 -13.117   6.930  -0.607
   62   HD21  LEU   9          3HD2      LEU   9 -13.929   6.996  -2.919
   63   HD22  LEU   9          1HD2      LEU   9 -12.797   7.123  -4.265
   64   HD23  LEU   9          2HD2      LEU   9 -13.076   8.511  -3.213
   65    H    TYR  10           HN       TYR  10  -7.787   6.768  -3.259
   66    HA   TYR  10           HA       TYR  10  -6.394   9.116  -3.844
   67    HB2  TYR  10           2HB      TYR  10  -5.608   7.462  -2.224
   68    HB3  TYR  10           1HB      TYR  10  -5.374   6.284  -3.504
   69    HD1  TYR  10           2HD      TYR  10  -4.227   9.684  -2.462
   70    HD2  TYR  10           1HD      TYR  10  -3.267   6.042  -4.446
   71    HE1  TYR  10           2HE      TYR  10  -1.908  10.449  -2.737
   72    HE2  TYR  10           1HE      TYR  10  -0.941   6.799  -4.720
   73    HH   TYR  10           HH       TYR  10   0.292   8.959  -4.808
   74    H    ILE  11           HN       ILE  11  -6.659   6.096  -5.620
   75    HA   ILE  11           HA       ILE  11  -4.835   6.783  -7.678
   76    HB   ILE  11           HB       ILE  11  -7.013   4.696  -7.572
   77   HG12  ILE  11          2HG1      ILE  11  -4.013   4.446  -7.274
   78   HG13  ILE  11          1HG1      ILE  11  -5.144   4.503  -5.929
   79   HG21  ILE  11          1HG2      ILE  11  -4.784   5.003  -9.582
   80   HG22  ILE  11          2HG2      ILE  11  -6.504   5.240  -9.892
   81   HG23  ILE  11          3HG2      ILE  11  -5.895   3.639  -9.472
   82   HD11  ILE  11          3HD1      ILE  11  -4.438   2.230  -6.435
   83   HD12  ILE  11          1HD1      ILE  11  -5.081   2.393  -8.068
   84   HD13  ILE  11          2HD1      ILE  11  -6.172   2.442  -6.682
   85    H    LYS  12           HN       LYS  12  -8.416   6.776  -7.585
   86    HA   LYS  12           HA       LYS  12  -8.675   7.586 -10.299
   87    HB2  LYS  12           2HB      LYS  12 -10.620   7.561  -8.001
   88    HB3  LYS  12           1HB      LYS  12 -11.066   8.109  -9.609
   89    HG2  LYS  12           2HG      LYS  12 -10.407   5.892 -10.498
   90    HG3  LYS  12           1HG      LYS  12 -10.114   5.358  -8.841
   91    HD2  LYS  12           2HD      LYS  12 -12.747   6.428  -9.844
   92    HD3  LYS  12           1HD      LYS  12 -12.348   4.711  -9.748
   93    HE2  LYS  12           2HE      LYS  12 -12.080   4.869  -7.355
   94    HE3  LYS  12           1HE      LYS  12 -12.328   6.615  -7.407
   95    HZ1  LYS  12           3HZ      LYS  12 -14.372   4.674  -8.325
   96    HZ2  LYS  12           1HZ      LYS  12 -14.573   6.331  -8.009
   97    HZ3  LYS  12           2HZ      LYS  12 -14.300   5.246  -6.730
   98    H    ALA  13           HN       ALA  13  -8.513   9.350  -7.257
   99    HA   ALA  13           HA       ALA  13  -9.372  11.843  -8.324
  100    HB1  ALA  13           1HB      ALA  13  -7.701  11.301  -5.871
  101    HB2  ALA  13           2HB      ALA  13  -9.463  11.359  -5.931
  102    HB3  ALA  13           3HB      ALA  13  -8.520  12.814  -6.256
  103    H    HIS  14           HN       HIS  14  -6.582  10.105  -8.898
  104    HA   HIS  14           HA       HIS  14  -5.207  12.543  -9.815
  105    HB2  HIS  14           2HB      HIS  14  -3.920  10.171  -8.439
  106    HB3  HIS  14           1HB      HIS  14  -3.033  11.468  -9.231
  107    HD1  HIS  14           1HD      HIS  14  -4.652  10.538  -6.077
  108    HD2  HIS  14           2HD      HIS  14  -3.262  14.010  -7.898
  109    HE1  HIS  14           1HE      HIS  14  -4.477  12.248  -4.237
  110    HE2  HIS  14           2HE      HIS  14  -3.648  14.350  -5.359
  111    H    ARG  15           HN       ARG  15  -6.810  10.054 -10.944
  112    HA   ARG  15           HA       ARG  15  -4.929   8.507 -12.365
  113    HB2  ARG  15           2HB      ARG  15  -6.765   7.483 -13.483
  114    HB3  ARG  15           1HB      ARG  15  -7.248   7.774 -11.822
  115    HG2  ARG  15           2HG      ARG  15  -8.577   9.678 -12.510
  116    HG3  ARG  15           1HG      ARG  15  -8.034   9.478 -14.180
  117    HD2  ARG  15           2HD      ARG  15  -9.014   7.178 -14.134
  118    HD3  ARG  15           1HD      ARG  15  -9.696   7.558 -12.555
  119    HE   ARG  15           HE       ARG  15 -10.674   9.556 -14.048
  120   HH11  ARG  15          1HH1      ARG  15 -10.474   6.123 -14.682
  121   HH12  ARG  15          2HH1      ARG  15 -11.940   6.060 -15.599
  122   HH21  ARG  15          1HH2      ARG  15 -12.615   9.490 -15.287
  123   HH22  ARG  15          2HH2      ARG  15 -13.169   7.976 -15.933
  124    H    SER  16           HN       SER  16  -6.735  11.403 -13.269
  125    HA   SER  16           HA       SER  16  -5.922  11.389 -15.985
  126    HB2  SER  16           2HB      SER  16  -6.854  13.694 -14.263
  127    HB3  SER  16           1HB      SER  16  -6.850  13.629 -16.020
  128    HG   SER  16           HG       SER  16  -8.882  13.084 -14.746
  129    H    SER  17           HN       SER  17  -4.509  12.442 -13.015
  130    HA   SER  17           HA       SER  17  -2.520  14.107 -14.277
  131    HB2  SER  17           2HB      SER  17  -2.771  13.192 -11.405
  132    HB3  SER  17           1HB      SER  17  -1.757  14.495 -12.007
  133    HG   SER  17           HG       SER  17  -3.699  15.563 -12.685
  134    H    TRP  18           HN       TRP  18  -2.937  10.819 -13.645
  135    HA   TRP  18           HA       TRP  18  -0.106  10.292 -13.249
  136    HB2  TRP  18           2HB      TRP  18  -2.581   8.635 -12.968
  137    HB3  TRP  18           1HB      TRP  18  -1.009   7.852 -13.119
  138    HD1  TRP  18           1HD      TRP  18  -0.146  10.821 -11.342
  139    HE1  TRP  18           1HE      TRP  18  -0.128  10.476  -8.792
  140    HE3  TRP  18           3HE      TRP  18  -2.780   6.457 -11.100
  141    HZ2  TRP  18           2HZ      TRP  18  -1.098   8.597  -6.926
  142    HZ3  TRP  18           3HZ      TRP  18  -3.187   5.447  -8.897
  143    HH2  TRP  18           2HH      TRP  18  -2.366   6.495  -6.853
  144    H    LYS  19           HN       LYS  19  -1.163  11.262 -15.821
  145    HA   LYS  19           HA       LYS  19  -0.471   9.224 -17.707
  146    HB2  LYS  19           2HB      LYS  19  -0.433  12.250 -17.930
  147    HB3  LYS  19           1HB      LYS  19  -0.215  11.140 -19.276
  148    HG2  LYS  19           2HG      LYS  19  -2.477  10.322 -19.010
  149    HG3  LYS  19           1HG      LYS  19  -2.705  11.342 -17.591
  150    HD2  LYS  19           2HD      LYS  19  -2.101  12.378 -20.363
  151    HD3  LYS  19           1HD      LYS  19  -3.719  12.269 -19.666
  152    HE2  LYS  19           2HE      LYS  19  -3.013  13.761 -17.842
  153    HE3  LYS  19           1HE      LYS  19  -1.421  13.898 -18.585
  154    HZ1  LYS  19           3HZ      LYS  19  -3.947  14.686 -19.930
  155    HZ2  LYS  19           1HZ      LYS  19  -2.368  14.973 -20.477
  156    HZ3  LYS  19           2HZ      LYS  19  -2.948  15.765 -19.090
  157    H    ASN  20           HN       ASN  20   2.867   9.264 -17.615
  158    HA   ASN  20           HA       ASN  20   0.752   9.434 -19.553
  159    HB2  ASN  20           2HB      ASN  20   2.970   9.918 -20.405
  160    HB3  ASN  20           1HB      ASN  20   3.588   8.403 -19.756
  161   HD21  ASN  20          1HD2      ASN  20   1.675   9.889 -22.246
  162   HD22  ASN  20          2HD2      ASN  20   1.599   8.510 -23.290
  163    H    THR  21           HN       THR  21  -0.551   7.880 -19.870
  164    HA   THR  21           HA       THR  21  -1.527   5.893 -20.194
  165    HB   THR  21           HB       THR  21  -0.036   3.797 -20.237
  166    HG1  THR  21           1HG      THR  21   2.074   5.639 -20.545
  167   HG21  THR  21          3HG2      THR  21   0.790   4.386 -22.467
  168   HG22  THR  21          1HG2      THR  21   0.410   6.076 -22.142
  169   HG23  THR  21          2HG2      THR  21  -0.885   4.880 -22.216
  170    H    LYS  22           HN       LYS  22  -0.883   3.308 -19.012
  171    HA   LYS  22           HA       LYS  22  -2.869   3.659 -17.025
  172    HB2  LYS  22           2HB      LYS  22  -1.388   1.227 -17.980
  173    HB3  LYS  22           1HB      LYS  22  -2.676   1.183 -16.791
  174    HG2  LYS  22           2HG      LYS  22  -4.017   2.448 -18.654
  175    HG3  LYS  22           1HG      LYS  22  -2.806   1.717 -19.711
  176    HD2  LYS  22           2HD      LYS  22  -4.618   0.255 -17.789
  177    HD3  LYS  22           1HD      LYS  22  -4.764   0.282 -19.546
  178    HE2  LYS  22           2HE      LYS  22  -2.775  -0.955 -19.826
  179    HE3  LYS  22           1HE      LYS  22  -2.306  -0.731 -18.142
  180    HZ1  LYS  22           3HZ      LYS  22  -4.737  -2.221 -18.958
  181    HZ2  LYS  22           1HZ      LYS  22  -4.009  -2.183 -17.424
  182    HZ3  LYS  22           2HZ      LYS  22  -3.233  -2.964 -18.720
  183    H    HIS  23           HN       HIS  23  -0.351   4.800 -16.158
  184    HA   HIS  23           HA       HIS  23   0.901   3.282 -14.178
  185    HB2  HIS  23           2HB      HIS  23   0.334   6.233 -14.368
  186    HB3  HIS  23           1HB      HIS  23   1.189   5.550 -12.990
  187    HD1  HIS  23           1HD      HIS  23   3.320   6.910 -13.686
  188    HD2  HIS  23           2HD      HIS  23   2.040   4.111 -16.487
  189    HE1  HIS  23           1HE      HIS  23   5.239   6.617 -15.287
  190    HE2  HIS  23           2HE      HIS  23   4.355   5.082 -17.082
  191    H    ALA  24           HN       ALA  24  -2.204   4.952 -14.119
  192    HA   ALA  24           HA       ALA  24  -2.735   4.544 -11.356
  193    HB1  ALA  24           1HB      ALA  24  -3.916   6.222 -12.696
  194    HB2  ALA  24           2HB      ALA  24  -5.041   5.115 -11.910
  195    HB3  ALA  24           3HB      ALA  24  -4.684   4.938 -13.629
  196    H    ASP  25           HN       ASP  25  -3.423   2.658 -14.265
  197    HA   ASP  25           HA       ASP  25  -5.046   0.691 -13.023
  198    HB2  ASP  25           2HB      ASP  25  -4.985   1.029 -15.465
  199    HB3  ASP  25           1HB      ASP  25  -3.329   0.450 -15.507
  200    H    GLN  26           HN       GLN  26  -1.609   0.973 -13.649
  201    HA   GLN  26           HA       GLN  26  -0.750  -1.513 -12.736
  202    HB2  GLN  26           2HB      GLN  26   0.579   1.196 -12.608
  203    HB3  GLN  26           1HB      GLN  26   1.395  -0.307 -12.238
  204    HG2  GLN  26           2HG      GLN  26   1.026  -1.091 -14.513
  205    HG3  GLN  26           1HG      GLN  26   0.162   0.400 -14.887
  206   HE21  GLN  26          1HE2      GLN  26   1.598   0.945 -16.508
  207   HE22  GLN  26          2HE2      GLN  26   3.206   1.504 -16.181
  208    H    TRP  27           HN       TRP  27  -1.255   1.520 -10.948
  209    HA   TRP  27           HA       TRP  27  -0.526   0.557  -8.406
  210    HB2  TRP  27           2HB      TRP  27  -2.191   2.829  -9.400
  211    HB3  TRP  27           1HB      TRP  27  -2.242   2.429  -7.688
  212    HD1  TRP  27           1HD      TRP  27   0.480   3.255 -10.351
  213    HE1  TRP  27           1HE      TRP  27   2.331   4.605  -9.175
  214    HE3  TRP  27           3HE      TRP  27  -1.372   3.193  -5.587
  215    HZ2  TRP  27           2HZ      TRP  27   2.923   5.523  -6.574
  216    HZ3  TRP  27           3HZ      TRP  27  -0.106   4.334  -3.817
  217    HH2  TRP  27           2HH      TRP  27   1.996   5.477  -4.303
  218    H    THR  28           HN       THR  28  -3.717   0.823  -9.938
  219    HA   THR  28           HA       THR  28  -5.235  -0.186  -7.809
  220    HB   THR  28           HB       THR  28  -5.910  -0.474 -10.745
  221    HG1  THR  28           1HG      THR  28  -5.372   1.700 -10.296
  222   HG21  THR  28          3HG2      THR  28  -8.222  -0.327  -9.965
  223   HG22  THR  28          1HG2      THR  28  -7.660  -0.169  -8.300
  224   HG23  THR  28          2HG2      THR  28  -7.389  -1.671  -9.183
  225    H    ASN  29           HN       ASN  29  -3.860  -1.807 -10.633
  226    HA   ASN  29           HA       ASN  29  -5.089  -4.303 -10.227
  227    HB2  ASN  29           2HB      ASN  29  -3.965  -3.316 -12.328
  228    HB3  ASN  29           1HB      ASN  29  -2.458  -3.905 -11.640
  229   HD21  ASN  29          1HD2      ASN  29  -3.998  -4.599 -14.068
  230   HD22  ASN  29          2HD2      ASN  29  -4.180  -6.316 -14.005
  231    H    THR  30           HN       THR  30  -1.823  -3.155  -9.371
  232    HA   THR  30           HA       THR  30  -0.926  -5.645  -8.393
  233    HB   THR  30           HB       THR  30   0.830  -4.257  -7.199
  234    HG1  THR  30           1HG      THR  30  -0.106  -2.073  -8.727
  235   HG21  THR  30          3HG2      THR  30   0.436  -3.795 -10.161
  236   HG22  THR  30          1HG2      THR  30   1.201  -5.202  -9.425
  237   HG23  THR  30          2HG2      THR  30   1.955  -3.615  -9.285
  238    H    ILE  31           HN       ILE  31  -2.134  -2.771  -6.666
  239    HA   ILE  31           HA       ILE  31  -1.893  -3.841  -4.083
  240    HB   ILE  31           HB       ILE  31  -3.798  -1.722  -5.098
  241   HG12  ILE  31          2HG1      ILE  31  -1.123  -1.485  -3.690
  242   HG13  ILE  31          1HG1      ILE  31  -1.392  -1.209  -5.406
  243   HG21  ILE  31          1HG2      ILE  31  -3.007  -2.388  -2.261
  244   HG22  ILE  31          2HG2      ILE  31  -4.589  -2.665  -2.994
  245   HG23  ILE  31          3HG2      ILE  31  -4.000  -1.018  -2.762
  246   HD11  ILE  31          3HD1      ILE  31  -2.566   0.395  -3.150
  247   HD12  ILE  31          1HD1      ILE  31  -2.872   0.665  -4.864
  248   HD13  ILE  31          2HD1      ILE  31  -1.248   0.889  -4.210
  249    H    LYS  32           HN       LYS  32  -4.592  -3.873  -6.364
  250    HA   LYS  32           HA       LYS  32  -6.497  -5.000  -4.621
  251    HB2  LYS  32           2HB      LYS  32  -6.842  -3.876  -6.914
  252    HB3  LYS  32           1HB      LYS  32  -6.458  -5.445  -7.596
  253    HG2  LYS  32           2HG      LYS  32  -8.338  -6.445  -6.421
  254    HG3  LYS  32           1HG      LYS  32  -8.716  -4.886  -5.684
  255    HD2  LYS  32           2HD      LYS  32 -10.182  -5.202  -7.549
  256    HD3  LYS  32           1HD      LYS  32  -9.014  -3.952  -7.976
  257    HE2  LYS  32           2HE      LYS  32  -9.227  -5.367  -9.868
  258    HE3  LYS  32           1HE      LYS  32  -7.676  -5.746  -9.124
  259    HZ1  LYS  32           3HZ      LYS  32 -10.188  -7.307  -8.840
  260    HZ2  LYS  32           1HZ      LYS  32  -8.727  -7.666  -8.048
  261    HZ3  LYS  32           2HZ      LYS  32  -8.823  -7.759  -9.740
  262    H    THR  33           HN       THR  33  -3.939  -6.396  -6.527
  263    HA   THR  33           HA       THR  33  -4.993  -9.077  -6.385
  264    HB   THR  33           HB       THR  33  -2.289  -8.074  -7.294
  265    HG1  THR  33           1HG      THR  33  -3.824  -7.364  -8.722
  266   HG21  THR  33          3HG2      THR  33  -2.069 -10.274  -8.376
  267   HG22  THR  33          1HG2      THR  33  -3.574 -10.790  -7.615
  268   HG23  THR  33          2HG2      THR  33  -2.167 -10.416  -6.621
  269    H    TYR  34           HN       TYR  34  -2.197  -7.385  -4.963
  270    HA   TYR  34           HA       TYR  34  -1.505  -9.705  -3.414
  271    HB2  TYR  34           2HB      TYR  34  -0.347  -6.924  -3.516
  272    HB3  TYR  34           1HB      TYR  34   0.291  -8.208  -2.493
  273    HD1  TYR  34           1HD      TYR  34   1.127 -10.330  -3.606
  274    HD2  TYR  34           2HD      TYR  34   0.256  -6.783  -5.794
  275    HE1  TYR  34           1HE      TYR  34   2.459 -11.174  -5.493
  276    HE2  TYR  34           2HE      TYR  34   1.585  -7.619  -7.685
  277    HH   TYR  34           HH       TYR  34   2.593 -10.827  -7.950
  278    H    CYS  35           HN       CYS  35  -2.743  -6.455  -2.635
  279    HA   CYS  35           HA       CYS  35  -2.904  -7.167   0.177
  280    HB2  CYS  35           2HB      CYS  35  -3.772  -4.612  -1.187
  281    HB3  CYS  35           1HB      CYS  35  -3.508  -4.851   0.537
  282    HG   CYS  35           HG       CYS  35  -0.696  -5.471   0.005
  283    H    GLY  36           HN       GLY  36  -4.928  -7.093  -2.584
  284    HA2  GLY  36           2HA      GLY  36  -7.425  -6.429  -1.624
  285    HA3  GLY  36           1HA      GLY  36  -7.144  -7.569  -2.928
  286    HA   PRO  37           HA       PRO  37  -8.643 -10.998  -0.651
  287    HB2  PRO  37           2HB      PRO  37  -6.028 -12.390  -0.680
  288    HB3  PRO  37           1HB      PRO  37  -7.592 -12.911  -1.317
  289    HG2  PRO  37           2HG      PRO  37  -5.654 -12.121  -2.960
  290    HG3  PRO  37           1HG      PRO  37  -7.346 -11.698  -3.280
  291    HD2  PRO  37           2HD      PRO  37  -5.156 -10.011  -2.135
  292    HD3  PRO  37           1HD      PRO  37  -6.416  -9.577  -3.309
  293    H    VAL  38           HN       VAL  38  -6.124  -9.214   0.723
  294    HA   VAL  38           HA       VAL  38  -6.264 -10.760   3.226
  295    HB   VAL  38           HB       VAL  38  -4.216  -8.654   2.523
  296   HG11  VAL  38          1HG1      VAL  38  -2.975  -9.595   4.406
  297   HG12  VAL  38          2HG1      VAL  38  -4.295 -10.724   4.715
  298   HG13  VAL  38          3HG1      VAL  38  -4.554  -8.990   4.911
  299   HG21  VAL  38          3HG2      VAL  38  -2.663 -10.525   2.145
  300   HG22  VAL  38          1HG2      VAL  38  -3.990 -10.517   0.984
  301   HG23  VAL  38          2HG2      VAL  38  -4.002 -11.657   2.329
  302    H    ILE  39           HN       ILE  39  -5.826  -7.330   2.286
  303    HA   ILE  39           HA       ILE  39  -7.518  -6.624   4.599
  304    HB   ILE  39           HB       ILE  39  -6.260  -4.492   4.729
  305   HG12  ILE  39          2HG1      ILE  39  -4.394  -5.821   2.749
  306   HG13  ILE  39          1HG1      ILE  39  -5.457  -4.468   2.383
  307   HG21  ILE  39          1HG2      ILE  39  -5.696  -6.330   6.202
  308   HG22  ILE  39          2HG2      ILE  39  -4.242  -5.440   5.747
  309   HG23  ILE  39          3HG2      ILE  39  -4.601  -6.991   4.988
  310   HD11  ILE  39          3HD1      ILE  39  -4.233  -3.088   3.994
  311   HD12  ILE  39          1HD1      ILE  39  -3.180  -3.719   2.726
  312   HD13  ILE  39          2HD1      ILE  39  -3.162  -4.448   4.333
  313    H    GLY  40           HN       GLY  40  -7.612  -6.788   1.382
  314    HA2  GLY  40           2HA      GLY  40  -8.374  -4.314   0.381
  315    HA3  GLY  40           1HA      GLY  40  -8.946  -5.855  -0.233
  316    HA   PRO  41           HA       PRO  41 -12.984  -5.063   1.389
  317    HB2  PRO  41           2HB      PRO  41 -13.244  -7.592   2.809
  318    HB3  PRO  41           1HB      PRO  41 -14.008  -7.080   1.303
  319    HG2  PRO  41           2HG      PRO  41 -12.106  -9.009   1.405
  320    HG3  PRO  41           1HG      PRO  41 -12.326  -7.945   0.003
  321    HD2  PRO  41           2HD      PRO  41 -10.313  -7.777   2.219
  322    HD3  PRO  41           1HD      PRO  41 -10.088  -7.533   0.471
  323    H    LEU  42           HN       LEU  42 -10.472  -5.156   3.492
  324    HA   LEU  42           HA       LEU  42 -12.098  -4.921   5.910
  325    HB2  LEU  42           2HB      LEU  42  -9.108  -4.913   5.492
  326    HB3  LEU  42           1HB      LEU  42  -9.880  -4.691   7.049
  327    HG   LEU  42           HG       LEU  42 -10.050  -7.168   5.334
  328   HD11  LEU  42          1HD1      LEU  42  -8.744  -8.201   7.116
  329   HD12  LEU  42          2HD1      LEU  42  -8.641  -6.649   7.947
  330   HD13  LEU  42          3HD1      LEU  42  -7.867  -6.862   6.377
  331   HD21  LEU  42          3HD2      LEU  42 -11.212  -6.556   8.049
  332   HD22  LEU  42          1HD2      LEU  42 -11.183  -8.149   7.292
  333   HD23  LEU  42          2HD2      LEU  42 -12.111  -6.840   6.559
  334    H    SER  43           HN       SER  43 -11.482  -3.061   7.386
  335    HA   SER  43           HA       SER  43 -11.974  -0.619   6.030
  336    HB2  SER  43           2HB      SER  43 -12.773  -1.021   8.316
  337    HB3  SER  43           1HB      SER  43 -11.111  -1.117   8.889
  338    HG   SER  43           HG       SER  43 -12.629   1.039   8.621
  339    H    VAL  44           HN       VAL  44 -10.636   1.022   5.480
  340    HA   VAL  44           HA       VAL  44  -7.836   0.559   5.268
  341    HB   VAL  44           HB       VAL  44  -9.089   1.947   3.644
  342   HG11  VAL  44          1HG1      VAL  44  -9.696   4.262   4.223
  343   HG12  VAL  44          2HG1      VAL  44  -9.284   3.929   5.906
  344   HG13  VAL  44          3HG1      VAL  44 -10.619   3.071   5.140
  345   HG21  VAL  44          3HG2      VAL  44  -6.870   3.416   5.062
  346   HG22  VAL  44          1HG2      VAL  44  -7.431   3.741   3.423
  347   HG23  VAL  44          2HG2      VAL  44  -6.675   2.194   3.805
  348    H    GLN  45           HN       GLN  45  -9.892   1.844   7.681
  349    HA   GLN  45           HA       GLN  45  -7.904   3.380   9.078
  350    HB2  GLN  45           2HB      GLN  45 -10.405   3.746   9.194
  351    HB3  GLN  45           1HB      GLN  45 -10.515   2.262  10.124
  352    HG2  GLN  45           2HG      GLN  45  -8.805   4.560  11.008
  353    HG3  GLN  45           1HG      GLN  45 -10.522   4.474  11.384
  354   HE21  GLN  45          1HE2      GLN  45  -8.215   4.471  13.151
  355   HE22  GLN  45          2HE2      GLN  45  -8.320   3.010  14.081
  356    H    ASP  46           HN       ASP  46  -9.198   0.133   9.148
  357    HA   ASP  46           HA       ASP  46  -8.006  -0.602  11.642
  358    HB2  ASP  46           2HB      ASP  46 -10.103  -1.592  10.626
  359    HB3  ASP  46           1HB      ASP  46  -9.059  -2.457   9.504
  360    H    VAL  47           HN       VAL  47  -6.915  -0.451   8.402
  361    HA   VAL  47           HA       VAL  47  -4.975  -2.474   8.365
  362    HB   VAL  47           HB       VAL  47  -4.902   0.209   6.970
  363   HG11  VAL  47          1HG1      VAL  47  -3.299  -0.817   5.440
  364   HG12  VAL  47          2HG1      VAL  47  -3.312  -2.295   6.402
  365   HG13  VAL  47          3HG1      VAL  47  -2.677  -0.800   7.090
  366   HG21  VAL  47          3HG2      VAL  47  -6.861  -1.103   6.381
  367   HG22  VAL  47          1HG2      VAL  47  -5.843  -2.496   6.021
  368   HG23  VAL  47          2HG2      VAL  47  -5.733  -1.044   5.026
  369    H    ASP  48           HN       ASP  48  -3.373  -2.751   9.736
  370    HA   ASP  48           HA       ASP  48  -1.845  -0.415  10.652
  371    HB2  ASP  48           2HB      ASP  48  -3.562  -1.435  12.348
  372    HB3  ASP  48           1HB      ASP  48  -2.369  -2.714  12.514
  373    H    THR  49           HN       THR  49   0.037  -1.631  12.149
  374    HA   THR  49           HA       THR  49   1.871  -2.434  10.192
  375    HB   THR  49           HB       THR  49   2.078  -2.975  13.161
  376    HG1  THR  49           1HG      THR  49   1.841  -0.851  13.233
  377   HG21  THR  49          3HG2      THR  49   3.831  -3.999  11.762
  378   HG22  THR  49          1HG2      THR  49   4.473  -2.719  12.792
  379   HG23  THR  49          2HG2      THR  49   4.195  -2.415  11.078
  380    H    LYS  50           HN       LYS  50   0.033  -4.330  12.539
  381    HA   LYS  50           HA       LYS  50   1.203  -6.830  12.161
  382    HB2  LYS  50           2HB      LYS  50  -0.358  -6.267  13.979
  383    HB3  LYS  50           1HB      LYS  50  -1.671  -6.163  12.823
  384    HG2  LYS  50           2HG      LYS  50  -1.453  -8.532  12.330
  385    HG3  LYS  50           1HG      LYS  50  -0.100  -8.654  13.458
  386    HD2  LYS  50           2HD      LYS  50  -1.544  -8.016  15.303
  387    HD3  LYS  50           1HD      LYS  50  -2.896  -7.792  14.194
  388    HE2  LYS  50           2HE      LYS  50  -3.049  -9.921  15.380
  389    HE3  LYS  50           1HE      LYS  50  -2.861 -10.158  13.644
  390    HZ1  LYS  50           3HZ      LYS  50  -0.531 -10.220  15.462
  391    HZ2  LYS  50           1HZ      LYS  50  -0.677 -10.867  13.902
  392    HZ3  LYS  50           2HZ      LYS  50  -1.483 -11.597  15.201
  393    H    LEU  51           HN       LEU  51  -1.538  -5.334  10.533
  394    HA   LEU  51           HA       LEU  51  -2.144  -7.549   8.895
  395    HB2  LEU  51           2HB      LEU  51  -2.807  -4.625   8.614
  396    HB3  LEU  51           1HB      LEU  51  -3.444  -5.874   7.569
  397    HG   LEU  51           HG       LEU  51  -3.922  -5.631  10.532
  398   HD11  LEU  51          1HD1      LEU  51  -6.255  -5.238   9.839
  399   HD12  LEU  51          2HD1      LEU  51  -5.720  -5.197   8.159
  400   HD13  LEU  51          3HD1      LEU  51  -5.149  -3.977   9.299
  401   HD21  LEU  51          3HD2      LEU  51  -3.826  -7.966   9.872
  402   HD22  LEU  51          1HD2      LEU  51  -4.953  -7.658   8.552
  403   HD23  LEU  51          2HD2      LEU  51  -5.488  -7.496  10.224
  404    H    ILE  52           HN       ILE  52  -0.246  -4.601   8.314
  405    HA   ILE  52           HA       ILE  52   0.193  -5.021   5.575
  406    HB   ILE  52           HB       ILE  52   1.985  -3.552   7.514
  407   HG12  ILE  52          2HG1      ILE  52  -0.247  -2.525   5.746
  408   HG13  ILE  52          1HG1      ILE  52  -0.356  -2.740   7.488
  409   HG21  ILE  52          1HG2      ILE  52   2.781  -2.348   5.537
  410   HG22  ILE  52          2HG2      ILE  52   1.773  -3.364   4.507
  411   HG23  ILE  52          3HG2      ILE  52   3.110  -4.076   5.413
  412   HD11  ILE  52          3HD1      ILE  52   0.021  -0.417   6.899
  413   HD12  ILE  52          1HD1      ILE  52   1.511  -0.860   6.068
  414   HD13  ILE  52          2HD1      ILE  52   1.380  -1.070   7.815
  415    H    MET  53           HN       MET  53   2.157  -5.988   8.391
  416    HA   MET  53           HA       MET  53   4.272  -7.094   6.874
  417    HB2  MET  53           2HB      MET  53   4.988  -8.198   8.916
  418    HB3  MET  53           1HB      MET  53   4.500  -6.547   9.271
  419    HG2  MET  53           2HG      MET  53   2.395  -7.332  10.166
  420    HG3  MET  53           1HG      MET  53   2.803  -8.989   9.731
  421    HE1  MET  53           3HE      MET  53   4.967  -6.544  12.991
  422    HE2  MET  53           1HE      MET  53   3.665  -5.923  11.978
  423    HE3  MET  53           2HE      MET  53   5.247  -6.258  11.274
  424    H    LYS  54           HN       LYS  54   1.214  -8.406   7.996
  425    HA   LYS  54           HA       LYS  54   1.761 -11.094   7.251
  426    HB2  LYS  54           2HB      LYS  54  -0.685  -9.564   8.004
  427    HB3  LYS  54           1HB      LYS  54  -0.885 -11.116   7.202
  428    HG2  LYS  54           2HG      LYS  54   0.899 -10.882   9.589
  429    HG3  LYS  54           1HG      LYS  54  -0.848 -10.996   9.789
  430    HD2  LYS  54           2HD      LYS  54   0.003 -13.209   9.956
  431    HD3  LYS  54           1HD      LYS  54  -0.777 -13.082   8.382
  432    HE2  LYS  54           2HE      LYS  54   1.265 -14.263   8.076
  433    HE3  LYS  54           1HE      LYS  54   1.478 -12.656   7.385
  434    HZ1  LYS  54           3HZ      LYS  54   2.463 -13.560  10.046
  435    HZ2  LYS  54           1HZ      LYS  54   2.647 -11.998   9.411
  436    HZ3  LYS  54           2HZ      LYS  54   3.414 -13.309   8.660
  437    H    VAL  55           HN       VAL  55   0.304  -8.344   5.573
  438    HA   VAL  55           HA       VAL  55  -0.510  -9.699   3.249
  439    HB   VAL  55           HB       VAL  55   0.499  -6.856   3.499
  440   HG11  VAL  55          1HG1      VAL  55  -1.164  -8.126   1.324
  441   HG12  VAL  55          2HG1      VAL  55   0.529  -7.656   1.184
  442   HG13  VAL  55          3HG1      VAL  55  -0.708  -6.424   1.426
  443   HG21  VAL  55          3HG2      VAL  55  -1.869  -6.249   3.593
  444   HG22  VAL  55          1HG2      VAL  55  -1.405  -7.280   4.945
  445   HG23  VAL  55          2HG2      VAL  55  -2.305  -7.957   3.588
  446    H    LEU  56           HN       LEU  56   2.566  -8.164   4.088
  447    HA   LEU  56           HA       LEU  56   3.793  -8.677   1.566
  448    HB2  LEU  56           2HB      LEU  56   5.007  -7.987   4.242
  449    HB3  LEU  56           1HB      LEU  56   5.878  -8.002   2.724
  450    HG   LEU  56           HG       LEU  56   3.573  -6.170   3.392
  451   HD11  LEU  56          1HD1      LEU  56   6.527  -5.601   3.167
  452   HD12  LEU  56          2HD1      LEU  56   5.601  -5.663   4.667
  453   HD13  LEU  56          3HD1      LEU  56   5.256  -4.415   3.471
  454   HD21  LEU  56          3HD2      LEU  56   3.671  -6.680   1.014
  455   HD22  LEU  56          1HD2      LEU  56   5.387  -6.273   0.982
  456   HD23  LEU  56          2HD2      LEU  56   4.190  -5.021   1.314
  457    H    ASP  57           HN       ASP  57   3.344 -10.531   4.419
  458    HA   ASP  57           HA       ASP  57   5.588 -12.074   4.651
  459    HB2  ASP  57           2HB      ASP  57   3.377 -12.022   6.029
  460    HB3  ASP  57           1HB      ASP  57   2.896 -13.347   4.985
  461    HA   PRO  58           HA       PRO  58   4.120 -15.356   1.502
  462    HB2  PRO  58           2HB      PRO  58   1.927 -14.970  -0.003
  463    HB3  PRO  58           1HB      PRO  58   1.833 -15.644   1.628
  464    HG2  PRO  58           2HG      PRO  58   1.316 -12.846   0.699
  465    HG3  PRO  58           1HG      PRO  58   0.396 -13.828   1.853
  466    HD2  PRO  58           2HD      PRO  58   2.193 -11.916   2.604
  467    HD3  PRO  58           1HD      PRO  58   1.812 -13.343   3.586
  468    H    ILE  59           HN       ILE  59   4.054 -11.996   0.801
  469    HA   ILE  59           HA       ILE  59   4.382 -12.235  -2.042
  470    HB   ILE  59           HB       ILE  59   4.912  -9.846  -0.266
  471   HG12  ILE  59          2HG1      ILE  59   2.470 -10.582  -1.902
  472   HG13  ILE  59          1HG1      ILE  59   2.579 -10.649  -0.147
  473   HG21  ILE  59          1HG2      ILE  59   4.687  -8.546  -2.341
  474   HG22  ILE  59          2HG2      ILE  59   4.550 -10.047  -3.257
  475   HG23  ILE  59          3HG2      ILE  59   6.047  -9.666  -2.408
  476   HD11  ILE  59          3HD1      ILE  59   2.765  -8.176  -1.847
  477   HD12  ILE  59          1HD1      ILE  59   2.931  -8.225  -0.091
  478   HD13  ILE  59          2HD1      ILE  59   1.399  -8.667  -0.845
  479    H    TRP  60           HN       TRP  60   6.510 -11.890   0.745
  480    HA   TRP  60           HA       TRP  60   8.916 -11.444  -0.638
  481    HB2  TRP  60           2HB      TRP  60   8.348 -12.780   2.009
  482    HB3  TRP  60           1HB      TRP  60   9.983 -12.577   1.392
  483    HD1  TRP  60           1HD      TRP  60   7.348 -10.797   3.327
  484    HE1  TRP  60           1HE      TRP  60   8.093  -8.384   3.818
  485    HE3  TRP  60           3HE      TRP  60  11.367 -10.537   0.185
  486    HZ2  TRP  60           2HZ      TRP  60  10.116  -6.603   2.984
  487    HZ3  TRP  60           3HZ      TRP  60  12.658  -8.445   0.094
  488    HH2  TRP  60           2HH      TRP  60  12.045  -6.518   1.464
  489    H    GLU  61           HN       GLU  61   7.014 -14.301  -0.207
  490    HA   GLU  61           HA       GLU  61   9.018 -16.168  -0.977
  491    HB2  GLU  61           2HB      GLU  61   6.009 -16.303  -0.806
  492    HB3  GLU  61           1HB      GLU  61   7.030 -17.669  -1.187
  493    HG2  GLU  61           2HG      GLU  61   7.156 -16.086   1.358
  494    HG3  GLU  61           1HG      GLU  61   6.339 -17.635   1.158
  495    H    GLN  62           HN       GLN  62   6.232 -14.666  -2.564
  496    HA   GLN  62           HA       GLN  62   6.699 -15.907  -5.084
  497    HB2  GLN  62           2HB      GLN  62   4.617 -14.536  -3.867
  498    HB3  GLN  62           1HB      GLN  62   5.145 -13.439  -5.134
  499    HG2  GLN  62           2HG      GLN  62   4.512 -16.323  -5.668
  500    HG3  GLN  62           1HG      GLN  62   3.287 -15.061  -5.693
  501   HE21  GLN  62          1HE2      GLN  62   2.837 -15.335  -7.865
  502   HE22  GLN  62          2HE2      GLN  62   3.936 -14.862  -9.118
  503    H    LYS  63           HN       LYS  63   6.845 -12.473  -4.116
  504    HA   LYS  63           HA       LYS  63   8.963 -12.047  -6.110
  505    HB2  LYS  63           2HB      LYS  63   6.456 -10.395  -5.758
  506    HB3  LYS  63           1HB      LYS  63   7.841  -9.883  -6.704
  507    HG2  LYS  63           2HG      LYS  63   6.484 -12.467  -7.339
  508    HG3  LYS  63           1HG      LYS  63   5.777 -10.938  -7.868
  509    HD2  LYS  63           2HD      LYS  63   7.087 -11.585  -9.679
  510    HD3  LYS  63           1HD      LYS  63   8.113 -10.435  -8.826
  511    HE2  LYS  63           2HE      LYS  63   9.484 -12.278  -9.429
  512    HE3  LYS  63           1HE      LYS  63   9.197 -12.399  -7.694
  513    HZ1  LYS  63           3HZ      LYS  63   7.491 -14.053  -8.124
  514    HZ2  LYS  63           1HZ      LYS  63   8.970 -14.541  -8.792
  515    HZ3  LYS  63           2HZ      LYS  63   7.751 -13.929  -9.794
  516    HA   PRO  64           HA       PRO  64  10.189 -10.323  -1.990
  517    HB2  PRO  64           2HB      PRO  64  12.878 -10.534  -2.545
  518    HB3  PRO  64           1HB      PRO  64  11.915 -11.802  -1.781
  519    HG2  PRO  64           2HG      PRO  64  12.738 -11.509  -4.641
  520    HG3  PRO  64           1HG      PRO  64  12.684 -12.967  -3.634
  521    HD2  PRO  64           2HD      PRO  64  10.773 -12.433  -5.441
  522    HD3  PRO  64           1HD      PRO  64  10.393 -13.208  -3.889
  523    H    GLU  65           HN       GLU  65  11.193  -9.560  -5.241
  524    HA   GLU  65           HA       GLU  65  12.326  -7.014  -4.684
  525    HB2  GLU  65           2HB      GLU  65  12.923  -8.155  -6.708
  526    HB3  GLU  65           1HB      GLU  65  11.246  -8.295  -7.189
  527    HG2  GLU  65           2HG      GLU  65  12.401  -5.578  -6.846
  528    HG3  GLU  65           1HG      GLU  65  12.844  -6.519  -8.269
  529    H    THR  66           HN       THR  66   9.159  -8.143  -5.696
  530    HA   THR  66           HA       THR  66   8.045  -5.557  -6.065
  531    HB   THR  66           HB       THR  66   6.614  -8.196  -5.718
  532    HG1  THR  66           1HG      THR  66   8.266  -7.292  -7.667
  533   HG21  THR  66          3HG2      THR  66   5.125  -6.265  -5.538
  534   HG22  THR  66          1HG2      THR  66   4.846  -7.121  -7.054
  535   HG23  THR  66          2HG2      THR  66   5.764  -5.615  -7.048
  536    H    ALA  67           HN       ALA  67   8.230  -7.798  -3.384
  537    HA   ALA  67           HA       ALA  67   6.248  -6.786  -1.717
  538    HB1  ALA  67           1HB      ALA  67   7.467  -8.837  -1.233
  539    HB2  ALA  67           2HB      ALA  67   7.543  -7.729   0.136
  540    HB3  ALA  67           3HB      ALA  67   8.936  -7.907  -0.930
  541    H    SER  68           HN       SER  68   9.587  -5.696  -2.166
  542    HA   SER  68           HA       SER  68   9.491  -3.664  -0.187
  543    HB2  SER  68           2HB      SER  68  11.287  -3.858  -2.617
  544    HB3  SER  68           1HB      SER  68  11.582  -2.891  -1.172
  545    HG   SER  68           HG       SER  68  12.723  -4.725  -0.858
  546    H    ARG  69           HN       ARG  69   8.861  -3.751  -3.660
  547    HA   ARG  69           HA       ARG  69   8.638  -0.964  -4.031
  548    HB2  ARG  69           2HB      ARG  69   7.501  -3.248  -5.639
  549    HB3  ARG  69           1HB      ARG  69   7.599  -1.584  -6.171
  550    HG2  ARG  69           2HG      ARG  69  10.174  -2.359  -5.329
  551    HG3  ARG  69           1HG      ARG  69   9.535  -3.628  -6.373
  552    HD2  ARG  69           2HD      ARG  69  10.660  -2.062  -7.754
  553    HD3  ARG  69           1HD      ARG  69   8.933  -1.856  -8.021
  554    HE   ARG  69           HE       ARG  69  10.403  -0.089  -6.173
  555   HH11  ARG  69          1HH1      ARG  69   8.410  -0.544  -9.018
  556   HH12  ARG  69          2HH1      ARG  69   8.066   1.151  -9.206
  557   HH21  ARG  69          1HH2      ARG  69   9.984   2.144  -6.439
  558   HH22  ARG  69          2HH2      ARG  69   8.997   2.678  -7.767
  559    H    LEU  70           HN       LEU  70   6.336  -3.501  -3.245
  560    HA   LEU  70           HA       LEU  70   3.960  -2.058  -3.636
  561    HB2  LEU  70           2HB      LEU  70   4.075  -4.509  -3.381
  562    HB3  LEU  70           1HB      LEU  70   4.477  -4.305  -1.687
  563    HG   LEU  70           HG       LEU  70   2.273  -3.209  -1.336
  564   HD11  LEU  70          1HD1      LEU  70   1.776  -4.055  -4.188
  565   HD12  LEU  70          2HD1      LEU  70   1.895  -2.397  -3.598
  566   HD13  LEU  70          3HD1      LEU  70   0.561  -3.425  -3.073
  567   HD21  LEU  70          3HD2      LEU  70   2.569  -5.568  -0.852
  568   HD22  LEU  70          1HD2      LEU  70   2.205  -5.977  -2.528
  569   HD23  LEU  70          2HD2      LEU  70   0.955  -5.272  -1.502
  570    H    ARG  71           HN       ARG  71   6.173  -2.225  -0.925
  571    HA   ARG  71           HA       ARG  71   4.609  -1.161   1.109
  572    HB2  ARG  71           2HB      ARG  71   6.966  -2.063   1.315
  573    HB3  ARG  71           1HB      ARG  71   7.537  -0.525   0.679
  574    HG2  ARG  71           2HG      ARG  71   6.277   0.559   2.606
  575    HG3  ARG  71           1HG      ARG  71   6.138  -1.065   3.282
  576    HD2  ARG  71           2HD      ARG  71   8.701   0.385   2.613
  577    HD3  ARG  71           1HD      ARG  71   8.046   0.124   4.226
  578    HE   ARG  71           HE       ARG  71   8.576  -2.269   2.679
  579   HH11  ARG  71          1HH1      ARG  71   9.705  -0.016   5.107
  580   HH12  ARG  71          2HH1      ARG  71  10.962  -1.062   5.699
  581   HH21  ARG  71          1HH2      ARG  71  10.238  -3.672   3.464
  582   HH22  ARG  71          2HH2      ARG  71  11.265  -3.141   4.757
  583    H    GLY  72           HN       GLY  72   6.322   0.444  -1.513
  584    HA2  GLY  72           2HA      GLY  72   5.998   3.107  -0.599
  585    HA3  GLY  72           1HA      GLY  72   6.330   2.617  -2.253
  586    H    ARG  73           HN       ARG  73   3.969   1.011  -2.584
  587    HA   ARG  73           HA       ARG  73   2.128   3.075  -3.294
  588    HB2  ARG  73           2HB      ARG  73   1.915   0.066  -3.367
  589    HB3  ARG  73           1HB      ARG  73   0.616   1.130  -3.892
  590    HG2  ARG  73           2HG      ARG  73   2.181   2.136  -5.531
  591    HG3  ARG  73           1HG      ARG  73   3.380   0.931  -5.062
  592    HD2  ARG  73           2HD      ARG  73   1.877  -0.856  -5.758
  593    HD3  ARG  73           1HD      ARG  73   0.645   0.332  -6.179
  594    HE   ARG  73           HE       ARG  73   2.031   1.053  -7.990
  595   HH11  ARG  73          1HH1      ARG  73   3.106  -1.854  -6.387
  596   HH12  ARG  73          2HH1      ARG  73   4.093  -2.393  -7.712
  597   HH21  ARG  73          1HH2      ARG  73   3.308   0.353  -9.764
  598   HH22  ARG  73          2HH2      ARG  73   4.222  -1.117  -9.634
  599    H    ILE  74           HN       ILE  74   2.156   0.509  -0.852
  600    HA   ILE  74           HA       ILE  74  -0.324   1.087   0.316
  601    HB   ILE  74           HB       ILE  74   2.149   0.009   1.690
  602   HG12  ILE  74          2HG1      ILE  74  -0.134  -1.476   0.359
  603   HG13  ILE  74          1HG1      ILE  74   1.483  -1.292  -0.316
  604   HG21  ILE  74          1HG2      ILE  74  -0.769  -0.166   2.451
  605   HG22  ILE  74          2HG2      ILE  74   0.484   0.750   3.289
  606   HG23  ILE  74          3HG2      ILE  74   0.549  -1.012   3.261
  607   HD11  ILE  74          3HD1      ILE  74   0.792  -2.715   2.245
  608   HD12  ILE  74          1HD1      ILE  74   2.407  -2.546   1.555
  609   HD13  ILE  74          2HD1      ILE  74   1.178  -3.475   0.700
  610    H    GLU  75           HN       GLU  75   2.914   2.369   0.939
  611    HA   GLU  75           HA       GLU  75   2.331   3.957   3.153
  612    HB2  GLU  75           2HB      GLU  75   4.610   3.534   2.451
  613    HB3  GLU  75           1HB      GLU  75   4.337   4.370   0.933
  614    HG2  GLU  75           2HG      GLU  75   3.931   6.454   2.220
  615    HG3  GLU  75           1HG      GLU  75   4.383   5.584   3.684
  616    H    SER  76           HN       SER  76   2.297   4.763  -0.280
  617    HA   SER  76           HA       SER  76   1.670   7.468   0.007
  618    HB2  SER  76           2HB      SER  76   0.994   5.655  -2.301
  619    HB3  SER  76           1HB      SER  76   1.097   7.412  -2.359
  620    HG   SER  76           HG       SER  76   3.163   5.509  -2.063
  621    H    VAL  77           HN       VAL  77  -0.415   4.637  -0.265
  622    HA   VAL  77           HA       VAL  77  -2.843   6.114  -0.432
  623    HB   VAL  77           HB       VAL  77  -2.382   3.241   0.393
  624   HG11  VAL  77          1HG1      VAL  77  -4.940   4.641  -0.397
  625   HG12  VAL  77          2HG1      VAL  77  -4.534   4.055   1.216
  626   HG13  VAL  77          3HG1      VAL  77  -4.764   2.911  -0.105
  627   HG21  VAL  77          3HG2      VAL  77  -3.093   2.714  -1.896
  628   HG22  VAL  77          1HG2      VAL  77  -1.630   3.699  -1.878
  629   HG23  VAL  77          2HG2      VAL  77  -3.186   4.437  -2.258
  630    H    LEU  78           HN       LEU  78  -1.149   4.482   2.248
  631    HA   LEU  78           HA       LEU  78  -3.165   5.064   4.159
  632    HB2  LEU  78           2HB      LEU  78  -0.276   4.275   4.472
  633    HB3  LEU  78           1HB      LEU  78  -1.362   4.494   5.829
  634    HG   LEU  78           HG       LEU  78  -1.663   2.455   3.622
  635   HD11  LEU  78          1HD1      LEU  78  -1.020   2.154   6.551
  636   HD12  LEU  78          2HD1      LEU  78   0.099   1.910   5.208
  637   HD13  LEU  78          3HD1      LEU  78  -1.283   0.833   5.411
  638   HD21  LEU  78          3HD2      LEU  78  -3.567   1.624   4.914
  639   HD22  LEU  78          1HD2      LEU  78  -3.835   3.281   4.368
  640   HD23  LEU  78          2HD2      LEU  78  -3.387   2.966   6.044
  641    H    ASP  79           HN       ASP  79  -0.178   6.713   3.225
  642    HA   ASP  79           HA       ASP  79  -0.181   8.725   5.172
  643    HB2  ASP  79           2HB      ASP  79   1.692   8.368   3.631
  644    HB3  ASP  79           1HB      ASP  79   0.691   8.854   2.269
  645    H    TRP  80           HN       TRP  80  -1.712   8.614   1.988
  646    HA   TRP  80           HA       TRP  80  -2.930  11.138   2.042
  647    HB2  TRP  80           2HB      TRP  80  -2.629   9.715   0.026
  648    HB3  TRP  80           1HB      TRP  80  -3.861   8.624   0.641
  649    HD1  TRP  80           1HD      TRP  80  -3.502  12.227  -0.693
  650    HE1  TRP  80           1HE      TRP  80  -5.763  12.939  -1.701
  651    HE3  TRP  80           3HE      TRP  80  -6.292   8.158   0.654
  652    HZ2  TRP  80           2HZ      TRP  80  -8.386  11.896  -1.896
  653    HZ3  TRP  80           3HZ      TRP  80  -8.670   8.100   0.022
  654    HH2  TRP  80           2HH      TRP  80  -9.692   9.934  -1.222
  655    H    ALA  81           HN       ALA  81  -4.188   7.930   2.909
  656    HA   ALA  81           HA       ALA  81  -6.794   8.741   3.573
  657    HB1  ALA  81           1HB      ALA  81  -7.009   6.591   4.668
  658    HB2  ALA  81           2HB      ALA  81  -5.258   6.389   4.664
  659    HB3  ALA  81           3HB      ALA  81  -6.144   6.416   3.139
  660    H    THR  82           HN       THR  82  -3.852   8.567   5.523
  661    HA   THR  82           HA       THR  82  -5.092   8.986   8.028
  662    HB   THR  82           HB       THR  82  -2.263   9.680   7.205
  663    HG1  THR  82           1HG      THR  82  -2.533   7.508   6.883
  664   HG21  THR  82          3HG2      THR  82  -2.925  10.735   9.318
  665   HG22  THR  82          1HG2      THR  82  -1.745   9.455   9.591
  666   HG23  THR  82          2HG2      THR  82  -3.452   9.171   9.937
  667    H    VAL  83           HN       VAL  83  -3.645  11.232   5.688
  668    HA   VAL  83           HA       VAL  83  -4.097  13.568   7.226
  669    HB   VAL  83           HB       VAL  83  -3.789  13.274   4.227
  670   HG11  VAL  83          1HG1      VAL  83  -3.548  15.724   5.978
  671   HG12  VAL  83          2HG1      VAL  83  -4.812  15.411   4.790
  672   HG13  VAL  83          3HG1      VAL  83  -3.147  15.651   4.261
  673   HG21  VAL  83          3HG2      VAL  83  -1.755  13.916   6.366
  674   HG22  VAL  83          1HG2      VAL  83  -1.451  13.902   4.628
  675   HG23  VAL  83          2HG2      VAL  83  -1.871  12.406   5.463
  676    H    ARG  84           HN       ARG  84  -6.065  11.742   4.973
  677    HA   ARG  84           HA       ARG  84  -8.062  13.781   4.681
  678    HB2  ARG  84           2HB      ARG  84  -8.000  10.871   3.896
  679    HB3  ARG  84           1HB      ARG  84  -9.370  11.924   3.576
  680    HG2  ARG  84           2HG      ARG  84  -6.568  12.355   2.563
  681    HG3  ARG  84           1HG      ARG  84  -7.912  11.695   1.628
  682    HD2  ARG  84           2HD      ARG  84  -7.851  14.434   2.892
  683    HD3  ARG  84           1HD      ARG  84  -7.532  14.092   1.193
  684    HE   ARG  84           HE       ARG  84  -9.934  13.047   1.379
  685   HH11  ARG  84          1HH1      ARG  84  -8.788  16.015   2.848
  686   HH12  ARG  84          2HH1      ARG  84 -10.332  16.810   2.749
  687   HH21  ARG  84          1HH2      ARG  84 -11.959  14.060   1.264
  688   HH22  ARG  84          2HH2      ARG  84 -12.152  15.681   1.858
  689    H    GLY  85           HN       GLY  85  -7.333  11.746   7.205
  690    HA2  GLY  85           2HA      GLY  85  -8.430  11.791   9.263
  691    HA3  GLY  85           1HA      GLY  85  -9.843  12.469   8.473
  692    H    TYR  86           HN       TYR  86  -8.638   9.709   6.895
  693    HA   TYR  86           HA       TYR  86 -10.938   8.178   7.727
  694    HB2  TYR  86           2HB      TYR  86  -8.645   7.500   5.870
  695    HB3  TYR  86           1HB      TYR  86  -9.997   6.421   6.193
  696    HD1  TYR  86           1HD      TYR  86 -12.377   7.679   5.936
  697    HD2  TYR  86           2HD      TYR  86  -8.779   8.728   3.925
  698    HE1  TYR  86           1HE      TYR  86 -13.692   8.786   4.181
  699    HE2  TYR  86           2HE      TYR  86 -10.083   9.847   2.166
  700    HH   TYR  86           HH       TYR  86 -13.379  10.576   2.506
  701    H    ARG  87           HN       ARG  87  -7.678   8.504   8.651
  702    HA   ARG  87           HA       ARG  87  -8.131   6.850  10.942
  703    HB2  ARG  87           2HB      ARG  87  -6.196   5.387  10.643
  704    HB3  ARG  87           1HB      ARG  87  -7.351   5.143   9.342
  705    HG2  ARG  87           2HG      ARG  87  -5.986   6.499   7.855
  706    HG3  ARG  87           1HG      ARG  87  -4.832   6.784   9.159
  707    HD2  ARG  87           2HD      ARG  87  -5.504   4.146   7.859
  708    HD3  ARG  87           1HD      ARG  87  -3.986   5.036   7.735
  709    HE   ARG  87           HE       ARG  87  -4.867   3.364   9.924
  710   HH11  ARG  87          1HH1      ARG  87  -2.696   5.941   8.958
  711   HH12  ARG  87          2HH1      ARG  87  -1.525   5.588  10.191
  712   HH21  ARG  87          1HH2      ARG  87  -3.332   2.892  11.546
  713   HH22  ARG  87          2HH2      ARG  87  -1.871   3.835  11.646
  714    H    GLU  88           HN       GLU  88  -6.553   7.293  12.597
  715    HA   GLU  88           HA       GLU  88  -5.124   9.802  12.033
  716    HB2  GLU  88           2HB      GLU  88  -6.199   8.796  14.671
  717    HB3  GLU  88           1HB      GLU  88  -5.316  10.298  14.438
  718    HG2  GLU  88           2HG      GLU  88  -7.410  11.133  14.380
  719    HG3  GLU  88           1HG      GLU  88  -7.261  10.708  12.677
  720    H    GLY  89           HN       GLY  89  -3.232  10.204  13.470
  721    HA2  GLY  89           2HA      GLY  89  -1.389   9.332  14.724
  722    HA3  GLY  89           1HA      GLY  89  -1.766   7.732  14.096
  723    H    ASP  90           HN       ASP  90   0.215   7.306  13.237
  724    HA   ASP  90           HA       ASP  90   0.955   8.958  10.923
  725    HB2  ASP  90           2HB      ASP  90   2.653   7.339  12.826
  726    HB3  ASP  90           1HB      ASP  90   3.246   7.898  11.271
  727    H    ASN  91           HN       ASN  91   2.518   7.250   9.523
  728    HA   ASN  91           HA       ASN  91   0.560   5.200   8.780
  729    HB2  ASN  91           2HB      ASN  91   1.236   6.606   6.968
  730    HB3  ASN  91           1HB      ASN  91   2.933   6.453   7.389
  731   HD21  ASN  91          1HD2      ASN  91   3.345   5.893   5.237
  732   HD22  ASN  91          2HD2      ASN  91   3.043   4.296   4.663
  733    HA   PRO  92           HA       PRO  92   3.191   2.092  10.614
  734    HB2  PRO  92           2HB      PRO  92   1.605   0.057   9.299
  735    HB3  PRO  92           1HB      PRO  92   1.641   0.504  11.005
  736    HG2  PRO  92           2HG      PRO  92  -0.496   0.955   9.375
  737    HG3  PRO  92           1HG      PRO  92  -0.119   1.940  10.798
  738    HD2  PRO  92           2HD      PRO  92   0.405   2.504   7.909
  739    HD3  PRO  92           1HD      PRO  92  -0.140   3.602   9.195
  740    H    ALA  93           HN       ALA  93   2.628   2.338   7.194
  741    HA   ALA  93           HA       ALA  93   4.315   0.111   6.474
  742    HB1  ALA  93           1HB      ALA  93   2.400   0.769   5.090
  743    HB2  ALA  93           2HB      ALA  93   3.908   0.799   4.178
  744    HB3  ALA  93           3HB      ALA  93   3.189   2.308   4.740
  745    H    ARG  94           HN       ARG  94   5.099   2.983   7.741
  746    HA   ARG  94           HA       ARG  94   7.214   3.833   6.005
  747    HB2  ARG  94           2HB      ARG  94   5.898   5.228   7.717
  748    HB3  ARG  94           1HB      ARG  94   6.930   4.493   8.933
  749    HG2  ARG  94           2HG      ARG  94   7.801   6.647   8.366
  750    HG3  ARG  94           1HG      ARG  94   8.902   5.412   7.754
  751    HD2  ARG  94           2HD      ARG  94   8.282   5.772   5.545
  752    HD3  ARG  94           1HD      ARG  94   6.756   6.534   5.995
  753    HE   ARG  94           HE       ARG  94   8.975   8.047   6.928
  754   HH11  ARG  94          1HH1      ARG  94   7.249   7.266   3.965
  755   HH12  ARG  94          2HH1      ARG  94   7.529   8.834   3.264
  756   HH21  ARG  94          1HH2      ARG  94   9.344  10.083   5.980
  757   HH22  ARG  94          2HH2      ARG  94   8.704  10.429   4.400
  758    H    TRP  95           HN       TRP  95   7.300   2.621   9.345
  759    HA   TRP  95           HA       TRP  95   8.600   1.160  10.452
  760    HB2  TRP  95           2HB      TRP  95   8.992   0.254   7.670
  761    HB3  TRP  95           1HB      TRP  95  10.189  -0.283   8.847
  762    HD1  TRP  95           1HD      TRP  95   8.798  -1.202  11.264
  763    HE1  TRP  95           1HE      TRP  95   6.959  -2.999  11.298
  764    HE3  TRP  95           3HE      TRP  95   7.289  -0.888   6.389
  765    HZ2  TRP  95           2HZ      TRP  95   5.108  -4.132   9.480
  766    HZ3  TRP  95           3HZ      TRP  95   5.480  -2.365   5.618
  767    HH2  TRP  95           2HH      TRP  95   4.414  -3.952   7.133
  768    H    ARG  96           HN       ARG  96  10.200   1.701  11.676
  769    HA   ARG  96           HA       ARG  96  12.354   3.376  10.817
  770    HB2  ARG  96           2HB      ARG  96  11.879   1.795  13.349
  771    HB3  ARG  96           1HB      ARG  96  13.263   2.848  13.110
  772    HG2  ARG  96           2HG      ARG  96  10.401   3.766  12.982
  773    HG3  ARG  96           1HG      ARG  96  11.415   3.858  14.422
  774    HD2  ARG  96           2HD      ARG  96  12.993   5.288  13.232
  775    HD3  ARG  96           1HD      ARG  96  12.006   5.176  11.775
  776    HE   ARG  96           HE       ARG  96  10.209   6.249  13.216
  777   HH11  ARG  96          1HH1      ARG  96  13.639   6.841  13.682
  778   HH12  ARG  96          2HH1      ARG  96  13.394   8.417  14.374
  779   HH21  ARG  96          1HH2      ARG  96   9.897   8.308  14.115
  780   HH22  ARG  96          2HH2      ARG  96  11.266   9.263  14.588
  781    H    GLY  97           HN       GLY  97  11.822  -0.032  11.226
  782    HA2  GLY  97           2HA      GLY  97  13.597  -0.955   9.393
  783    HA3  GLY  97           1HA      GLY  97  14.580  -0.767  10.838
  784    H    TYR  98           HN       TYR  98  11.640  -2.309   9.602
  785    HA   TYR  98           HA       TYR  98  11.360  -4.067  11.828
  786    HB2  TYR  98           2HB      TYR  98   9.466  -3.481  10.363
  787    HB3  TYR  98           1HB      TYR  98  10.242  -4.325   9.028
  788    HD1  TYR  98           2HD      TYR  98   9.209  -5.005  12.559
  789    HD2  TYR  98           1HD      TYR  98   9.504  -6.472   8.579
  790    HE1  TYR  98           2HE      TYR  98   8.122  -7.100  13.258
  791    HE2  TYR  98           1HE      TYR  98   8.413  -8.563   9.266
  792    HH   TYR  98           HH       TYR  98   8.033  -9.879  11.236
  793    H    LEU  99           HN       LEU  99  12.770  -4.362   8.608
  794    HA   LEU  99           HA       LEU  99  13.997  -6.901   9.427
  795    HB2  LEU  99           2HB      LEU  99  13.398  -5.840   6.662
  796    HB3  LEU  99           1HB      LEU  99  14.237  -7.338   7.001
  797    HG   LEU  99           HG       LEU  99  11.389  -6.758   7.808
  798   HD11  LEU  99          1HD1      LEU  99  12.468  -8.408   5.530
  799   HD12  LEU  99          2HD1      LEU  99  11.579  -6.891   5.393
  800   HD13  LEU  99          3HD1      LEU  99  10.777  -8.327   6.029
  801   HD21  LEU  99          3HD2      LEU  99  12.497  -8.356   9.275
  802   HD22  LEU  99          1HD2      LEU  99  13.005  -9.303   7.877
  803   HD23  LEU  99          2HD2      LEU  99  11.290  -9.160   8.270
  804    H    GLU 100           HN       GLU 100  14.653  -4.289   7.098
  805    HA   GLU 100           HA       GLU 100  17.448  -4.286   8.016
  806    HB2  GLU 100           2HB      GLU 100  16.243  -3.430   5.384
  807    HB3  GLU 100           1HB      GLU 100  17.920  -3.155   5.828
  808    HG2  GLU 100           2HG      GLU 100  18.283  -5.561   5.965
  809    HG3  GLU 100           1HG      GLU 100  16.593  -5.839   5.531
  810    H    HIS 101           HN       HIS 101  18.469  -2.350   8.444
  811    HA   HIS 101           HA       HIS 101  16.834   0.091   8.286
  812    HB2  HIS 101           2HB      HIS 101  17.216  -0.544  10.650
  813    HB3  HIS 101           1HB      HIS 101  18.952  -0.559  10.361
  814    HD1  HIS 101           1HD      HIS 101  16.032   1.806  10.672
  815    HD2  HIS 101           2HD      HIS 101  20.189   1.927  10.448
  816    HE1  HIS 101           1HE      HIS 101  16.675   4.172  11.228
  817    HE2  HIS 101           2HE      HIS 101  19.193   4.201  11.205
  818    H    HIS 102           HN       HIS 102  17.580   0.939   6.419
  819    HA   HIS 102           HA       HIS 102  20.398   0.652   5.750
  820    HB2  HIS 102           2HB      HIS 102  17.960   1.505   4.242
  821    HB3  HIS 102           1HB      HIS 102  19.548   1.970   3.643
  822    HD1  HIS 102           1HD      HIS 102  20.590   0.345   2.109
  823    HD2  HIS 102           2HD      HIS 102  17.806  -1.452   4.618
  824    HE1  HIS 102           1HE      HIS 102  20.495  -2.064   1.396
  825    HE2  HIS 102           2HE      HIS 102  18.953  -3.172   3.058
  826    H    HIS 103           HN       HIS 103  21.852   2.261   5.545
  827    HA   HIS 103           HA       HIS 103  21.291   4.775   6.846
  828    HB2  HIS 103           2HB      HIS 103  23.538   3.306   6.637
  829    HB3  HIS 103           1HB      HIS 103  23.784   4.373   5.260
  830    HD1  HIS 103           1HD      HIS 103  25.670   4.470   7.693
  831    HD2  HIS 103           2HD      HIS 103  22.339   6.923   7.219
  832    HE1  HIS 103           1HE      HIS 103  26.108   6.502   9.112
  833    HE2  HIS 103           2HE      HIS 103  24.161   8.042   8.674
  834    H    HIS 104           HN       HIS 104  21.216   6.808   5.831
  835    HA   HIS 104           HA       HIS 104  19.771   7.003   3.508
  836    HB2  HIS 104           2HB      HIS 104  20.063   8.834   5.156
  837    HB3  HIS 104           1HB      HIS 104  21.692   9.098   4.545
  838    HD1  HIS 104           1HD      HIS 104  21.936  10.474   2.419
  839    HD2  HIS 104           2HD      HIS 104  17.986   9.594   3.369
  840    HE1  HIS 104           1HE      HIS 104  20.541  11.871   0.863
  841    HE2  HIS 104           2HE      HIS 104  18.160  11.452   1.576
  842    H    HIS 105           HN       HIS 105  23.271   7.573   3.825
  843    HA   HIS 105           HA       HIS 105  24.987   7.456   2.347
  844    HB2  HIS 105           2HB      HIS 105  24.172   5.327   1.534
  845    HB3  HIS 105           1HB      HIS 105  22.954   6.121   0.545
  846    HD1  HIS 105           1HD      HIS 105  23.701   7.080  -1.714
  847    HD2  HIS 105           2HD      HIS 105  26.803   5.413   0.494
  848    HE1  HIS 105           1HE      HIS 105  25.643   6.913  -3.299
  849    HE2  HIS 105           2HE      HIS 105  27.532   5.947  -1.935
  850    H    HIS 106           HN       HIS 106  25.892   8.971   1.033
  851    HA   HIS 106           HA       HIS 106  24.102  11.055   0.065
  852    HB2  HIS 106           2HB      HIS 106  26.147  11.637   1.386
  853    HB3  HIS 106           1HB      HIS 106  27.129  11.008   0.066
  854    HD1  HIS 106           1HD      HIS 106  27.736  12.643  -1.725
  855    HD2  HIS 106           2HD      HIS 106  24.482  13.910   0.538
  856    HE1  HIS 106           1HE      HIS 106  27.214  14.969  -2.525
  857    HE2  HIS 106           2HE      HIS 106  25.141  15.647  -1.265
  Start of MODEL   17
    1    H1   MET   1           H1       MET   1 -15.074   3.559   6.147
    2    H2   MET   1           H2       MET   1 -14.920   5.238   5.995
    3    H3   MET   1           H3       MET   1 -13.716   4.344   6.782
    4    HA   MET   1           HA       MET   1 -14.430   4.045   3.926
    5    HB2  MET   1           2HB      MET   1 -13.418   6.261   4.469
    6    HB3  MET   1           1HB      MET   1 -12.029   5.422   5.147
    7    HG2  MET   1           2HG      MET   1 -11.518   6.179   2.926
    8    HG3  MET   1           1HG      MET   1 -11.589   4.419   2.952
    9    HE1  MET   1           2HE      MET   1 -13.640   7.694   2.062
   10    HE2  MET   1           3HE      MET   1 -14.730   6.751   3.075
   11    HE3  MET   1           1HE      MET   1 -15.095   6.981   1.365
   12    H    THR   2           HN       THR   2 -13.629   2.244   3.027
   13    HA   THR   2           HA       THR   2 -11.904   0.556   4.673
   14    HB   THR   2           HB       THR   2 -12.338  -1.204   3.001
   15    HG1  THR   2           1HG      THR   2 -14.188   0.581   1.785
   16   HG21  THR   2          3HG2      THR   2 -14.822   0.203   3.981
   17   HG22  THR   2          1HG2      THR   2 -13.871  -0.977   4.880
   18   HG23  THR   2          2HG2      THR   2 -14.748  -1.472   3.431
   19    H    PHE   3           HN       PHE   3 -10.154  -0.669   3.440
   20    HA   PHE   3           HA       PHE   3  -8.291   1.266   2.561
   21    HB2  PHE   3           2HB      PHE   3  -7.649  -0.838   3.702
   22    HB3  PHE   3           1HB      PHE   3  -8.134  -1.740   2.271
   23    HD1  PHE   3           2HD      PHE   3  -5.803   0.901   3.433
   24    HD2  PHE   3           1HD      PHE   3  -6.617  -2.109   0.538
   25    HE1  PHE   3           2HE      PHE   3  -3.549   1.202   2.491
   26    HE2  PHE   3           1HE      PHE   3  -4.367  -1.809  -0.412
   27    HZ   PHE   3           HZ       PHE   3  -2.830  -0.153   0.564
   28    H    SER   4           HN       SER   4 -10.240  -1.138   0.847
   29    HA   SER   4           HA       SER   4  -9.119  -0.733  -1.705
   30    HB2  SER   4           2HB      SER   4 -11.921  -1.619  -0.968
   31    HB3  SER   4           1HB      SER   4 -11.202  -1.758  -2.572
   32    HG   SER   4           HG       SER   4 -10.498  -3.604  -1.878
   33    H    GLU   5           HN       GLU   5 -11.884   0.780  -0.092
   34    HA   GLU   5           HA       GLU   5 -12.671   2.414  -2.251
   35    HB2  GLU   5           2HB      GLU   5 -13.083   2.655   0.728
   36    HB3  GLU   5           1HB      GLU   5 -13.854   3.706  -0.444
   37    HG2  GLU   5           2HG      GLU   5 -14.994   1.820  -1.430
   38    HG3  GLU   5           1HG      GLU   5 -14.168   0.723  -0.326
   39    H    CYS   6           HN       CYS   6 -10.616   2.999   0.563
   40    HA   CYS   6           HA       CYS   6 -10.067   5.710   0.101
   41    HB2  CYS   6           2HB      CYS   6  -9.565   4.330   2.170
   42    HB3  CYS   6           1HB      CYS   6  -8.157   3.719   1.324
   43    HG   CYS   6           HG       CYS   6  -7.262   6.505   0.923
   44    H    ALA   7           HN       ALA   7  -8.312   2.792  -0.858
   45    HA   ALA   7           HA       ALA   7  -6.224   4.023  -2.267
   46    HB1  ALA   7           1HB      ALA   7  -5.915   1.882  -3.394
   47    HB2  ALA   7           2HB      ALA   7  -7.497   1.346  -2.831
   48    HB3  ALA   7           3HB      ALA   7  -6.207   1.654  -1.671
   49    H    ALA   8           HN       ALA   8  -9.402   2.892  -3.409
   50    HA   ALA   8           HA       ALA   8  -9.071   3.579  -6.107
   51    HB1  ALA   8           1HB      ALA   8 -11.626   3.540  -4.501
   52    HB2  ALA   8           2HB      ALA   8 -10.894   2.152  -5.305
   53    HB3  ALA   8           3HB      ALA   8 -11.502   3.502  -6.262
   54    H    LEU   9           HN       LEU   9 -10.300   5.456  -3.370
   55    HA   LEU   9           HA       LEU   9 -10.963   7.772  -4.832
   56    HB2  LEU   9           2HB      LEU   9 -10.211   7.403  -1.936
   57    HB3  LEU   9           1HB      LEU   9 -10.755   8.927  -2.605
   58    HG   LEU   9           HG       LEU   9 -12.359   6.375  -2.474
   59   HD11  LEU   9          1HD1      LEU   9 -12.108   7.446  -0.308
   60   HD12  LEU   9          2HD1      LEU   9 -13.758   7.639  -0.904
   61   HD13  LEU   9          3HD1      LEU   9 -12.623   8.987  -0.992
   62   HD21  LEU   9          3HD2      LEU   9 -12.877   7.676  -4.484
   63   HD22  LEU   9          1HD2      LEU   9 -13.142   9.107  -3.488
   64   HD23  LEU   9          2HD2      LEU   9 -14.211   7.714  -3.329
   65    H    TYR  10           HN       TYR  10  -7.974   6.765  -3.220
   66    HA   TYR  10           HA       TYR  10  -6.447   9.072  -3.624
   67    HB2  TYR  10           2HB      TYR  10  -5.577   7.302  -2.265
   68    HB3  TYR  10           1HB      TYR  10  -5.670   6.152  -3.588
   69    HD1  TYR  10           1HD      TYR  10  -3.835   9.093  -2.302
   70    HD2  TYR  10           2HD      TYR  10  -3.912   5.964  -5.190
   71    HE1  TYR  10           1HE      TYR  10  -1.508   9.602  -2.911
   72    HE2  TYR  10           2HE      TYR  10  -1.584   6.462  -5.802
   73    HH   TYR  10           HH       TYR  10   0.448   8.331  -3.937
   74    H    ILE  11           HN       ILE  11  -6.828   6.229  -5.686
   75    HA   ILE  11           HA       ILE  11  -5.232   7.056  -7.829
   76    HB   ILE  11           HB       ILE  11  -7.641   5.230  -7.787
   77   HG12  ILE  11          2HG1      ILE  11  -4.670   4.659  -7.830
   78   HG13  ILE  11          1HG1      ILE  11  -5.703   4.547  -6.411
   79   HG21  ILE  11          1HG2      ILE  11  -7.308   6.078 -10.047
   80   HG22  ILE  11          2HG2      ILE  11  -6.866   4.374  -9.945
   81   HG23  ILE  11          3HG2      ILE  11  -5.609   5.610  -9.982
   82   HD11  ILE  11          3HD1      ILE  11  -5.231   2.365  -7.378
   83   HD12  ILE  11          1HD1      ILE  11  -5.965   2.876  -8.898
   84   HD13  ILE  11          2HD1      ILE  11  -6.951   2.742  -7.443
   85    H    LYS  12           HN       LYS  12  -8.746   7.449  -7.309
   86    HA   LYS  12           HA       LYS  12  -9.186   8.787  -9.773
   87    HB2  LYS  12           2HB      LYS  12 -10.857   8.629  -7.269
   88    HB3  LYS  12           1HB      LYS  12 -11.399   9.396  -8.757
   89    HG2  LYS  12           2HG      LYS  12 -11.037   7.231  -9.927
   90    HG3  LYS  12           1HG      LYS  12 -10.683   6.500  -8.362
   91    HD2  LYS  12           2HD      LYS  12 -12.916   7.098  -7.570
   92    HD3  LYS  12           1HD      LYS  12 -13.268   7.862  -9.123
   93    HE2  LYS  12           2HE      LYS  12 -12.931   5.695 -10.237
   94    HE3  LYS  12           1HE      LYS  12 -12.645   4.946  -8.669
   95    HZ1  LYS  12           3HZ      LYS  12 -15.166   6.214  -9.594
   96    HZ2  LYS  12           1HZ      LYS  12 -14.903   5.626  -8.020
   97    HZ3  LYS  12           2HZ      LYS  12 -14.890   4.559  -9.341
   98    H    ALA  13           HN       ALA  13  -8.411   9.916  -6.534
   99    HA   ALA  13           HA       ALA  13  -8.944  12.647  -6.938
  100    HB1  ALA  13           1HB      ALA  13  -8.536  11.670  -4.728
  101    HB2  ALA  13           2HB      ALA  13  -7.483  13.049  -5.040
  102    HB3  ALA  13           3HB      ALA  13  -6.846  11.409  -5.161
  103    H    HIS  14           HN       HIS  14  -6.506  10.644  -8.254
  104    HA   HIS  14           HA       HIS  14  -4.939  13.021  -9.015
  105    HB2  HIS  14           2HB      HIS  14  -4.082  10.156  -8.630
  106    HB3  HIS  14           1HB      HIS  14  -3.082  11.345  -9.456
  107    HD1  HIS  14           1HD      HIS  14  -1.660  12.837  -8.017
  108    HD2  HIS  14           2HD      HIS  14  -4.526  10.756  -5.832
  109    HE1  HIS  14           1HE      HIS  14  -1.131  13.286  -5.602
  110    HE2  HIS  14           2HE      HIS  14  -2.751  11.857  -4.309
  111    H    ARG  15           HN       ARG  15  -7.095  10.761 -10.240
  112    HA   ARG  15           HA       ARG  15  -5.877   9.725 -12.499
  113    HB2  ARG  15           2HB      ARG  15  -8.114   9.307 -13.386
  114    HB3  ARG  15           1HB      ARG  15  -7.980   8.872 -11.691
  115    HG2  ARG  15           2HG      ARG  15  -9.227  10.756 -11.011
  116    HG3  ARG  15           1HG      ARG  15  -9.133  11.479 -12.618
  117    HD2  ARG  15           2HD      ARG  15 -10.418   8.808 -12.219
  118    HD3  ARG  15           1HD      ARG  15 -11.312  10.293 -11.888
  119    HE   ARG  15           HE       ARG  15 -10.045  10.281 -14.465
  120   HH11  ARG  15          1HH1      ARG  15 -12.859   9.220 -12.692
  121   HH12  ARG  15          2HH1      ARG  15 -13.921   9.297 -14.061
  122   HH21  ARG  15          1HH2      ARG  15 -11.420  10.393 -16.279
  123   HH22  ARG  15          2HH2      ARG  15 -13.103   9.993 -16.115
  124    H    SER  16           HN       SER  16  -7.138  12.928 -12.061
  125    HA   SER  16           HA       SER  16  -7.538  13.614 -14.767
  126    HB2  SER  16           2HB      SER  16  -8.386  14.900 -12.779
  127    HB3  SER  16           1HB      SER  16  -6.740  15.460 -12.498
  128    HG   SER  16           HG       SER  16  -8.052  16.945 -13.689
  129    H    SER  17           HN       SER  17  -4.700  13.804 -12.673
  130    HA   SER  17           HA       SER  17  -3.019  14.656 -14.895
  131    HB2  SER  17           2HB      SER  17  -2.155  13.873 -12.105
  132    HB3  SER  17           1HB      SER  17  -1.323  14.919 -13.247
  133    HG   SER  17           HG       SER  17  -3.340  16.270 -13.028
  134    H    TRP  18           HN       TRP  18  -4.269  11.929 -13.502
  135    HA   TRP  18           HA       TRP  18  -1.984  10.177 -13.957
  136    HB2  TRP  18           2HB      TRP  18  -4.202  10.314 -12.129
  137    HB3  TRP  18           1HB      TRP  18  -4.119   8.734 -12.894
  138    HD1  TRP  18           1HD      TRP  18  -1.031  10.806 -11.806
  139    HE1  TRP  18           1HE      TRP  18   0.209   9.437  -9.996
  140    HE3  TRP  18           3HE      TRP  18  -4.345   6.988 -11.345
  141    HZ2  TRP  18           2HZ      TRP  18  -0.210   7.024  -8.555
  142    HZ3  TRP  18           3HZ      TRP  18  -3.869   5.176  -9.744
  143    HH2  TRP  18           2HH      TRP  18  -1.856   5.206  -8.373
  144    H    LYS  19           HN       LYS  19  -3.600  11.114 -16.291
  145    HA   LYS  19           HA       LYS  19  -4.974   9.075 -17.492
  146    HB2  LYS  19           2HB      LYS  19  -2.722  10.749 -18.650
  147    HB3  LYS  19           1HB      LYS  19  -3.770   9.710 -19.615
  148    HG2  LYS  19           2HG      LYS  19  -5.697  11.002 -19.040
  149    HG3  LYS  19           1HG      LYS  19  -4.775  11.951 -17.877
  150    HD2  LYS  19           2HD      LYS  19  -3.457  12.915 -19.674
  151    HD3  LYS  19           1HD      LYS  19  -4.308  11.914 -20.855
  152    HE2  LYS  19           2HE      LYS  19  -5.163  14.239 -20.753
  153    HE3  LYS  19           1HE      LYS  19  -6.389  13.028 -20.378
  154    HZ1  LYS  19           3HZ      LYS  19  -6.091  13.487 -18.027
  155    HZ2  LYS  19           1HZ      LYS  19  -6.480  14.915 -18.857
  156    HZ3  LYS  19           2HZ      LYS  19  -4.880  14.627 -18.371
  157    H    ASN  20           HN       ASN  20  -3.313   6.619 -16.366
  158    HA   ASN  20           HA       ASN  20  -5.238   5.740 -17.210
  159    HB2  ASN  20           2HB      ASN  20  -6.120   8.055 -17.671
  160    HB3  ASN  20           1HB      ASN  20  -5.290   8.024 -19.220
  161   HD21  ASN  20          1HD2      ASN  20  -6.910   5.236 -17.809
  162   HD22  ASN  20          2HD2      ASN  20  -8.184   5.173 -18.975
  163    H    THR  21           HN       THR  21  -2.339   6.058 -18.251
  164    HA   THR  21           HA       THR  21  -2.552   4.051 -20.357
  165    HB   THR  21           HB       THR  21  -0.005   4.033 -20.043
  166    HG1  THR  21           1HG      THR  21   0.312   6.432 -19.055
  167   HG21  THR  21          3HG2      THR  21   0.309   6.094 -21.321
  168   HG22  THR  21          1HG2      THR  21  -1.308   6.630 -20.865
  169   HG23  THR  21          2HG2      THR  21  -1.105   5.211 -21.892
  170    H    LYS  22           HN       LYS  22  -0.402   2.379 -19.444
  171    HA   LYS  22           HA       LYS  22  -1.837   0.728 -17.638
  172    HB2  LYS  22           2HB      LYS  22   0.063  -0.754 -17.694
  173    HB3  LYS  22           1HB      LYS  22  -0.298  -0.170 -19.309
  174    HG2  LYS  22           2HG      LYS  22   1.536   1.412 -19.169
  175    HG3  LYS  22           1HG      LYS  22   1.895   0.858 -17.530
  176    HD2  LYS  22           2HD      LYS  22   2.380  -1.367 -18.364
  177    HD3  LYS  22           1HD      LYS  22   1.950  -0.872 -20.001
  178    HE2  LYS  22           2HE      LYS  22   3.793   0.744 -19.986
  179    HE3  LYS  22           1HE      LYS  22   4.225   0.230 -18.356
  180    HZ1  LYS  22           3HZ      LYS  22   4.798  -1.916 -19.150
  181    HZ2  LYS  22           1HZ      LYS  22   5.563  -0.794 -20.164
  182    HZ3  LYS  22           2HZ      LYS  22   4.166  -1.601 -20.689
  183    H    HIS  23           HN       HIS  23   0.076   3.429 -17.016
  184    HA   HIS  23           HA       HIS  23   1.351   2.806 -14.604
  185    HB2  HIS  23           2HB      HIS  23   0.108   5.380 -15.573
  186    HB3  HIS  23           1HB      HIS  23   0.884   5.269 -13.999
  187    HD1  HIS  23           1HD      HIS  23   3.504   4.435 -14.143
  188    HD2  HIS  23           2HD      HIS  23   1.793   6.027 -17.583
  189    HE1  HIS  23           1HE      HIS  23   5.432   5.118 -15.602
  190    HE2  HIS  23           2HE      HIS  23   4.378   6.179 -17.632
  191    H    ALA  24           HN       ALA  24  -1.969   4.020 -15.069
  192    HA   ALA  24           HA       ALA  24  -2.702   3.970 -12.341
  193    HB1  ALA  24           1HB      ALA  24  -3.963   5.223 -14.020
  194    HB2  ALA  24           2HB      ALA  24  -5.007   4.096 -13.152
  195    HB3  ALA  24           3HB      ALA  24  -4.458   3.713 -14.784
  196    H    ASP  25           HN       ASP  25  -2.767   1.575 -14.894
  197    HA   ASP  25           HA       ASP  25  -4.278  -0.407 -13.547
  198    HB2  ASP  25           2HB      ASP  25  -3.815  -0.339 -16.019
  199    HB3  ASP  25           1HB      ASP  25  -2.162  -0.831 -15.669
  200    H    GLN  26           HN       GLN  26  -0.801   0.148 -13.921
  201    HA   GLN  26           HA       GLN  26   0.157  -2.066 -12.559
  202    HB2  GLN  26           2HB      GLN  26   1.229   0.703 -13.013
  203    HB3  GLN  26           1HB      GLN  26   2.152  -0.489 -12.125
  204    HG2  GLN  26           2HG      GLN  26   1.172  -0.771 -14.950
  205    HG3  GLN  26           1HG      GLN  26   2.819  -0.394 -14.455
  206   HE21  GLN  26          1HE2      GLN  26   4.061  -1.998 -13.435
  207   HE22  GLN  26          2HE2      GLN  26   3.661  -3.679 -13.585
  208    H    TRP  27           HN       TRP  27  -0.990   1.013 -11.319
  209    HA   TRP  27           HA       TRP  27  -0.215   0.472  -8.611
  210    HB2  TRP  27           2HB      TRP  27  -1.754   2.588 -10.029
  211    HB3  TRP  27           1HB      TRP  27  -2.060   2.386  -8.306
  212    HD1  TRP  27           1HD      TRP  27   0.965   3.030 -10.671
  213    HE1  TRP  27           1HE      TRP  27   2.689   4.435  -9.359
  214    HE3  TRP  27           3HE      TRP  27  -1.395   3.181  -6.136
  215    HZ2  TRP  27           2HZ      TRP  27   2.990   5.473  -6.744
  216    HZ3  TRP  27           3HZ      TRP  27  -0.327   4.399  -4.285
  217    HH2  TRP  27           2HH      TRP  27   1.817   5.520  -4.582
  218    H    THR  28           HN       THR  28  -3.290   0.418 -10.388
  219    HA   THR  28           HA       THR  28  -4.908  -0.311  -8.202
  220    HB   THR  28           HB       THR  28  -5.444  -0.921 -11.116
  221    HG1  THR  28           1HG      THR  28  -4.932   1.320 -10.730
  222   HG21  THR  28          3HG2      THR  28  -7.312  -0.449  -8.786
  223   HG22  THR  28          1HG2      THR  28  -6.981  -2.006  -9.546
  224   HG23  THR  28          2HG2      THR  28  -7.800  -0.738 -10.457
  225    H    ASN  29           HN       ASN  29  -3.378  -2.242 -10.737
  226    HA   ASN  29           HA       ASN  29  -4.559  -4.704 -10.204
  227    HB2  ASN  29           2HB      ASN  29  -3.174  -4.027 -12.207
  228    HB3  ASN  29           1HB      ASN  29  -1.743  -4.271 -11.216
  229   HD21  ASN  29          1HD2      ASN  29  -2.712  -5.569 -13.674
  230   HD22  ASN  29          2HD2      ASN  29  -2.733  -7.261 -13.325
  231    H    THR  30           HN       THR  30  -1.538  -3.332  -8.900
  232    HA   THR  30           HA       THR  30  -0.766  -5.612  -7.452
  233    HB   THR  30           HB       THR  30   0.561  -3.913  -6.039
  234    HG1  THR  30           1HG      THR  30  -1.014  -2.187  -7.168
  235   HG21  THR  30          3HG2      THR  30   1.521  -5.225  -7.867
  236   HG22  THR  30          1HG2      THR  30   2.191  -3.593  -7.834
  237   HG23  THR  30          2HG2      THR  30   0.965  -4.020  -9.027
  238    H    ILE  31           HN       ILE  31  -2.726  -2.813  -6.484
  239    HA   ILE  31           HA       ILE  31  -2.904  -3.643  -3.752
  240    HB   ILE  31           HB       ILE  31  -4.609  -1.656  -5.270
  241   HG12  ILE  31          2HG1      ILE  31  -2.217  -1.184  -3.473
  242   HG13  ILE  31          1HG1      ILE  31  -2.193  -1.093  -5.232
  243   HG21  ILE  31          1HG2      ILE  31  -4.265  -2.061  -2.301
  244   HG22  ILE  31          2HG2      ILE  31  -5.703  -2.452  -3.245
  245   HG23  ILE  31          3HG2      ILE  31  -5.196  -0.772  -3.062
  246   HD11  ILE  31          3HD1      ILE  31  -3.787   0.762  -5.148
  247   HD12  ILE  31          1HD1      ILE  31  -2.313   1.118  -4.247
  248   HD13  ILE  31          2HD1      ILE  31  -3.788   0.673  -3.386
  249    H    LYS  32           HN       LYS  32  -5.014  -3.791  -6.561
  250    HA   LYS  32           HA       LYS  32  -7.321  -4.762  -5.321
  251    HB2  LYS  32           2HB      LYS  32  -7.155  -3.862  -7.643
  252    HB3  LYS  32           1HB      LYS  32  -6.346  -5.341  -8.126
  253    HG2  LYS  32           2HG      LYS  32  -8.310  -6.639  -7.689
  254    HG3  LYS  32           1HG      LYS  32  -9.131  -5.238  -6.995
  255    HD2  LYS  32           2HD      LYS  32  -9.028  -4.102  -9.160
  256    HD3  LYS  32           1HD      LYS  32  -8.200  -5.496  -9.852
  257    HE2  LYS  32           2HE      LYS  32 -10.952  -5.587  -8.631
  258    HE3  LYS  32           1HE      LYS  32 -10.637  -5.398 -10.354
  259    HZ1  LYS  32           3HZ      LYS  32  -9.731  -7.706  -8.716
  260    HZ2  LYS  32           1HZ      LYS  32  -9.564  -7.525 -10.397
  261    HZ3  LYS  32           2HZ      LYS  32 -11.104  -7.703  -9.710
  262    H    THR  33           HN       THR  33  -4.457  -6.416  -6.499
  263    HA   THR  33           HA       THR  33  -5.717  -9.014  -6.324
  264    HB   THR  33           HB       THR  33  -2.814  -8.367  -6.888
  265    HG1  THR  33           1HG      THR  33  -3.806  -7.487  -8.592
  266   HG21  THR  33          3HG2      THR  33  -4.475 -10.835  -7.438
  267   HG22  THR  33          1HG2      THR  33  -3.189 -10.697  -6.242
  268   HG23  THR  33          2HG2      THR  33  -2.810 -10.589  -7.961
  269    H    TYR  34           HN       TYR  34  -2.974  -7.407  -4.683
  270    HA   TYR  34           HA       TYR  34  -2.647  -9.659  -2.922
  271    HB2  TYR  34           2HB      TYR  34  -1.282  -6.967  -2.966
  272    HB3  TYR  34           1HB      TYR  34  -0.837  -8.297  -1.903
  273    HD1  TYR  34           2HD      TYR  34  -0.587 -10.624  -3.373
  274    HD2  TYR  34           1HD      TYR  34   0.134  -6.665  -4.741
  275    HE1  TYR  34           2HE      TYR  34   0.928 -11.503  -5.099
  276    HE2  TYR  34           1HE      TYR  34   1.652  -7.530  -6.472
  277    HH   TYR  34           HH       TYR  34   1.790 -10.762  -7.352
  278    H    CYS  35           HN       CYS  35  -3.688  -6.282  -2.511
  279    HA   CYS  35           HA       CYS  35  -3.973  -6.684   0.344
  280    HB2  CYS  35           2HB      CYS  35  -4.569  -4.241  -1.336
  281    HB3  CYS  35           1HB      CYS  35  -4.450  -4.290   0.419
  282    HG   CYS  35           HG       CYS  35  -1.668  -5.289   0.075
  283    H    GLY  36           HN       GLY  36  -5.994  -6.456  -2.470
  284    HA2  GLY  36           2HA      GLY  36  -8.404  -5.582  -1.575
  285    HA3  GLY  36           1HA      GLY  36  -8.237  -6.833  -2.788
  286    HA   PRO  37           HA       PRO  37 -10.136  -9.832  -0.295
  287    HB2  PRO  37           2HB      PRO  37  -8.445 -11.951  -0.032
  288    HB3  PRO  37           1HB      PRO  37  -9.293 -11.557  -1.531
  289    HG2  PRO  37           2HG      PRO  37  -6.474 -10.950  -0.727
  290    HG3  PRO  37           1HG      PRO  37  -7.098 -11.520  -2.287
  291    HD2  PRO  37           2HD      PRO  37  -6.458  -8.932  -1.845
  292    HD3  PRO  37           1HD      PRO  37  -7.784  -9.410  -2.926
  293    H    VAL  38           HN       VAL  38  -7.089  -8.747   0.978
  294    HA   VAL  38           HA       VAL  38  -7.581 -10.093   3.530
  295    HB   VAL  38           HB       VAL  38  -5.152  -8.492   2.709
  296   HG11  VAL  38          1HG1      VAL  38  -5.611 -10.384   5.015
  297   HG12  VAL  38          2HG1      VAL  38  -5.453  -8.630   5.122
  298   HG13  VAL  38          3HG1      VAL  38  -4.079  -9.611   4.611
  299   HG21  VAL  38          3HG2      VAL  38  -5.551 -11.485   2.721
  300   HG22  VAL  38          1HG2      VAL  38  -4.050 -10.637   2.356
  301   HG23  VAL  38          2HG2      VAL  38  -5.439 -10.467   1.284
  302    H    ILE  39           HN       ILE  39  -6.287  -6.863   2.723
  303    HA   ILE  39           HA       ILE  39  -7.622  -5.856   5.135
  304    HB   ILE  39           HB       ILE  39  -6.069  -3.932   4.972
  305   HG12  ILE  39          2HG1      ILE  39  -4.796  -5.528   2.735
  306   HG13  ILE  39          1HG1      ILE  39  -5.685  -4.020   2.533
  307   HG21  ILE  39          1HG2      ILE  39  -4.773  -6.652   5.045
  308   HG22  ILE  39          2HG2      ILE  39  -5.510  -5.799   6.401
  309   HG23  ILE  39          3HG2      ILE  39  -4.047  -5.163   5.649
  310   HD11  ILE  39          3HD1      ILE  39  -3.114  -4.371   4.062
  311   HD12  ILE  39          1HD1      ILE  39  -4.000  -2.858   3.867
  312   HD13  ILE  39          2HD1      ILE  39  -3.286  -3.649   2.461
  313    H    GLY  40           HN       GLY  40  -8.155  -5.981   1.907
  314    HA2  GLY  40           2HA      GLY  40  -8.766  -3.432   1.043
  315    HA3  GLY  40           1HA      GLY  40  -9.579  -4.888   0.495
  316    HA   PRO  41           HA       PRO  41 -13.297  -3.677   2.477
  317    HB2  PRO  41           2HB      PRO  41 -13.703  -6.112   4.023
  318    HB3  PRO  41           1HB      PRO  41 -14.537  -5.567   2.565
  319    HG2  PRO  41           2HG      PRO  41 -12.852  -7.688   2.581
  320    HG3  PRO  41           1HG      PRO  41 -13.069  -6.642   1.166
  321    HD2  PRO  41           2HD      PRO  41 -10.869  -6.638   3.204
  322    HD3  PRO  41           1HD      PRO  41 -10.768  -6.471   1.437
  323    H    LEU  42           HN       LEU  42 -10.664  -3.964   4.393
  324    HA   LEU  42           HA       LEU  42 -12.054  -3.579   6.930
  325    HB2  LEU  42           2HB      LEU  42  -9.082  -3.591   6.371
  326    HB3  LEU  42           1HB      LEU  42  -9.851  -3.644   7.946
  327    HG   LEU  42           HG       LEU  42  -9.890  -5.817   5.850
  328   HD11  LEU  42          1HD1      LEU  42  -8.655  -7.092   7.529
  329   HD12  LEU  42          2HD1      LEU  42  -8.646  -5.684   8.591
  330   HD13  LEU  42          3HD1      LEU  42  -7.786  -5.633   7.053
  331   HD21  LEU  42          3HD2      LEU  42 -11.112  -7.150   7.488
  332   HD22  LEU  42          1HD2      LEU  42 -12.033  -5.721   7.017
  333   HD23  LEU  42          2HD2      LEU  42 -11.196  -5.758   8.568
  334    H    SER  43           HN       SER  43 -11.819  -1.668   8.169
  335    HA   SER  43           HA       SER  43 -11.864   0.748   6.847
  336    HB2  SER  43           2HB      SER  43 -11.145   0.204   9.735
  337    HB3  SER  43           1HB      SER  43 -11.767   1.698   9.072
  338    HG   SER  43           HG       SER  43 -13.615   0.867   9.665
  339    H    VAL  44           HN       VAL  44 -10.313   2.099   6.138
  340    HA   VAL  44           HA       VAL  44  -7.633   1.233   5.950
  341    HB   VAL  44           HB       VAL  44  -8.735   2.707   4.290
  342   HG11  VAL  44          1HG1      VAL  44  -8.426   4.827   6.405
  343   HG12  VAL  44          2HG1      VAL  44  -9.941   4.192   5.765
  344   HG13  VAL  44          3HG1      VAL  44  -8.864   5.125   4.724
  345   HG21  VAL  44          3HG2      VAL  44  -6.809   4.153   3.852
  346   HG22  VAL  44          1HG2      VAL  44  -6.312   2.524   4.315
  347   HG23  VAL  44          2HG2      VAL  44  -6.214   3.842   5.482
  348    H    GLN  45           HN       GLN  45  -9.289   3.097   8.324
  349    HA   GLN  45           HA       GLN  45  -6.954   4.278   9.505
  350    HB2  GLN  45           2HB      GLN  45  -9.270   5.212   9.686
  351    HB3  GLN  45           1HB      GLN  45  -9.698   3.842  10.699
  352    HG2  GLN  45           2HG      GLN  45  -7.979   4.556  12.321
  353    HG3  GLN  45           1HG      GLN  45  -7.672   5.978  11.325
  354   HE21  GLN  45          1HE2      GLN  45  -9.317   7.557  11.126
  355   HE22  GLN  45          2HE2      GLN  45 -10.563   7.689  12.319
  356    H    ASP  46           HN       ASP  46  -8.503   1.236   9.609
  357    HA   ASP  46           HA       ASP  46  -7.582   0.606  12.316
  358    HB2  ASP  46           2HB      ASP  46  -9.972   0.245  11.670
  359    HB3  ASP  46           1HB      ASP  46  -9.437  -0.950  10.500
  360    H    VAL  47           HN       VAL  47  -6.383   0.372   9.286
  361    HA   VAL  47           HA       VAL  47  -5.473  -2.312   9.159
  362    HB   VAL  47           HB       VAL  47  -4.308   0.142   7.824
  363   HG11  VAL  47          1HG1      VAL  47  -2.734  -1.699   7.812
  364   HG12  VAL  47          2HG1      VAL  47  -3.395  -1.467   6.194
  365   HG13  VAL  47          3HG1      VAL  47  -3.977  -2.792   7.202
  366   HG21  VAL  47          3HG2      VAL  47  -6.656  -0.158   7.249
  367   HG22  VAL  47          1HG2      VAL  47  -6.348  -1.843   6.821
  368   HG23  VAL  47          2HG2      VAL  47  -5.626  -0.545   5.870
  369    H    ASP  48           HN       ASP  48  -3.894  -3.267  10.245
  370    HA   ASP  48           HA       ASP  48  -2.169  -1.629  11.944
  371    HB2  ASP  48           2HB      ASP  48  -2.759  -4.595  11.958
  372    HB3  ASP  48           1HB      ASP  48  -1.593  -3.824  13.023
  373    H    THR  49           HN       THR  49   0.063  -2.486  12.276
  374    HA   THR  49           HA       THR  49   1.480  -2.552   9.825
  375    HB   THR  49           HB       THR  49   2.606  -3.379  12.500
  376    HG1  THR  49           1HG      THR  49   2.748  -0.701  11.805
  377   HG21  THR  49          3HG2      THR  49   4.623  -2.251  11.633
  378   HG22  THR  49          1HG2      THR  49   3.768  -1.913  10.128
  379   HG23  THR  49          2HG2      THR  49   4.109  -3.580  10.594
  380    H    LYS  50           HN       LYS  50   0.569  -4.985  12.222
  381    HA   LYS  50           HA       LYS  50   1.992  -7.164  11.175
  382    HB2  LYS  50           2HB      LYS  50   0.811  -7.073  13.399
  383    HB3  LYS  50           1HB      LYS  50  -0.699  -7.307  12.533
  384    HG2  LYS  50           2HG      LYS  50   0.265  -9.413  11.595
  385    HG3  LYS  50           1HG      LYS  50   1.621  -9.211  12.703
  386    HD2  LYS  50           2HD      LYS  50  -1.284  -9.553  13.432
  387    HD3  LYS  50           1HD      LYS  50   0.008 -10.730  13.661
  388    HE2  LYS  50           2HE      LYS  50   1.132  -9.020  15.140
  389    HE3  LYS  50           1HE      LYS  50  -0.366  -8.093  15.061
  390    HZ1  LYS  50           3HZ      LYS  50   0.030 -10.801  16.189
  391    HZ2  LYS  50           1HZ      LYS  50  -1.506 -10.142  15.897
  392    HZ3  LYS  50           2HZ      LYS  50  -0.463  -9.401  17.005
  393    H    LEU  51           HN       LEU  51  -1.241  -5.931  10.472
  394    HA   LEU  51           HA       LEU  51  -2.107  -8.000   8.815
  395    HB2  LEU  51           2HB      LEU  51  -2.786  -5.063   8.705
  396    HB3  LEU  51           1HB      LEU  51  -3.659  -6.323   7.864
  397    HG   LEU  51           HG       LEU  51  -3.477  -5.924  10.840
  398   HD11  LEU  51          1HD1      LEU  51  -5.814  -5.882   8.939
  399   HD12  LEU  51          2HD1      LEU  51  -5.054  -4.467   9.662
  400   HD13  LEU  51          3HD1      LEU  51  -5.888  -5.637  10.683
  401   HD21  LEU  51          3HD2      LEU  51  -4.787  -8.168   9.311
  402   HD22  LEU  51          1HD2      LEU  51  -4.925  -7.884  11.045
  403   HD23  LEU  51          2HD2      LEU  51  -3.364  -8.308  10.345
  404    H    ILE  52           HN       ILE  52  -0.317  -5.045   8.058
  405    HA   ILE  52           HA       ILE  52  -0.133  -5.494   5.271
  406    HB   ILE  52           HB       ILE  52   1.751  -3.946   7.058
  407   HG12  ILE  52          2HG1      ILE  52  -0.619  -3.015   5.426
  408   HG13  ILE  52          1HG1      ILE  52  -0.611  -3.204   7.175
  409   HG21  ILE  52          1HG2      ILE  52   1.356  -3.843   4.069
  410   HG22  ILE  52          2HG2      ILE  52   2.778  -4.454   4.916
  411   HG23  ILE  52          3HG2      ILE  52   2.366  -2.742   5.006
  412   HD11  ILE  52          3HD1      ILE  52  -0.355  -0.878   6.488
  413   HD12  ILE  52          1HD1      ILE  52   1.122  -1.299   5.622
  414   HD13  ILE  52          2HD1      ILE  52   1.052  -1.459   7.377
  415    H    MET  53           HN       MET  53   2.006  -6.350   7.976
  416    HA   MET  53           HA       MET  53   4.081  -7.548   6.531
  417    HB2  MET  53           2HB      MET  53   2.963  -8.250   9.249
  418    HB3  MET  53           1HB      MET  53   4.441  -8.933   8.594
  419    HG2  MET  53           2HG      MET  53   5.465  -6.740   8.541
  420    HG3  MET  53           1HG      MET  53   3.969  -6.010   9.130
  421    HE1  MET  53           3HE      MET  53   5.404  -4.832  11.061
  422    HE2  MET  53           1HE      MET  53   6.875  -5.624  10.500
  423    HE3  MET  53           2HE      MET  53   6.421  -5.714  12.202
  424    H    LYS  54           HN       LYS  54   1.053  -8.875   7.738
  425    HA   LYS  54           HA       LYS  54   1.454 -11.565   7.137
  426    HB2  LYS  54           2HB      LYS  54  -0.372 -10.622   8.537
  427    HB3  LYS  54           1HB      LYS  54  -1.155 -10.037   7.077
  428    HG2  LYS  54           2HG      LYS  54  -1.391 -12.344   6.292
  429    HG3  LYS  54           1HG      LYS  54  -0.635 -12.919   7.781
  430    HD2  LYS  54           2HD      LYS  54  -2.435 -11.813   9.069
  431    HD3  LYS  54           1HD      LYS  54  -3.211 -11.370   7.548
  432    HE2  LYS  54           2HE      LYS  54  -3.366 -13.764   6.973
  433    HE3  LYS  54           1HE      LYS  54  -2.670 -14.160   8.545
  434    HZ1  LYS  54           3HZ      LYS  54  -5.067 -14.328   8.601
  435    HZ2  LYS  54           1HZ      LYS  54  -5.225 -12.722   8.084
  436    HZ3  LYS  54           2HZ      LYS  54  -4.552 -13.060   9.604
  437    H    VAL  55           HN       VAL  55   0.125  -8.968   5.135
  438    HA   VAL  55           HA       VAL  55  -0.561 -10.634   2.931
  439    HB   VAL  55           HB       VAL  55  -0.009  -7.657   2.946
  440   HG11  VAL  55          1HG1      VAL  55   0.043  -8.590   0.696
  441   HG12  VAL  55          2HG1      VAL  55  -1.402  -7.603   0.926
  442   HG13  VAL  55          3HG1      VAL  55  -1.519  -9.363   0.967
  443   HG21  VAL  55          3HG2      VAL  55  -2.593  -9.165   3.308
  444   HG22  VAL  55          1HG2      VAL  55  -2.453  -7.418   3.115
  445   HG23  VAL  55          2HG2      VAL  55  -1.754  -8.209   4.529
  446    H    LEU  56           HN       LEU  56   2.274  -8.709   3.764
  447    HA   LEU  56           HA       LEU  56   3.503  -9.083   1.195
  448    HB2  LEU  56           2HB      LEU  56   4.521  -7.895   3.766
  449    HB3  LEU  56           1HB      LEU  56   5.454  -7.951   2.284
  450    HG   LEU  56           HG       LEU  56   2.840  -6.482   2.657
  451   HD11  LEU  56          1HD1      LEU  56   5.656  -5.450   2.347
  452   HD12  LEU  56          2HD1      LEU  56   4.720  -5.451   3.842
  453   HD13  LEU  56          3HD1      LEU  56   4.194  -4.471   2.472
  454   HD21  LEU  56          3HD2      LEU  56   3.328  -5.554   0.432
  455   HD22  LEU  56          1HD2      LEU  56   3.083  -7.299   0.385
  456   HD23  LEU  56          2HD2      LEU  56   4.715  -6.638   0.300
  457    H    ASP  57           HN       ASP  57   3.535 -10.785   4.198
  458    HA   ASP  57           HA       ASP  57   6.027 -11.891   4.389
  459    HB2  ASP  57           2HB      ASP  57   4.062 -12.276   5.930
  460    HB3  ASP  57           1HB      ASP  57   3.513 -13.494   4.812
  461    HA   PRO  58           HA       PRO  58   5.007 -15.533   1.430
  462    HB2  PRO  58           2HB      PRO  58   2.816 -15.384  -0.159
  463    HB3  PRO  58           1HB      PRO  58   2.783 -16.095   1.459
  464    HG2  PRO  58           2HG      PRO  58   1.937 -13.362   0.572
  465    HG3  PRO  58           1HG      PRO  58   1.135 -14.475   1.698
  466    HD2  PRO  58           2HD      PRO  58   2.642 -12.376   2.532
  467    HD3  PRO  58           1HD      PRO  58   2.506 -13.882   3.454
  468    H    ILE  59           HN       ILE  59   4.708 -12.238   0.646
  469    HA   ILE  59           HA       ILE  59   5.313 -12.622  -2.178
  470    HB   ILE  59           HB       ILE  59   5.052  -9.997  -0.711
  471   HG12  ILE  59          2HG1      ILE  59   2.913 -11.541  -2.206
  472   HG13  ILE  59          1HG1      ILE  59   2.991 -11.348  -0.457
  473   HG21  ILE  59          1HG2      ILE  59   6.176  -9.888  -2.877
  474   HG22  ILE  59          2HG2      ILE  59   4.596  -9.110  -2.949
  475   HG23  ILE  59          3HG2      ILE  59   4.816 -10.719  -3.635
  476   HD11  ILE  59          3HD1      ILE  59   1.373  -9.834  -1.477
  477   HD12  ILE  59          1HD1      ILE  59   2.661  -9.116  -2.445
  478   HD13  ILE  59          2HD1      ILE  59   2.682  -8.952  -0.690
  479    H    TRP  60           HN       TRP  60   6.813 -11.425   0.794
  480    HA   TRP  60           HA       TRP  60   9.123 -10.272  -0.210
  481    HB2  TRP  60           2HB      TRP  60   8.671 -11.837   2.329
  482    HB3  TRP  60           1HB      TRP  60  10.207 -11.066   1.957
  483    HD1  TRP  60           1HD      TRP  60   7.272 -10.425   3.918
  484    HE1  TRP  60           1HE      TRP  60   6.937  -7.915   4.363
  485    HE3  TRP  60           3HE      TRP  60  10.438  -8.520   0.370
  486    HZ2  TRP  60           2HZ      TRP  60   7.873  -5.466   3.360
  487    HZ3  TRP  60           3HZ      TRP  60  10.653  -6.075   0.186
  488    HH2  TRP  60           2HH      TRP  60   9.395  -4.584   1.652
  489    H    GLU  61           HN       GLU  61   8.356 -13.666   0.187
  490    HA   GLU  61           HA       GLU  61  11.034 -14.534  -0.310
  491    HB2  GLU  61           2HB      GLU  61   8.434 -16.050  -0.144
  492    HB3  GLU  61           1HB      GLU  61  10.034 -16.756  -0.154
  493    HG2  GLU  61           2HG      GLU  61  10.554 -15.548   1.933
  494    HG3  GLU  61           1HG      GLU  61   8.893 -14.956   1.957
  495    H    GLN  62           HN       GLN  62   8.010 -14.332  -2.128
  496    HA   GLN  62           HA       GLN  62   9.095 -15.820  -4.359
  497    HB2  GLN  62           2HB      GLN  62   6.439 -14.410  -4.055
  498    HB3  GLN  62           1HB      GLN  62   6.877 -15.510  -5.351
  499    HG2  GLN  62           2HG      GLN  62   6.759 -16.271  -2.446
  500    HG3  GLN  62           1HG      GLN  62   5.451 -16.521  -3.598
  501   HE21  GLN  62          1HE2      GLN  62   5.493 -18.727  -3.287
  502   HE22  GLN  62          2HE2      GLN  62   6.742 -19.732  -3.942
  503    H    LYS  63           HN       LYS  63   7.836 -12.527  -3.855
  504    HA   LYS  63           HA       LYS  63   9.503 -11.617  -6.089
  505    HB2  LYS  63           2HB      LYS  63   6.553 -11.041  -5.734
  506    HB3  LYS  63           1HB      LYS  63   7.594 -10.163  -6.845
  507    HG2  LYS  63           2HG      LYS  63   7.909 -12.053  -8.210
  508    HG3  LYS  63           1HG      LYS  63   7.272 -13.143  -6.980
  509    HD2  LYS  63           2HD      LYS  63   5.657 -12.810  -8.770
  510    HD3  LYS  63           1HD      LYS  63   5.052 -12.162  -7.248
  511    HE2  LYS  63           2HE      LYS  63   4.549 -10.652  -9.083
  512    HE3  LYS  63           1HE      LYS  63   5.690  -9.902  -7.968
  513    HZ1  LYS  63           3HZ      LYS  63   7.479 -10.353  -9.470
  514    HZ2  LYS  63           1HZ      LYS  63   6.245  -9.575 -10.338
  515    HZ3  LYS  63           2HZ      LYS  63   6.469 -11.249 -10.501
  516    HA   PRO  64           HA       PRO  64  10.008  -9.075  -2.221
  517    HB2  PRO  64           2HB      PRO  64  12.718  -8.788  -3.356
  518    HB3  PRO  64           1HB      PRO  64  12.229  -9.259  -1.727
  519    HG2  PRO  64           2HG      PRO  64  13.245 -11.033  -3.472
  520    HG3  PRO  64           1HG      PRO  64  11.998 -11.481  -2.294
  521    HD2  PRO  64           2HD      PRO  64  11.747 -10.947  -5.220
  522    HD3  PRO  64           1HD      PRO  64  10.901 -12.139  -4.212
  523    H    GLU  65           HN       GLU  65  11.107  -8.532  -5.508
  524    HA   GLU  65           HA       GLU  65  11.453  -5.761  -5.429
  525    HB2  GLU  65           2HB      GLU  65  12.253  -7.151  -7.259
  526    HB3  GLU  65           1HB      GLU  65  10.603  -7.564  -7.690
  527    HG2  GLU  65           2HG      GLU  65  10.226  -5.122  -8.141
  528    HG3  GLU  65           1HG      GLU  65  11.967  -4.910  -7.962
  529    H    THR  66           HN       THR  66   8.627  -7.729  -6.215
  530    HA   THR  66           HA       THR  66   6.932  -5.508  -6.775
  531    HB   THR  66           HB       THR  66   6.109  -8.337  -6.104
  532    HG1  THR  66           1HG      THR  66   7.077  -7.141  -8.499
  533   HG21  THR  66          3HG2      THR  66   4.269  -6.717  -6.137
  534   HG22  THR  66          1HG2      THR  66   4.163  -7.825  -7.506
  535   HG23  THR  66          2HG2      THR  66   4.765  -6.183  -7.743
  536    H    ALA  67           HN       ALA  67   7.657  -7.453  -3.957
  537    HA   ALA  67           HA       ALA  67   5.514  -6.679  -2.317
  538    HB1  ALA  67           1HB      ALA  67   6.993  -8.563  -1.802
  539    HB2  ALA  67           2HB      ALA  67   6.880  -7.431  -0.454
  540    HB3  ALA  67           3HB      ALA  67   8.311  -7.434  -1.486
  541    H    SER  68           HN       SER  68   8.788  -5.304  -2.625
  542    HA   SER  68           HA       SER  68   8.351  -3.260  -0.711
  543    HB2  SER  68           2HB      SER  68  10.419  -2.236  -1.808
  544    HB3  SER  68           1HB      SER  68  10.603  -3.857  -1.144
  545    HG   SER  68           HG       SER  68  10.643  -2.995  -3.784
  546    H    ARG  69           HN       ARG  69   7.861  -3.459  -4.182
  547    HA   ARG  69           HA       ARG  69   7.304  -0.698  -4.547
  548    HB2  ARG  69           2HB      ARG  69   6.773  -3.164  -6.192
  549    HB3  ARG  69           1HB      ARG  69   6.225  -1.579  -6.695
  550    HG2  ARG  69           2HG      ARG  69   8.517  -0.760  -6.682
  551    HG3  ARG  69           1HG      ARG  69   9.073  -2.346  -6.153
  552    HD2  ARG  69           2HD      ARG  69   8.320  -3.350  -8.207
  553    HD3  ARG  69           1HD      ARG  69   7.598  -1.827  -8.728
  554    HE   ARG  69           HE       ARG  69  10.161  -1.121  -8.388
  555   HH11  ARG  69          1HH1      ARG  69   8.741  -3.869 -10.047
  556   HH12  ARG  69          2HH1      ARG  69  10.025  -3.983 -11.208
  557   HH21  ARG  69          1HH2      ARG  69  11.832  -1.271  -9.916
  558   HH22  ARG  69          2HH2      ARG  69  11.793  -2.520 -11.129
  559    H    LEU  70           HN       LEU  70   5.381  -3.525  -3.746
  560    HA   LEU  70           HA       LEU  70   2.837  -2.316  -3.981
  561    HB2  LEU  70           2HB      LEU  70   3.122  -4.741  -3.814
  562    HB3  LEU  70           1HB      LEU  70   3.750  -4.568  -2.185
  563    HG   LEU  70           HG       LEU  70   1.552  -3.673  -1.464
  564   HD11  LEU  70          1HD1      LEU  70   0.773  -2.784  -3.580
  565   HD12  LEU  70          2HD1      LEU  70  -0.382  -3.957  -2.948
  566   HD13  LEU  70          3HD1      LEU  70   0.703  -4.410  -4.261
  567   HD21  LEU  70          3HD2      LEU  70   2.072  -6.022  -1.157
  568   HD22  LEU  70          1HD2      LEU  70   1.489  -6.383  -2.782
  569   HD23  LEU  70          2HD2      LEU  70   0.366  -5.816  -1.548
  570    H    ARG  71           HN       ARG  71   5.224  -2.437  -1.400
  571    HA   ARG  71           HA       ARG  71   3.728  -1.288   0.664
  572    HB2  ARG  71           2HB      ARG  71   6.116  -2.208   0.775
  573    HB3  ARG  71           1HB      ARG  71   6.635  -0.650   0.147
  574    HG2  ARG  71           2HG      ARG  71   5.342   0.352   2.126
  575    HG3  ARG  71           1HG      ARG  71   5.367  -1.284   2.785
  576    HD2  ARG  71           2HD      ARG  71   7.278  -0.439   3.724
  577    HD3  ARG  71           1HD      ARG  71   7.935  -1.112   2.231
  578    HE   ARG  71           HE       ARG  71   7.130   1.692   2.163
  579   HH11  ARG  71          1HH1      ARG  71   9.744  -0.636   2.407
  580   HH12  ARG  71          2HH1      ARG  71  10.982   0.536   2.067
  581   HH21  ARG  71          1HH2      ARG  71   8.745   3.224   1.759
  582   HH22  ARG  71          2HH2      ARG  71  10.413   2.729   1.711
  583    H    GLY  72           HN       GLY  72   5.445   0.135  -2.053
  584    HA2  GLY  72           2HA      GLY  72   5.241   2.840  -1.332
  585    HA3  GLY  72           1HA      GLY  72   5.414   2.232  -2.972
  586    H    ARG  73           HN       ARG  73   2.947   0.686  -2.893
  587    HA   ARG  73           HA       ARG  73   1.088   2.679  -3.684
  588    HB2  ARG  73           2HB      ARG  73   0.951  -0.273  -3.219
  589    HB3  ARG  73           1HB      ARG  73  -0.552   0.623  -3.328
  590    HG2  ARG  73           2HG      ARG  73  -0.121  -0.259  -5.464
  591    HG3  ARG  73           1HG      ARG  73   0.219   1.467  -5.552
  592    HD2  ARG  73           2HD      ARG  73   2.547   1.112  -5.572
  593    HD3  ARG  73           1HD      ARG  73   2.372  -0.569  -5.061
  594    HE   ARG  73           HE       ARG  73   1.229  -0.880  -7.302
  595   HH11  ARG  73          1HH1      ARG  73   3.722   1.534  -6.765
  596   HH12  ARG  73          2HH1      ARG  73   4.235   1.543  -8.425
  597   HH21  ARG  73          1HH2      ARG  73   1.906  -0.874  -9.468
  598   HH22  ARG  73          2HH2      ARG  73   3.201   0.169  -9.963
  599    H    ILE  74           HN       ILE  74   1.267   0.570  -0.838
  600    HA   ILE  74           HA       ILE  74  -1.063   1.606   0.410
  601    HB   ILE  74           HB       ILE  74   1.266   0.199   1.735
  602   HG12  ILE  74          2HG1      ILE  74  -1.236  -1.001   0.520
  603   HG13  ILE  74          1HG1      ILE  74   0.364  -1.053  -0.218
  604   HG21  ILE  74          1HG2      ILE  74  -0.301   1.273   3.287
  605   HG22  ILE  74          2HG2      ILE  74  -0.372  -0.485   3.400
  606   HG23  ILE  74          3HG2      ILE  74  -1.636   0.392   2.542
  607   HD11  ILE  74          3HD1      ILE  74  -0.452  -2.327   2.388
  608   HD12  ILE  74          1HD1      ILE  74   1.177  -2.339   1.711
  609   HD13  ILE  74          2HD1      ILE  74  -0.136  -3.149   0.859
  610    H    GLU  75           HN       GLU  75   2.361   2.308   0.668
  611    HA   GLU  75           HA       GLU  75   2.382   3.965   2.909
  612    HB2  GLU  75           2HB      GLU  75   4.331   2.980   1.624
  613    HB3  GLU  75           1HB      GLU  75   4.117   4.276   0.460
  614    HG2  GLU  75           2HG      GLU  75   4.567   5.920   2.189
  615    HG3  GLU  75           1HG      GLU  75   4.754   4.629   3.377
  616    H    SER  76           HN       SER  76   1.947   4.815  -0.526
  617    HA   SER  76           HA       SER  76   1.739   7.610   0.039
  618    HB2  SER  76           2HB      SER  76   2.595   6.667  -2.123
  619    HB3  SER  76           1HB      SER  76   0.939   6.204  -2.498
  620    HG   SER  76           HG       SER  76   1.271   8.842  -1.724
  621    H    VAL  77           HN       VAL  77  -0.547   4.973  -0.402
  622    HA   VAL  77           HA       VAL  77  -2.857   6.607  -0.606
  623    HB   VAL  77           HB       VAL  77  -2.558   3.731   0.276
  624   HG11  VAL  77          1HG1      VAL  77  -5.085   5.286  -0.293
  625   HG12  VAL  77          2HG1      VAL  77  -4.579   4.660   1.276
  626   HG13  VAL  77          3HG1      VAL  77  -4.992   3.543  -0.025
  627   HG21  VAL  77          3HG2      VAL  77  -3.497   3.254  -1.943
  628   HG22  VAL  77          1HG2      VAL  77  -1.982   4.153  -2.050
  629   HG23  VAL  77          2HG2      VAL  77  -3.520   4.980  -2.297
  630    H    LEU  78           HN       LEU  78  -1.284   5.007   2.157
  631    HA   LEU  78           HA       LEU  78  -3.085   5.999   4.109
  632    HB2  LEU  78           2HB      LEU  78  -0.198   5.153   4.380
  633    HB3  LEU  78           1HB      LEU  78  -1.281   5.455   5.724
  634    HG   LEU  78           HG       LEU  78  -1.640   3.289   3.651
  635   HD11  LEU  78          1HD1      LEU  78  -0.820   3.102   6.544
  636   HD12  LEU  78          2HD1      LEU  78   0.256   2.893   5.163
  637   HD13  LEU  78          3HD1      LEU  78  -1.062   1.753   5.436
  638   HD21  LEU  78          3HD2      LEU  78  -3.422   2.488   5.111
  639   HD22  LEU  78          1HD2      LEU  78  -3.763   4.119   4.532
  640   HD23  LEU  78          2HD2      LEU  78  -3.178   3.871   6.177
  641    H    ASP  79           HN       ASP  79  -0.152   7.265   2.659
  642    HA   ASP  79           HA       ASP  79   0.250   9.516   4.285
  643    HB2  ASP  79           2HB      ASP  79   1.874   8.737   2.608
  644    HB3  ASP  79           1HB      ASP  79   0.759   9.160   1.317
  645    H    TRP  80           HN       TRP  80  -1.627   9.094   1.321
  646    HA   TRP  80           HA       TRP  80  -2.723  11.672   1.172
  647    HB2  TRP  80           2HB      TRP  80  -2.749  10.179  -0.721
  648    HB3  TRP  80           1HB      TRP  80  -3.714   9.003   0.158
  649    HD1  TRP  80           1HD      TRP  80  -4.034  12.491  -1.457
  650    HE1  TRP  80           1HE      TRP  80  -6.513  12.870  -2.070
  651    HE3  TRP  80           3HE      TRP  80  -6.035   8.283   0.641
  652    HZ2  TRP  80           2HZ      TRP  80  -8.974  11.545  -1.719
  653    HZ3  TRP  80           3HZ      TRP  80  -8.458   7.914   0.456
  654    HH2  TRP  80           2HH      TRP  80  -9.895   9.510  -0.697
  655    H    ALA  81           HN       ALA  81  -3.938   8.689   2.651
  656    HA   ALA  81           HA       ALA  81  -6.444   9.652   3.451
  657    HB1  ALA  81           1HB      ALA  81  -5.816   7.275   3.369
  658    HB2  ALA  81           2HB      ALA  81  -6.533   7.734   4.913
  659    HB3  ALA  81           3HB      ALA  81  -4.788   7.515   4.782
  660    H    THR  82           HN       THR  82  -3.298   9.824   5.005
  661    HA   THR  82           HA       THR  82  -4.145  10.651   7.551
  662    HB   THR  82           HB       THR  82  -1.565  11.294   6.107
  663    HG1  THR  82           1HG      THR  82  -1.881   9.056   6.361
  664   HG21  THR  82          3HG2      THR  82  -1.931  12.790   8.004
  665   HG22  THR  82          1HG2      THR  82  -0.632  11.648   8.351
  666   HG23  THR  82          2HG2      THR  82  -2.232  11.405   9.053
  667    H    VAL  83           HN       VAL  83  -3.329  12.499   4.637
  668    HA   VAL  83           HA       VAL  83  -3.622  15.052   5.885
  669    HB   VAL  83           HB       VAL  83  -3.695  14.416   2.927
  670   HG11  VAL  83          1HG1      VAL  83  -2.939  16.737   2.667
  671   HG12  VAL  83          2HG1      VAL  83  -3.062  16.965   4.412
  672   HG13  VAL  83          3HG1      VAL  83  -4.512  16.646   3.460
  673   HG21  VAL  83          3HG2      VAL  83  -1.664  13.529   3.923
  674   HG22  VAL  83          1HG2      VAL  83  -1.349  15.078   4.705
  675   HG23  VAL  83          2HG2      VAL  83  -1.296  14.952   2.947
  676    H    ARG  84           HN       ARG  84  -5.702  13.031   3.847
  677    HA   ARG  84           HA       ARG  84  -7.857  14.864   3.778
  678    HB2  ARG  84           2HB      ARG  84  -7.296  12.135   2.879
  679    HB3  ARG  84           1HB      ARG  84  -8.978  12.419   3.297
  680    HG2  ARG  84           2HG      ARG  84  -8.357  12.784   0.887
  681    HG3  ARG  84           1HG      ARG  84  -9.197  14.102   1.687
  682    HD2  ARG  84           2HD      ARG  84  -6.209  14.069   1.531
  683    HD3  ARG  84           1HD      ARG  84  -7.179  14.659   0.183
  684    HE   ARG  84           HE       ARG  84  -8.001  15.893   2.598
  685   HH11  ARG  84          1HH1      ARG  84  -5.443  15.982   0.188
  686   HH12  ARG  84          2HH1      ARG  84  -4.995  17.627   0.557
  687   HH21  ARG  84          1HH2      ARG  84  -7.418  18.044   3.053
  688   HH22  ARG  84          2HH2      ARG  84  -6.137  18.802   2.159
  689    H    GLY  85           HN       GLY  85  -6.704  12.849   6.241
  690    HA2  GLY  85           2HA      GLY  85  -7.427  13.070   8.448
  691    HA3  GLY  85           1HA      GLY  85  -8.934  13.751   7.864
  692    H    TYR  86           HN       TYR  86  -8.074  10.840   6.299
  693    HA   TYR  86           HA       TYR  86 -10.300   9.455   7.419
  694    HB2  TYR  86           2HB      TYR  86  -8.030   8.561   5.641
  695    HB3  TYR  86           1HB      TYR  86  -9.290   7.459   6.187
  696    HD1  TYR  86           2HD      TYR  86 -11.726   8.167   5.684
  697    HD2  TYR  86           1HD      TYR  86  -8.343   9.795   3.688
  698    HE1  TYR  86           2HE      TYR  86 -13.168   8.866   3.827
  699    HE2  TYR  86           1HE      TYR  86  -9.782  10.506   1.823
  700    HH   TYR  86           HH       TYR  86 -11.895  10.028   0.843
  701    H    ARG  87           HN       ARG  87  -6.861   9.480   8.002
  702    HA   ARG  87           HA       ARG  87  -7.384   8.502  10.670
  703    HB2  ARG  87           2HB      ARG  87  -5.858   6.718  10.684
  704    HB3  ARG  87           1HB      ARG  87  -6.726   6.506   9.176
  705    HG2  ARG  87           2HG      ARG  87  -4.837   7.636   8.008
  706    HG3  ARG  87           1HG      ARG  87  -3.962   7.630   9.542
  707    HD2  ARG  87           2HD      ARG  87  -4.793   5.306   7.833
  708    HD3  ARG  87           1HD      ARG  87  -3.184   5.727   8.415
  709    HE   ARG  87           HE       ARG  87  -5.339   4.529  10.025
  710   HH11  ARG  87          1HH1      ARG  87  -1.965   5.370   9.639
  711   HH12  ARG  87          2HH1      ARG  87  -1.425   4.331  10.930
  712   HH21  ARG  87          1HH2      ARG  87  -4.641   3.140  11.700
  713   HH22  ARG  87          2HH2      ARG  87  -2.947   3.055  12.078
  714    H    GLU  88           HN       GLU  88  -5.691   9.126  12.128
  715    HA   GLU  88           HA       GLU  88  -4.474  11.586  11.299
  716    HB2  GLU  88           2HB      GLU  88  -4.404  10.099  13.923
  717    HB3  GLU  88           1HB      GLU  88  -3.641  11.664  13.663
  718    HG2  GLU  88           2HG      GLU  88  -5.854  12.576  13.015
  719    HG3  GLU  88           1HG      GLU  88  -6.575  11.026  13.443
  720    H    GLY  89           HN       GLY  89  -2.110  11.913  12.300
  721    HA2  GLY  89           2HA      GLY  89  -0.484  10.879  10.314
  722    HA3  GLY  89           1HA      GLY  89   0.100  11.652  11.767
  723    H    ASP  90           HN       ASP  90  -0.391   8.734  10.101
  724    HA   ASP  90           HA       ASP  90   1.684   7.431  11.526
  725    HB2  ASP  90           2HB      ASP  90  -0.063   7.001  13.175
  726    HB3  ASP  90           1HB      ASP  90  -1.123   6.365  11.923
  727    H    ASN  91           HN       ASN  91   2.563   5.832  10.294
  728    HA   ASN  91           HA       ASN  91   1.038   4.896   7.966
  729    HB2  ASN  91           2HB      ASN  91   2.489   6.803   7.260
  730    HB3  ASN  91           1HB      ASN  91   3.893   5.881   7.790
  731   HD21  ASN  91          1HD2      ASN  91   1.534   6.311   5.316
  732   HD22  ASN  91          2HD2      ASN  91   2.163   5.147   4.218
  733    HA   PRO  92           HA       PRO  92   2.947   1.361  10.194
  734    HB2  PRO  92           2HB      PRO  92   0.992  -0.407   9.491
  735    HB3  PRO  92           1HB      PRO  92   0.867   0.681  10.877
  736    HG2  PRO  92           2HG      PRO  92  -0.273   0.979   8.125
  737    HG3  PRO  92           1HG      PRO  92  -1.041   1.288   9.694
  738    HD2  PRO  92           2HD      PRO  92  -0.053   3.280   8.169
  739    HD3  PRO  92           1HD      PRO  92   0.004   3.339   9.941
  740    H    ALA  93           HN       ALA  93   2.472   2.109   6.957
  741    HA   ALA  93           HA       ALA  93   3.165  -0.486   5.885
  742    HB1  ALA  93           1HB      ALA  93   1.554   0.952   4.717
  743    HB2  ALA  93           2HB      ALA  93   2.948   0.563   3.710
  744    HB3  ALA  93           3HB      ALA  93   2.820   2.153   4.465
  745    H    ARG  94           HN       ARG  94   4.673   2.724   6.130
  746    HA   ARG  94           HA       ARG  94   6.980   1.945   4.660
  747    HB2  ARG  94           2HB      ARG  94   6.255   4.258   4.698
  748    HB3  ARG  94           1HB      ARG  94   6.494   4.336   6.436
  749    HG2  ARG  94           2HG      ARG  94   8.799   4.360   6.247
  750    HG3  ARG  94           1HG      ARG  94   8.774   3.670   4.623
  751    HD2  ARG  94           2HD      ARG  94   9.373   6.067   4.651
  752    HD3  ARG  94           1HD      ARG  94   7.919   5.732   3.715
  753    HE   ARG  94           HE       ARG  94   7.754   6.735   6.489
  754   HH11  ARG  94          1HH1      ARG  94   6.923   6.944   3.090
  755   HH12  ARG  94          2HH1      ARG  94   5.853   8.302   3.302
  756   HH21  ARG  94          1HH2      ARG  94   6.364   8.518   6.773
  757   HH22  ARG  94          2HH2      ARG  94   5.556   9.219   5.401
  758    H    TRP  95           HN       TRP  95   8.817   1.132   5.277
  759    HA   TRP  95           HA       TRP  95   9.379   0.767   8.145
  760    HB2  TRP  95           2HB      TRP  95   9.636  -1.114   5.827
  761    HB3  TRP  95           1HB      TRP  95  10.770  -1.248   7.167
  762    HD1  TRP  95           1HD      TRP  95   9.455  -1.439   9.679
  763    HE1  TRP  95           1HE      TRP  95   7.479  -2.971  10.256
  764    HE3  TRP  95           3HE      TRP  95   7.674  -2.259   4.965
  765    HZ2  TRP  95           2HZ      TRP  95   5.418  -4.342   8.894
  766    HZ3  TRP  95           3HZ      TRP  95   5.696  -3.694   4.685
  767    HH2  TRP  95           2HH      TRP  95   4.593  -4.714   6.610
  768    H    ARG  96           HN       ARG  96  11.526   1.031   8.799
  769    HA   ARG  96           HA       ARG  96  13.281   2.277   6.820
  770    HB2  ARG  96           2HB      ARG  96  14.385   3.351   8.585
  771    HB3  ARG  96           1HB      ARG  96  12.697   3.426   9.046
  772    HG2  ARG  96           2HG      ARG  96  13.014   1.573  10.578
  773    HG3  ARG  96           1HG      ARG  96  14.700   1.430  10.079
  774    HD2  ARG  96           2HD      ARG  96  14.932   3.870  10.815
  775    HD3  ARG  96           1HD      ARG  96  13.379   3.643  11.622
  776    HE   ARG  96           HE       ARG  96  15.522   1.753  12.228
  777   HH11  ARG  96          1HH1      ARG  96  13.492   4.424  13.241
  778   HH12  ARG  96          2HH1      ARG  96  14.009   4.344  14.902
  779   HH21  ARG  96          1HH2      ARG  96  16.213   1.654  14.398
  780   HH22  ARG  96          2HH2      ARG  96  15.541   2.757  15.563
  781    H    GLY  97           HN       GLY  97  12.883  -0.434   8.944
  782    HA2  GLY  97           2HA      GLY  97  15.110  -1.786   7.678
  783    HA3  GLY  97           1HA      GLY  97  15.333  -1.452   9.387
  784    H    TYR  98           HN       TYR  98  12.574  -2.589   7.419
  785    HA   TYR  98           HA       TYR  98  11.731  -4.518   9.314
  786    HB2  TYR  98           2HB      TYR  98  10.266  -3.680   7.502
  787    HB3  TYR  98           1HB      TYR  98  11.277  -4.496   6.315
  788    HD1  TYR  98           1HD      TYR  98   9.118  -5.139   9.278
  789    HD2  TYR  98           2HD      TYR  98  10.832  -6.720   5.719
  790    HE1  TYR  98           1HE      TYR  98   7.756  -7.171   9.532
  791    HE2  TYR  98           2HE      TYR  98   9.476  -8.756   5.964
  792    HH   TYR  98           HH       TYR  98   8.337 -10.010   7.797
  793    H    LEU  99           HN       LEU  99  13.806  -4.652   6.470
  794    HA   LEU  99           HA       LEU  99  14.624  -7.380   7.149
  795    HB2  LEU  99           2HB      LEU  99  15.136  -5.725   4.672
  796    HB3  LEU  99           1HB      LEU  99  15.672  -7.374   4.913
  797    HG   LEU  99           HG       LEU  99  12.785  -6.497   4.794
  798   HD11  LEU  99          1HD1      LEU  99  12.758  -7.630   2.620
  799   HD12  LEU  99          2HD1      LEU  99  14.497  -7.898   2.746
  800   HD13  LEU  99          3HD1      LEU  99  13.863  -6.256   2.634
  801   HD21  LEU  99          3HD2      LEU  99  12.334  -8.916   4.637
  802   HD22  LEU  99          1HD2      LEU  99  13.071  -8.466   6.175
  803   HD23  LEU  99          2HD2      LEU  99  14.044  -9.235   4.921
  804    H    GLU 100           HN       GLU 100  16.226  -4.485   5.825
  805    HA   GLU 100           HA       GLU 100  18.093  -4.287   7.973
  806    HB2  GLU 100           2HB      GLU 100  19.068  -6.219   6.820
  807    HB3  GLU 100           1HB      GLU 100  19.072  -5.330   5.303
  808    HG2  GLU 100           2HG      GLU 100  20.637  -3.702   6.323
  809    HG3  GLU 100           1HG      GLU 100  20.704  -4.724   7.759
  810    H    HIS 101           HN       HIS 101  19.199  -2.327   7.912
  811    HA   HIS 101           HA       HIS 101  18.396  -0.437   5.872
  812    HB2  HIS 101           2HB      HIS 101  19.578   1.252   7.168
  813    HB3  HIS 101           1HB      HIS 101  18.563   0.297   8.235
  814    HD1  HIS 101           1HD      HIS 101  21.635   1.880   8.347
  815    HD2  HIS 101           2HD      HIS 101  20.447  -1.992   9.293
  816    HE1  HIS 101           1HE      HIS 101  23.405   0.984   9.889
  817    HE2  HIS 101           2HE      HIS 101  22.536  -1.261  10.629
  818    H    HIS 102           HN       HIS 102  19.306  -0.960   3.954
  819    HA   HIS 102           HA       HIS 102  22.247  -1.109   3.862
  820    HB2  HIS 102           2HB      HIS 102  20.843  -3.313   3.555
  821    HB3  HIS 102           1HB      HIS 102  20.551  -2.673   1.943
  822    HD1  HIS 102           1HD      HIS 102  22.780  -4.794   3.721
  823    HD2  HIS 102           2HD      HIS 102  23.202  -2.061   0.609
  824    HE1  HIS 102           1HE      HIS 102  24.953  -5.377   2.590
  825    HE2  HIS 102           2HE      HIS 102  25.050  -3.878   0.563
  826    H    HIS 103           HN       HIS 103  23.154   0.268   2.469
  827    HA   HIS 103           HA       HIS 103  21.464   1.414   0.346
  828    HB2  HIS 103           2HB      HIS 103  23.118   2.829   2.394
  829    HB3  HIS 103           1HB      HIS 103  22.952   3.537   0.791
  830    HD1  HIS 103           1HD      HIS 103  21.350   3.474   4.017
  831    HD2  HIS 103           2HD      HIS 103  20.096   3.868   0.068
  832    HE1  HIS 103           1HE      HIS 103  19.048   4.483   4.130
  833    HE2  HIS 103           2HE      HIS 103  18.412   4.916   1.724
  834    H    HIS 104           HN       HIS 104  22.250   0.913  -1.540
  835    HA   HIS 104           HA       HIS 104  25.089   1.409  -2.065
  836    HB2  HIS 104           2HB      HIS 104  23.829  -1.183  -2.108
  837    HB3  HIS 104           1HB      HIS 104  24.321  -0.743  -3.739
  838    HD1  HIS 104           1HD      HIS 104  26.625  -1.451  -4.305
  839    HD2  HIS 104           2HD      HIS 104  26.164  -0.775  -0.219
  840    HE1  HIS 104           1HE      HIS 104  28.823  -2.077  -3.254
  841    HE2  HIS 104           2HE      HIS 104  28.481  -1.789  -0.774
  842    H    HIS 105           HN       HIS 105  25.273   2.767  -3.757
  843    HA   HIS 105           HA       HIS 105  22.945   3.247  -5.420
  844    HB2  HIS 105           2HB      HIS 105  24.290   4.987  -6.528
  845    HB3  HIS 105           1HB      HIS 105  24.264   5.189  -4.786
  846    HD1  HIS 105           1HD      HIS 105  26.454   5.662  -3.758
  847    HD2  HIS 105           2HD      HIS 105  26.852   3.711  -7.415
  848    HE1  HIS 105           1HE      HIS 105  28.927   5.568  -4.218
  849    HE2  HIS 105           2HE      HIS 105  29.127   4.586  -6.527
  850    H    HIS 106           HN       HIS 106  25.853   1.463  -5.512
  851    HA   HIS 106           HA       HIS 106  24.997  -0.166  -7.623
  852    HB2  HIS 106           2HB      HIS 106  25.695   1.844  -8.972
  853    HB3  HIS 106           1HB      HIS 106  27.330   1.623  -8.361
  854    HD1  HIS 106           1HD      HIS 106  27.693   1.447 -11.090
  855    HD2  HIS 106           2HD      HIS 106  25.886  -1.774  -9.169
  856    HE1  HIS 106           1HE      HIS 106  27.943  -0.516 -12.656
  857    HE2  HIS 106           2HE      HIS 106  26.735  -2.423 -11.520
  Start of MODEL   18
    1    H1   MET   1           H1       MET   1 -16.240   1.591   4.425
    2    H2   MET   1           H2       MET   1 -16.504   3.263   4.462
    3    H3   MET   1           H3       MET   1 -15.381   2.557   5.518
    4    HA   MET   1           HA       MET   1 -15.153   2.605   2.570
    5    HB2  MET   1           2HB      MET   1 -14.822   4.836   3.573
    6    HB3  MET   1           1HB      MET   1 -13.615   4.162   4.661
    7    HG2  MET   1           2HG      MET   1 -12.410   5.197   2.913
    8    HG3  MET   1           1HG      MET   1 -12.324   3.468   2.616
    9    HE1  MET   1           2HE      MET   1 -15.492   5.735   1.948
   10    HE2  MET   1           3HE      MET   1 -15.157   6.288   0.307
   11    HE3  MET   1           1HE      MET   1 -14.125   6.805   1.640
   12    H    THR   2           HN       THR   2 -13.879   1.067   1.820
   13    HA   THR   2           HA       THR   2 -12.288  -0.490   3.714
   14    HB   THR   2           HB       THR   2 -12.073  -2.116   1.845
   15    HG1  THR   2           1HG      THR   2 -14.038  -0.606   0.463
   16   HG21  THR   2          3HG2      THR   2 -13.921  -2.306   3.461
   17   HG22  THR   2          1HG2      THR   2 -14.393  -2.872   1.857
   18   HG23  THR   2          2HG2      THR   2 -14.919  -1.287   2.424
   19    H    PHE   3           HN       PHE   3 -10.129  -1.256   2.918
   20    HA   PHE   3           HA       PHE   3  -8.437   0.896   2.330
   21    HB2  PHE   3           2HB      PHE   3  -7.650  -1.135   3.453
   22    HB3  PHE   3           1HB      PHE   3  -7.935  -2.072   1.991
   23    HD1  PHE   3           1HD      PHE   3  -5.954   0.778   3.311
   24    HD2  PHE   3           2HD      PHE   3  -6.249  -2.325   0.418
   25    HE1  PHE   3           1HE      PHE   3  -3.657   1.261   2.563
   26    HE2  PHE   3           2HE      PHE   3  -3.955  -1.851  -0.335
   27    HZ   PHE   3           HZ       PHE   3  -2.656  -0.056   0.739
   28    H    SER   4           HN       SER   4  -9.872  -1.576   0.252
   29    HA   SER   4           HA       SER   4  -8.465  -0.914  -2.096
   30    HB2  SER   4           2HB      SER   4 -11.221  -2.133  -1.810
   31    HB3  SER   4           1HB      SER   4 -10.233  -2.160  -3.271
   32    HG   SER   4           HG       SER   4  -8.659  -3.104  -1.484
   33    H    GLU   5           HN       GLU   5 -11.574   0.234  -0.824
   34    HA   GLU   5           HA       GLU   5 -12.247   1.850  -3.035
   35    HB2  GLU   5           2HB      GLU   5 -13.026   1.981  -0.127
   36    HB3  GLU   5           1HB      GLU   5 -13.723   3.013  -1.360
   37    HG2  GLU   5           2HG      GLU   5 -14.637   1.115  -2.509
   38    HG3  GLU   5           1HG      GLU   5 -13.835   0.015  -1.388
   39    H    CYS   6           HN       CYS   6 -10.666   2.587   0.048
   40    HA   CYS   6           HA       CYS   6 -10.371   5.360  -0.357
   41    HB2  CYS   6           2HB      CYS   6 -10.100   4.058   1.806
   42    HB3  CYS   6           1HB      CYS   6  -8.512   3.600   1.244
   43    HG   CYS   6           HG       CYS   6  -8.137   6.617   0.864
   44    H    ALA   7           HN       ALA   7  -8.214   2.642  -0.980
   45    HA   ALA   7           HA       ALA   7  -6.044   4.040  -2.054
   46    HB1  ALA   7           1HB      ALA   7  -6.004   1.638  -1.496
   47    HB2  ALA   7           2HB      ALA   7  -5.412   1.957  -3.126
   48    HB3  ALA   7           3HB      ALA   7  -7.036   1.316  -2.888
   49    H    ALA   8           HN       ALA   8  -8.948   2.769  -3.637
   50    HA   ALA   8           HA       ALA   8  -8.278   3.522  -6.262
   51    HB1  ALA   8           1HB      ALA   8 -10.655   3.242  -6.759
   52    HB2  ALA   8           2HB      ALA   8 -11.015   3.205  -5.033
   53    HB3  ALA   8           3HB      ALA   8 -10.049   1.921  -5.760
   54    H    LEU   9           HN       LEU   9  -9.901   5.272  -3.654
   55    HA   LEU   9           HA       LEU   9 -10.660   7.526  -5.175
   56    HB2  LEU   9           2HB      LEU   9  -9.982   7.322  -2.241
   57    HB3  LEU   9           1HB      LEU   9 -10.739   8.709  -2.994
   58    HG   LEU   9           HG       LEU   9 -11.932   5.946  -2.774
   59   HD11  LEU   9          1HD1      LEU   9 -13.546   7.039  -1.292
   60   HD12  LEU   9          2HD1      LEU   9 -12.638   8.546  -1.425
   61   HD13  LEU   9          3HD1      LEU   9 -11.902   7.137  -0.659
   62   HD21  LEU   9          3HD2      LEU   9 -13.095   8.475  -3.936
   63   HD22  LEU   9          1HD2      LEU   9 -13.947   6.946  -3.721
   64   HD23  LEU   9          2HD2      LEU   9 -12.599   7.052  -4.851
   65    H    TYR  10           HN       TYR  10  -7.729   6.770  -3.347
   66    HA   TYR  10           HA       TYR  10  -6.372   9.204  -3.768
   67    HB2  TYR  10           2HB      TYR  10  -5.671   7.478  -2.130
   68    HB3  TYR  10           1HB      TYR  10  -5.214   6.418  -3.454
   69    HD1  TYR  10           2HD      TYR  10  -4.508   9.859  -2.178
   70    HD2  TYR  10           1HD      TYR  10  -2.998   6.382  -4.110
   71    HE1  TYR  10           2HE      TYR  10  -2.258  10.850  -2.182
   72    HE2  TYR  10           1HE      TYR  10  -0.743   7.361  -4.122
   73    HH   TYR  10           HH       TYR  10   0.029  10.253  -2.368
   74    H    ILE  11           HN       ILE  11  -6.546   6.221  -5.604
   75    HA   ILE  11           HA       ILE  11  -4.754   6.890  -7.667
   76    HB   ILE  11           HB       ILE  11  -7.132   5.034  -7.633
   77   HG12  ILE  11          2HG1      ILE  11  -4.172   4.429  -7.556
   78   HG13  ILE  11          1HG1      ILE  11  -5.182   4.563  -6.123
   79   HG21  ILE  11          1HG2      ILE  11  -6.261   4.028  -9.673
   80   HG22  ILE  11          2HG2      ILE  11  -4.986   5.242  -9.745
   81   HG23  ILE  11          3HG2      ILE  11  -6.671   5.723  -9.937
   82   HD11  ILE  11          3HD1      ILE  11  -4.856   2.250  -6.710
   83   HD12  ILE  11          1HD1      ILE  11  -5.488   2.546  -8.330
   84   HD13  ILE  11          2HD1      ILE  11  -6.550   2.697  -6.930
   85    H    LYS  12           HN       LYS  12  -8.301   7.198  -7.485
   86    HA   LYS  12           HA       LYS  12  -8.651   8.378 -10.006
   87    HB2  LYS  12           2HB      LYS  12 -10.316   8.507  -7.500
   88    HB3  LYS  12           1HB      LYS  12 -10.810   9.273  -9.004
   89    HG2  LYS  12           2HG      LYS  12 -10.601   7.029 -10.104
   90    HG3  LYS  12           1HG      LYS  12 -10.372   6.346  -8.493
   91    HD2  LYS  12           2HD      LYS  12 -12.541   7.110  -7.803
   92    HD3  LYS  12           1HD      LYS  12 -12.762   7.985  -9.319
   93    HE2  LYS  12           2HE      LYS  12 -12.604   5.801 -10.514
   94    HE3  LYS  12           1HE      LYS  12 -12.587   5.000  -8.943
   95    HZ1  LYS  12           3HZ      LYS  12 -14.760   5.865  -8.472
   96    HZ2  LYS  12           1HZ      LYS  12 -14.806   5.087  -9.981
   97    HZ3  LYS  12           2HZ      LYS  12 -14.764   6.780  -9.902
   98    H    ALA  13           HN       ALA  13  -7.803   9.778  -6.910
   99    HA   ALA  13           HA       ALA  13  -8.133  12.488  -7.677
  100    HB1  ALA  13           1HB      ALA  13  -8.011  11.775  -5.336
  101    HB2  ALA  13           2HB      ALA  13  -6.815  13.020  -5.703
  102    HB3  ALA  13           3HB      ALA  13  -6.318  11.333  -5.562
  103    H    HIS  14           HN       HIS  14  -5.910  10.189  -8.743
  104    HA   HIS  14           HA       HIS  14  -4.056  12.311  -9.596
  105    HB2  HIS  14           2HB      HIS  14  -3.353   9.593  -8.492
  106    HB3  HIS  14           1HB      HIS  14  -2.211  10.589  -9.387
  107    HD1  HIS  14           1HD      HIS  14  -3.980  10.351  -6.098
  108    HD2  HIS  14           2HD      HIS  14  -1.210  12.799  -8.006
  109    HE1  HIS  14           1HE      HIS  14  -3.033  11.839  -4.300
  110    HE2  HIS  14           2HE      HIS  14  -1.249  13.199  -5.448
  111    H    ARG  15           HN       ARG  15  -6.259  10.216 -10.723
  112    HA   ARG  15           HA       ARG  15  -4.895   8.848 -12.787
  113    HB2  ARG  15           2HB      ARG  15  -7.153   8.599 -13.821
  114    HB3  ARG  15           1HB      ARG  15  -7.072   8.091 -12.143
  115    HG2  ARG  15           2HG      ARG  15  -8.144  10.123 -11.427
  116    HG3  ARG  15           1HG      ARG  15  -8.121  10.750 -13.075
  117    HD2  ARG  15           2HD      ARG  15  -9.490   8.168 -12.393
  118    HD3  ARG  15           1HD      ARG  15 -10.306   9.721 -12.208
  119    HE   ARG  15           HE       ARG  15  -9.608   9.991 -14.682
  120   HH11  ARG  15          1HH1      ARG  15 -10.651   6.998 -13.162
  121   HH12  ARG  15          2HH1      ARG  15 -11.303   6.348 -14.628
  122   HH21  ARG  15          1HH2      ARG  15 -10.458   9.117 -16.603
  123   HH22  ARG  15          2HH2      ARG  15 -11.171   7.528 -16.588
  124    H    SER  16           HN       SER  16  -5.929  12.090 -12.447
  125    HA   SER  16           HA       SER  16  -5.920  12.874 -15.158
  126    HB2  SER  16           2HB      SER  16  -5.142  14.696 -12.902
  127    HB3  SER  16           1HB      SER  16  -6.152  15.027 -14.306
  128    HG   SER  16           HG       SER  16  -7.829  14.443 -13.192
  129    H    SER  17           HN       SER  17  -3.446  12.578 -12.684
  130    HA   SER  17           HA       SER  17  -1.400  13.806 -14.313
  131    HB2  SER  17           2HB      SER  17  -1.439  14.033 -11.824
  132    HB3  SER  17           1HB      SER  17  -1.120  12.303 -11.696
  133    HG   SER  17           HG       SER  17   0.550  14.148 -13.066
  134    H    TRP  18           HN       TRP  18  -2.544  10.620 -13.491
  135    HA   TRP  18           HA       TRP  18  -0.277   9.317 -14.750
  136    HB2  TRP  18           2HB      TRP  18  -2.785   8.174 -13.505
  137    HB3  TRP  18           1HB      TRP  18  -1.446   7.216 -14.133
  138    HD1  TRP  18           1HD      TRP  18   0.832   9.242 -12.864
  139    HE1  TRP  18           1HE      TRP  18   1.325   9.031 -10.343
  140    HE3  TRP  18           3HE      TRP  18  -3.458   6.889 -11.405
  141    HZ2  TRP  18           2HZ      TRP  18   0.059   7.990  -8.049
  142    HZ3  TRP  18           3HZ      TRP  18  -3.735   6.313  -9.035
  143    HH2  TRP  18           2HH      TRP  18  -2.014   6.851  -7.391
  144    H    LYS  19           HN       LYS  19  -2.277  11.028 -16.196
  145    HA   LYS  19           HA       LYS  19  -3.115   9.147 -18.277
  146    HB2  LYS  19           2HB      LYS  19  -4.881  10.708 -17.431
  147    HB3  LYS  19           1HB      LYS  19  -3.847  12.068 -17.838
  148    HG2  LYS  19           2HG      LYS  19  -5.352  11.985 -19.593
  149    HG3  LYS  19           1HG      LYS  19  -3.936  11.157 -20.237
  150    HD2  LYS  19           2HD      LYS  19  -5.612   9.717 -20.873
  151    HD3  LYS  19           1HD      LYS  19  -5.145   9.018 -19.324
  152    HE2  LYS  19           2HE      LYS  19  -7.427  10.952 -19.711
  153    HE3  LYS  19           1HE      LYS  19  -7.605   9.200 -19.658
  154    HZ1  LYS  19           3HZ      LYS  19  -8.105  10.196 -17.526
  155    HZ2  LYS  19           1HZ      LYS  19  -6.571  10.911 -17.456
  156    HZ3  LYS  19           2HZ      LYS  19  -6.726   9.223 -17.403
  157    H    ASN  20           HN       ASN  20  -0.616  10.117 -20.306
  158    HA   ASN  20           HA       ASN  20  -3.311   9.031 -20.129
  159    HB2  ASN  20           2HB      ASN  20  -2.566   9.999 -22.284
  160    HB3  ASN  20           1HB      ASN  20  -1.243   8.847 -22.337
  161   HD21  ASN  20          1HD2      ASN  20  -4.634   9.340 -22.787
  162   HD22  ASN  20          2HD2      ASN  20  -4.970   7.796 -23.512
  163    H    THR  21           HN       THR  21  -0.410   8.306 -18.887
  164    HA   THR  21           HA       THR  21   0.308   5.765 -19.736
  165    HB   THR  21           HB       THR  21   1.505   5.563 -17.580
  166    HG1  THR  21           1HG      THR  21  -0.358   7.386 -16.831
  167   HG21  THR  21          3HG2      THR  21   1.704   8.255 -18.935
  168   HG22  THR  21          1HG2      THR  21   2.554   6.781 -19.398
  169   HG23  THR  21          2HG2      THR  21   2.925   7.568 -17.864
  170    H    LYS  22           HN       LYS  22   0.232   3.732 -18.586
  171    HA   LYS  22           HA       LYS  22  -2.409   3.075 -17.629
  172    HB2  LYS  22           2HB      LYS  22   0.040   1.578 -18.410
  173    HB3  LYS  22           1HB      LYS  22  -1.095   0.777 -17.335
  174    HG2  LYS  22           2HG      LYS  22  -1.984   2.023 -19.913
  175    HG3  LYS  22           1HG      LYS  22  -1.346   0.376 -19.835
  176    HD2  LYS  22           2HD      LYS  22  -3.064  -0.167 -18.142
  177    HD3  LYS  22           1HD      LYS  22  -3.725   1.458 -18.324
  178    HE2  LYS  22           2HE      LYS  22  -4.382   1.032 -20.562
  179    HE3  LYS  22           1HE      LYS  22  -3.447  -0.462 -20.626
  180    HZ1  LYS  22           3HZ      LYS  22  -5.804  -0.012 -18.871
  181    HZ2  LYS  22           1HZ      LYS  22  -4.943  -1.464 -19.055
  182    HZ3  LYS  22           2HZ      LYS  22  -5.845  -0.841 -20.350
  183    H    HIS  23           HN       HIS  23  -0.185   4.639 -16.026
  184    HA   HIS  23           HA       HIS  23   0.567   3.074 -13.828
  185    HB2  HIS  23           2HB      HIS  23   0.265   6.043 -14.201
  186    HB3  HIS  23           1HB      HIS  23   0.694   5.373 -12.631
  187    HD1  HIS  23           1HD      HIS  23   3.126   5.305 -12.242
  188    HD2  HIS  23           2HD      HIS  23   2.206   4.962 -16.284
  189    HE1  HIS  23           1HE      HIS  23   5.337   5.150 -13.433
  190    HE2  HIS  23           2HE      HIS  23   4.743   4.725 -15.845
  191    H    ALA  24           HN       ALA  24  -2.298   5.099 -14.308
  192    HA   ALA  24           HA       ALA  24  -3.369   4.935 -11.737
  193    HB1  ALA  24           1HB      ALA  24  -5.532   5.425 -12.788
  194    HB2  ALA  24           2HB      ALA  24  -4.840   5.073 -14.371
  195    HB3  ALA  24           3HB      ALA  24  -4.247   6.447 -13.435
  196    H    ASP  25           HN       ASP  25  -3.832   2.785 -14.525
  197    HA   ASP  25           HA       ASP  25  -5.612   1.006 -13.228
  198    HB2  ASP  25           2HB      ASP  25  -5.410   1.105 -15.676
  199    HB3  ASP  25           1HB      ASP  25  -3.772   0.480 -15.571
  200    H    GLN  26           HN       GLN  26  -2.123   0.900 -13.810
  201    HA   GLN  26           HA       GLN  26  -1.685  -1.632 -12.693
  202    HB2  GLN  26           2HB      GLN  26   0.162   0.711 -13.105
  203    HB3  GLN  26           1HB      GLN  26   0.700  -0.879 -12.602
  204    HG2  GLN  26           2HG      GLN  26  -0.700  -0.208 -15.176
  205    HG3  GLN  26           1HG      GLN  26   1.010  -0.583 -14.983
  206   HE21  GLN  26          1HE2      GLN  26  -2.223  -1.864 -15.085
  207   HE22  GLN  26          2HE2      GLN  26  -1.771  -3.530 -15.195
  208    H    TRP  27           HN       TRP  27  -1.812   1.558 -11.207
  209    HA   TRP  27           HA       TRP  27  -0.858   0.825  -8.668
  210    HB2  TRP  27           2HB      TRP  27  -2.588   2.999  -9.721
  211    HB3  TRP  27           1HB      TRP  27  -2.682   2.675  -7.992
  212    HD1  TRP  27           1HD      TRP  27   0.109   3.370 -10.615
  213    HE1  TRP  27           1HE      TRP  27   1.934   4.781  -9.469
  214    HE3  TRP  27           3HE      TRP  27  -1.864   3.554  -5.901
  215    HZ2  TRP  27           2HZ      TRP  27   2.456   5.831  -6.895
  216    HZ3  TRP  27           3HZ      TRP  27  -0.643   4.781  -4.159
  217    HH2  TRP  27           2HH      TRP  27   1.472   5.896  -4.645
  218    H    THR  28           HN       THR  28  -4.143   0.755 -10.015
  219    HA   THR  28           HA       THR  28  -5.381  -0.389  -7.732
  220    HB   THR  28           HB       THR  28  -6.327  -0.750 -10.579
  221    HG1  THR  28           1HG      THR  28  -6.044   1.581  -9.111
  222   HG21  THR  28          3HG2      THR  28  -7.576  -1.921  -8.825
  223   HG22  THR  28          1HG2      THR  28  -8.543  -0.636  -9.550
  224   HG23  THR  28          2HG2      THR  28  -7.802  -0.396  -7.968
  225    H    ASN  29           HN       ASN  29  -3.912  -1.677 -10.641
  226    HA   ASN  29           HA       ASN  29  -4.831  -4.284 -10.643
  227    HB2  ASN  29           2HB      ASN  29  -3.475  -3.030 -12.404
  228    HB3  ASN  29           1HB      ASN  29  -2.046  -3.468 -11.476
  229   HD21  ASN  29          1HD2      ASN  29  -4.516  -4.532 -13.603
  230   HD22  ASN  29          2HD2      ASN  29  -3.875  -6.109 -13.904
  231    H    THR  30           HN       THR  30  -1.824  -3.049  -9.174
  232    HA   THR  30           HA       THR  30  -0.979  -5.572  -8.202
  233    HB   THR  30           HB       THR  30  -0.163  -2.871  -7.127
  234    HG1  THR  30           1HG      THR  30   1.022  -4.303  -9.288
  235   HG21  THR  30          3HG2      THR  30   1.312  -5.503  -7.302
  236   HG22  THR  30          1HG2      THR  30   0.634  -4.800  -5.834
  237   HG23  THR  30          2HG2      THR  30   1.964  -3.993  -6.666
  238    H    ILE  31           HN       ILE  31  -2.719  -2.875  -6.682
  239    HA   ILE  31           HA       ILE  31  -2.705  -3.952  -4.059
  240    HB   ILE  31           HB       ILE  31  -4.601  -1.953  -5.312
  241   HG12  ILE  31          2HG1      ILE  31  -2.175  -1.546  -3.546
  242   HG13  ILE  31          1HG1      ILE  31  -2.228  -1.259  -5.283
  243   HG21  ILE  31          1HG2      ILE  31  -5.623  -2.962  -3.361
  244   HG22  ILE  31          2HG2      ILE  31  -5.143  -1.303  -3.000
  245   HG23  ILE  31          3HG2      ILE  31  -4.170  -2.652  -2.413
  246   HD11  ILE  31          3HD1      ILE  31  -3.831   0.204  -3.199
  247   HD12  ILE  31          1HD1      ILE  31  -3.895   0.493  -4.937
  248   HD13  ILE  31          2HD1      ILE  31  -2.409   0.817  -4.043
  249    H    LYS  32           HN       LYS  32  -5.001  -4.090  -6.727
  250    HA   LYS  32           HA       LYS  32  -7.102  -5.425  -5.466
  251    HB2  LYS  32           2HB      LYS  32  -7.174  -4.374  -7.727
  252    HB3  LYS  32           1HB      LYS  32  -6.182  -5.678  -8.342
  253    HG2  LYS  32           2HG      LYS  32  -8.792  -6.300  -7.032
  254    HG3  LYS  32           1HG      LYS  32  -8.751  -5.724  -8.698
  255    HD2  LYS  32           2HD      LYS  32  -7.258  -7.568  -9.296
  256    HD3  LYS  32           1HD      LYS  32  -7.286  -8.137  -7.627
  257    HE2  LYS  32           2HE      LYS  32  -9.726  -8.459  -7.814
  258    HE3  LYS  32           1HE      LYS  32  -9.637  -7.969  -9.505
  259    HZ1  LYS  32           3HZ      LYS  32  -8.218 -10.299  -8.330
  260    HZ2  LYS  32           1HZ      LYS  32  -8.229  -9.855  -9.967
  261    HZ3  LYS  32           2HZ      LYS  32  -9.658 -10.389  -9.219
  262    H    THR  33           HN       THR  33  -4.100  -6.611  -6.839
  263    HA   THR  33           HA       THR  33  -4.967  -9.358  -6.841
  264    HB   THR  33           HB       THR  33  -2.190  -8.221  -7.248
  265    HG1  THR  33           1HG      THR  33  -3.770  -7.443  -8.777
  266   HG21  THR  33          3HG2      THR  33  -1.754 -10.332  -8.427
  267   HG22  THR  33          1HG2      THR  33  -3.374 -10.897  -8.018
  268   HG23  THR  33          2HG2      THR  33  -2.188 -10.621  -6.743
  269    H    TYR  34           HN       TYR  34  -2.451  -7.548  -5.043
  270    HA   TYR  34           HA       TYR  34  -1.973  -9.841  -3.363
  271    HB2  TYR  34           2HB      TYR  34  -0.765  -7.078  -3.357
  272    HB3  TYR  34           1HB      TYR  34  -0.254  -8.390  -2.296
  273    HD1  TYR  34           2HD      TYR  34   0.605 -10.533  -3.378
  274    HD2  TYR  34           1HD      TYR  34   0.107  -6.901  -5.535
  275    HE1  TYR  34           2HE      TYR  34   2.101 -11.377  -5.133
  276    HE2  TYR  34           1HE      TYR  34   1.604  -7.740  -7.297
  277    HH   TYR  34           HH       TYR  34   2.478 -10.974  -7.570
  278    H    CYS  35           HN       CYS  35  -3.266  -6.574  -2.847
  279    HA   CYS  35           HA       CYS  35  -3.553  -7.091  -0.012
  280    HB2  CYS  35           2HB      CYS  35  -4.340  -4.651  -1.618
  281    HB3  CYS  35           1HB      CYS  35  -4.251  -4.757   0.137
  282    HG   CYS  35           HG       CYS  35  -1.403  -5.403  -0.063
  283    H    GLY  36           HN       GLY  36  -5.554  -6.918  -2.843
  284    HA2  GLY  36           2HA      GLY  36  -8.054  -6.347  -1.963
  285    HA3  GLY  36           1HA      GLY  36  -7.733  -7.526  -3.216
  286    HA   PRO  37           HA       PRO  37  -9.279 -10.885  -0.917
  287    HB2  PRO  37           2HB      PRO  37  -6.689 -12.280  -0.643
  288    HB3  PRO  37           1HB      PRO  37  -8.169 -12.794  -1.459
  289    HG2  PRO  37           2HG      PRO  37  -6.018 -12.040  -2.849
  290    HG3  PRO  37           1HG      PRO  37  -7.657 -11.643  -3.399
  291    HD2  PRO  37           2HD      PRO  37  -5.649  -9.905  -2.014
  292    HD3  PRO  37           1HD      PRO  37  -6.735  -9.516  -3.365
  293    H    VAL  38           HN       VAL  38  -6.586  -9.286   0.569
  294    HA   VAL  38           HA       VAL  38  -7.170 -10.643   3.118
  295    HB   VAL  38           HB       VAL  38  -4.687  -9.065   2.435
  296   HG11  VAL  38          1HG1      VAL  38  -3.771 -10.133   4.454
  297   HG12  VAL  38          2HG1      VAL  38  -5.338 -10.881   4.759
  298   HG13  VAL  38          3HG1      VAL  38  -5.173  -9.127   4.826
  299   HG21  VAL  38          3HG2      VAL  38  -4.834 -11.084   1.062
  300   HG22  VAL  38          1HG2      VAL  38  -5.094 -12.052   2.513
  301   HG23  VAL  38          2HG2      VAL  38  -3.556 -11.226   2.271
  302    H    ILE  39           HN       ILE  39  -5.721  -7.458   2.389
  303    HA   ILE  39           HA       ILE  39  -7.296  -6.374   4.604
  304    HB   ILE  39           HB       ILE  39  -5.794  -4.397   4.441
  305   HG12  ILE  39          2HG1      ILE  39  -4.287  -6.088   2.430
  306   HG13  ILE  39          1HG1      ILE  39  -5.223  -4.648   2.037
  307   HG21  ILE  39          1HG2      ILE  39  -4.443  -7.068   4.771
  308   HG22  ILE  39          2HG2      ILE  39  -5.312  -6.167   6.013
  309   HG23  ILE  39          3HG2      ILE  39  -3.810  -5.527   5.345
  310   HD11  ILE  39          3HD1      ILE  39  -2.767  -4.757   3.778
  311   HD12  ILE  39          1HD1      ILE  39  -3.707  -3.309   3.414
  312   HD13  ILE  39          2HD1      ILE  39  -2.856  -4.155   2.123
  313    H    GLY  40           HN       GLY  40  -7.773  -6.725   1.453
  314    HA2  GLY  40           2HA      GLY  40  -8.417  -4.242   0.387
  315    HA3  GLY  40           1HA      GLY  40  -9.194  -5.753  -0.057
  316    HA   PRO  41           HA       PRO  41 -12.931  -4.528   1.920
  317    HB2  PRO  41           2HB      PRO  41 -13.171  -6.897   3.611
  318    HB3  PRO  41           1HB      PRO  41 -14.113  -6.440   2.191
  319    HG2  PRO  41           2HG      PRO  41 -12.375  -8.511   2.172
  320    HG3  PRO  41           1HG      PRO  41 -12.689  -7.519   0.735
  321    HD2  PRO  41           2HD      PRO  41 -10.395  -7.399   2.660
  322    HD3  PRO  41           1HD      PRO  41 -10.384  -7.288   0.886
  323    H    LEU  42           HN       LEU  42 -10.219  -4.974   3.874
  324    HA   LEU  42           HA       LEU  42 -11.477  -4.463   6.402
  325    HB2  LEU  42           2HB      LEU  42  -8.591  -4.373   5.541
  326    HB3  LEU  42           1HB      LEU  42  -9.121  -4.077   7.185
  327    HG   LEU  42           HG       LEU  42  -9.441  -6.658   5.650
  328   HD11  LEU  42          1HD1      LEU  42  -7.149  -6.206   6.396
  329   HD12  LEU  42          2HD1      LEU  42  -7.873  -7.560   7.263
  330   HD13  LEU  42          3HD1      LEU  42  -7.738  -5.985   8.045
  331   HD21  LEU  42          3HD2      LEU  42 -10.239  -5.953   8.471
  332   HD22  LEU  42          1HD2      LEU  42 -10.291  -7.565   7.760
  333   HD23  LEU  42          2HD2      LEU  42 -11.332  -6.291   7.128
  334    H    SER  43           HN       SER  43 -11.644  -2.555   7.493
  335    HA   SER  43           HA       SER  43 -11.829  -0.174   6.052
  336    HB2  SER  43           2HB      SER  43 -11.609  -0.573   9.033
  337    HB3  SER  43           1HB      SER  43 -12.379   0.753   8.189
  338    HG   SER  43           HG       SER  43 -13.688  -1.158   9.027
  339    H    VAL  44           HN       VAL  44 -10.505   1.629   6.000
  340    HA   VAL  44           HA       VAL  44  -7.746   1.098   5.930
  341    HB   VAL  44           HB       VAL  44  -8.843   2.750   4.484
  342   HG11  VAL  44          1HG1      VAL  44  -9.038   4.418   6.984
  343   HG12  VAL  44          2HG1      VAL  44 -10.378   3.761   6.045
  344   HG13  VAL  44          3HG1      VAL  44  -9.337   5.004   5.348
  345   HG21  VAL  44          3HG2      VAL  44  -6.434   2.858   4.738
  346   HG22  VAL  44          1HG2      VAL  44  -6.607   3.879   6.166
  347   HG23  VAL  44          2HG2      VAL  44  -7.096   4.485   4.584
  348    H    GLN  45           HN       GLN  45  -9.747   2.324   8.488
  349    HA   GLN  45           HA       GLN  45  -7.522   3.372  10.018
  350    HB2  GLN  45           2HB      GLN  45  -9.806   4.355  10.146
  351    HB3  GLN  45           1HB      GLN  45 -10.370   2.865  10.894
  352    HG2  GLN  45           2HG      GLN  45  -8.856   3.225  12.770
  353    HG3  GLN  45           1HG      GLN  45  -8.267   4.706  12.017
  354   HE21  GLN  45          1HE2      GLN  45  -8.907   5.987  13.736
  355   HE22  GLN  45          2HE2      GLN  45 -10.573   6.334  14.034
  356    H    ASP  46           HN       ASP  46  -9.081   0.381   9.541
  357    HA   ASP  46           HA       ASP  46  -8.365  -0.708  12.128
  358    HB2  ASP  46           2HB      ASP  46  -9.856  -1.820   9.754
  359    HB3  ASP  46           1HB      ASP  46  -9.443  -2.793  11.157
  360    H    VAL  47           HN       VAL  47  -7.276  -0.789   8.814
  361    HA   VAL  47           HA       VAL  47  -5.556  -3.025   9.019
  362    HB   VAL  47           HB       VAL  47  -5.267  -0.599   7.230
  363   HG11  VAL  47          1HG1      VAL  47  -3.197  -1.898   7.418
  364   HG12  VAL  47          2HG1      VAL  47  -3.907  -2.035   5.810
  365   HG13  VAL  47          3HG1      VAL  47  -4.075  -3.359   6.963
  366   HG21  VAL  47          3HG2      VAL  47  -6.346  -2.026   5.524
  367   HG22  VAL  47          1HG2      VAL  47  -7.408  -1.660   6.884
  368   HG23  VAL  47          2HG2      VAL  47  -6.640  -3.244   6.765
  369    H    ASP  48           HN       ASP  48  -3.871  -3.235  10.332
  370    HA   ASP  48           HA       ASP  48  -2.367  -0.818  11.090
  371    HB2  ASP  48           2HB      ASP  48  -2.001  -1.664  13.219
  372    HB3  ASP  48           1HB      ASP  48  -3.614  -2.274  12.884
  373    H    THR  49           HN       THR  49  -0.127  -1.800  12.084
  374    HA   THR  49           HA       THR  49   1.459  -2.346   9.847
  375    HB   THR  49           HB       THR  49   2.161  -2.865  12.743
  376    HG1  THR  49           1HG      THR  49   2.658  -0.472  11.297
  377   HG21  THR  49          3HG2      THR  49   3.789  -3.745  11.121
  378   HG22  THR  49          1HG2      THR  49   4.449  -2.386  12.032
  379   HG23  THR  49          2HG2      THR  49   3.895  -2.152  10.374
  380    H    LYS  50           HN       LYS  50   0.141  -4.514  12.341
  381    HA   LYS  50           HA       LYS  50   1.702  -6.768  11.566
  382    HB2  LYS  50           2HB      LYS  50   0.361  -6.214  13.785
  383    HB3  LYS  50           1HB      LYS  50  -0.922  -7.083  12.961
  384    HG2  LYS  50           2HG      LYS  50   1.816  -8.254  13.311
  385    HG3  LYS  50           1HG      LYS  50   0.564  -8.395  14.543
  386    HD2  LYS  50           2HD      LYS  50  -0.874  -9.584  13.036
  387    HD3  LYS  50           1HD      LYS  50   0.227  -9.288  11.687
  388    HE2  LYS  50           2HE      LYS  50   0.408 -11.580  12.593
  389    HE3  LYS  50           1HE      LYS  50   1.916 -10.675  12.706
  390    HZ1  LYS  50           3HZ      LYS  50   1.527 -10.299  15.024
  391    HZ2  LYS  50           1HZ      LYS  50   1.380 -11.960  14.727
  392    HZ3  LYS  50           2HZ      LYS  50  -0.004 -11.011  14.949
  393    H    LEU  51           HN       LEU  51  -1.586  -5.675  10.812
  394    HA   LEU  51           HA       LEU  51  -2.367  -7.893   9.287
  395    HB2  LEU  51           2HB      LEU  51  -3.166  -4.995   9.110
  396    HB3  LEU  51           1HB      LEU  51  -3.937  -6.268   8.193
  397    HG   LEU  51           HG       LEU  51  -3.886  -6.033  11.193
  398   HD11  LEU  51          1HD1      LEU  51  -6.297  -5.670  10.964
  399   HD12  LEU  51          2HD1      LEU  51  -6.124  -5.676   9.208
  400   HD13  LEU  51          3HD1      LEU  51  -5.359  -4.408  10.169
  401   HD21  LEU  51          3HD2      LEU  51  -3.863  -8.364  10.527
  402   HD22  LEU  51          1HD2      LEU  51  -5.210  -8.083   9.423
  403   HD23  LEU  51          2HD2      LEU  51  -5.448  -7.927  11.164
  404    H    ILE  52           HN       ILE  52  -0.588  -4.972   8.419
  405    HA   ILE  52           HA       ILE  52  -0.449  -5.516   5.635
  406    HB   ILE  52           HB       ILE  52   1.385  -3.831   7.351
  407   HG12  ILE  52          2HG1      ILE  52  -0.947  -3.018   5.606
  408   HG13  ILE  52          1HG1      ILE  52  -1.012  -3.158   7.358
  409   HG21  ILE  52          1HG2      ILE  52   2.454  -4.442   5.250
  410   HG22  ILE  52          2HG2      ILE  52   2.027  -2.731   5.258
  411   HG23  ILE  52          3HG2      ILE  52   1.042  -3.881   4.354
  412   HD11  ILE  52          3HD1      ILE  52   0.723  -1.252   5.808
  413   HD12  ILE  52          1HD1      ILE  52   0.658  -1.393   7.565
  414   HD13  ILE  52          2HD1      ILE  52  -0.761  -0.846   6.671
  415    H    MET  53           HN       MET  53   1.591  -6.330   8.394
  416    HA   MET  53           HA       MET  53   3.774  -7.428   7.057
  417    HB2  MET  53           2HB      MET  53   2.498  -8.209   9.675
  418    HB3  MET  53           1HB      MET  53   3.986  -8.931   9.090
  419    HG2  MET  53           2HG      MET  53   5.048  -6.727   9.096
  420    HG3  MET  53           1HG      MET  53   3.550  -6.021   9.707
  421    HE1  MET  53           3HE      MET  53   6.037  -5.929  12.783
  422    HE2  MET  53           1HE      MET  53   5.045  -4.955  11.697
  423    HE3  MET  53           2HE      MET  53   6.483  -5.770  11.084
  424    H    LYS  54           HN       LYS  54   0.709  -8.932   7.995
  425    HA   LYS  54           HA       LYS  54   1.287 -11.538   7.173
  426    HB2  LYS  54           2HB      LYS  54  -1.362 -10.098   7.289
  427    HB3  LYS  54           1HB      LYS  54  -1.193 -11.827   7.019
  428    HG2  LYS  54           2HG      LYS  54   0.117 -11.832   9.229
  429    HG3  LYS  54           1HG      LYS  54  -0.600 -10.241   9.487
  430    HD2  LYS  54           2HD      LYS  54  -1.965 -11.944  10.545
  431    HD3  LYS  54           1HD      LYS  54  -2.841 -11.231   9.187
  432    HE2  LYS  54           2HE      LYS  54  -2.293 -13.125   7.789
  433    HE3  LYS  54           1HE      LYS  54  -1.288 -13.816   9.063
  434    HZ1  LYS  54           3HZ      LYS  54  -3.458 -14.873   8.946
  435    HZ2  LYS  54           1HZ      LYS  54  -4.224 -13.385   9.225
  436    HZ3  LYS  54           2HZ      LYS  54  -3.249 -14.076  10.431
  437    H    VAL  55           HN       VAL  55   0.110  -8.777   5.352
  438    HA   VAL  55           HA       VAL  55  -0.462 -10.236   2.967
  439    HB   VAL  55           HB       VAL  55   0.124  -7.285   3.281
  440   HG11  VAL  55          1HG1      VAL  55  -1.260  -8.782   1.054
  441   HG12  VAL  55          2HG1      VAL  55   0.327  -8.018   0.968
  442   HG13  VAL  55          3HG1      VAL  55  -1.118  -7.029   1.181
  443   HG21  VAL  55          3HG2      VAL  55  -2.499  -8.772   3.329
  444   HG22  VAL  55          1HG2      VAL  55  -2.323  -7.017   3.304
  445   HG23  VAL  55          2HG2      VAL  55  -1.735  -7.943   4.685
  446    H    LEU  56           HN       LEU  56   2.322  -8.369   4.115
  447    HA   LEU  56           HA       LEU  56   3.728  -8.590   1.626
  448    HB2  LEU  56           2HB      LEU  56   4.637  -7.695   4.355
  449    HB3  LEU  56           1HB      LEU  56   5.626  -7.610   2.910
  450    HG   LEU  56           HG       LEU  56   3.034  -6.127   3.364
  451   HD11  LEU  56          1HD1      LEU  56   4.877  -5.245   4.692
  452   HD12  LEU  56          2HD1      LEU  56   4.457  -4.136   3.386
  453   HD13  LEU  56          3HD1      LEU  56   5.889  -5.158   3.251
  454   HD21  LEU  56          3HD2      LEU  56   3.343  -6.731   1.019
  455   HD22  LEU  56          1HD2      LEU  56   4.959  -6.028   1.045
  456   HD23  LEU  56          2HD2      LEU  56   3.547  -4.996   1.265
  457    H    ASP  57           HN       ASP  57   3.641 -10.432   4.577
  458    HA   ASP  57           HA       ASP  57   6.107 -11.622   4.688
  459    HB2  ASP  57           2HB      ASP  57   4.049 -11.899   6.235
  460    HB3  ASP  57           1HB      ASP  57   3.621 -13.237   5.186
  461    HA   PRO  58           HA       PRO  58   4.865 -15.171   1.702
  462    HB2  PRO  58           2HB      PRO  58   2.618 -14.971   0.218
  463    HB3  PRO  58           1HB      PRO  58   2.626 -15.655   1.847
  464    HG2  PRO  58           2HG      PRO  58   1.840 -12.913   0.948
  465    HG3  PRO  58           1HG      PRO  58   1.042 -13.978   2.121
  466    HD2  PRO  58           2HD      PRO  58   2.664 -11.918   2.852
  467    HD3  PRO  58           1HD      PRO  58   2.481 -13.392   3.821
  468    H    ILE  59           HN       ILE  59   4.544 -11.844   0.888
  469    HA   ILE  59           HA       ILE  59   4.959 -12.228  -1.944
  470    HB   ILE  59           HB       ILE  59   5.169  -9.657  -0.368
  471   HG12  ILE  59          2HG1      ILE  59   2.824 -10.805  -1.901
  472   HG13  ILE  59          1HG1      ILE  59   2.943 -10.713  -0.149
  473   HG21  ILE  59          1HG2      ILE  59   4.830  -8.573  -2.531
  474   HG22  ILE  59          2HG2      ILE  59   4.781 -10.149  -3.321
  475   HG23  ILE  59          3HG2      ILE  59   6.270  -9.592  -2.557
  476   HD11  ILE  59          3HD1      ILE  59   3.024  -8.266  -0.305
  477   HD12  ILE  59          1HD1      ILE  59   1.543  -8.942  -0.984
  478   HD13  ILE  59          2HD1      ILE  59   2.833  -8.390  -2.055
  479    H    TRP  60           HN       TRP  60   6.914 -11.547   0.889
  480    HA   TRP  60           HA       TRP  60   9.330 -10.888  -0.391
  481    HB2  TRP  60           2HB      TRP  60   8.843 -12.325   2.224
  482    HB3  TRP  60           1HB      TRP  60  10.424 -11.772   1.688
  483    HD1  TRP  60           1HD      TRP  60   7.659 -10.712   3.792
  484    HE1  TRP  60           1HE      TRP  60   7.752  -8.187   4.270
  485    HE3  TRP  60           3HE      TRP  60  11.046  -9.330   0.217
  486    HZ2  TRP  60           2HZ      TRP  60   9.079  -5.904   3.260
  487    HZ3  TRP  60           3HZ      TRP  60  11.672  -6.959   0.040
  488    HH2  TRP  60           2HH      TRP  60  10.708  -5.280   1.530
  489    H    GLU  61           HN       GLU  61   7.661 -13.873  -0.032
  490    HA   GLU  61           HA       GLU  61   9.783 -15.655  -0.592
  491    HB2  GLU  61           2HB      GLU  61   6.805 -15.744  -0.556
  492    HB3  GLU  61           1HB      GLU  61   7.661 -17.031  -1.374
  493    HG2  GLU  61           2HG      GLU  61   8.398 -16.285   1.415
  494    HG3  GLU  61           1HG      GLU  61   6.990 -17.301   1.107
  495    H    GLN  62           HN       GLN  62   7.299 -14.088  -2.566
  496    HA   GLN  62           HA       GLN  62   8.193 -15.418  -4.950
  497    HB2  GLN  62           2HB      GLN  62   5.795 -15.091  -4.349
  498    HB3  GLN  62           1HB      GLN  62   6.022 -13.358  -4.559
  499    HG2  GLN  62           2HG      GLN  62   6.629 -13.726  -6.878
  500    HG3  GLN  62           1HG      GLN  62   6.380 -15.455  -6.662
  501   HE21  GLN  62          1HE2      GLN  62   4.854 -12.357  -6.945
  502   HE22  GLN  62          2HE2      GLN  62   3.243 -12.943  -7.185
  503    H    LYS  63           HN       LYS  63   7.736 -11.999  -3.946
  504    HA   LYS  63           HA       LYS  63   9.755 -11.213  -5.920
  505    HB2  LYS  63           2HB      LYS  63   7.125  -9.757  -5.725
  506    HB3  LYS  63           1HB      LYS  63   8.381  -9.563  -6.935
  507    HG2  LYS  63           2HG      LYS  63   7.878 -11.866  -7.729
  508    HG3  LYS  63           1HG      LYS  63   6.520 -11.903  -6.603
  509    HD2  LYS  63           2HD      LYS  63   5.526 -11.240  -8.598
  510    HD3  LYS  63           1HD      LYS  63   5.799  -9.708  -7.765
  511    HE2  LYS  63           2HE      LYS  63   6.481  -9.455 -10.048
  512    HE3  LYS  63           1HE      LYS  63   7.924  -9.468  -9.035
  513    HZ1  LYS  63           3HZ      LYS  63   8.362 -11.720  -9.646
  514    HZ2  LYS  63           1HZ      LYS  63   8.110 -10.838 -11.072
  515    HZ3  LYS  63           2HZ      LYS  63   6.888 -11.848 -10.473
  516    HA   PRO  64           HA       PRO  64  10.549  -9.257  -1.812
  517    HB2  PRO  64           2HB      PRO  64  13.108  -8.809  -3.268
  518    HB3  PRO  64           1HB      PRO  64  12.837  -9.365  -1.613
  519    HG2  PRO  64           2HG      PRO  64  13.554 -11.080  -3.512
  520    HG3  PRO  64           1HG      PRO  64  12.364 -11.537  -2.279
  521    HD2  PRO  64           2HD      PRO  64  11.943 -10.800  -5.141
  522    HD3  PRO  64           1HD      PRO  64  11.086 -11.990  -4.143
  523    H    GLU  65           HN       GLU  65  11.706  -7.882  -4.915
  524    HA   GLU  65           HA       GLU  65  11.748  -5.227  -3.932
  525    HB2  GLU  65           2HB      GLU  65  13.037  -5.980  -5.917
  526    HB3  GLU  65           1HB      GLU  65  11.527  -6.116  -6.803
  527    HG2  GLU  65           2HG      GLU  65  11.130  -3.726  -6.509
  528    HG3  GLU  65           1HG      GLU  65  12.643  -3.583  -5.618
  529    H    THR  66           HN       THR  66   9.319  -7.167  -5.540
  530    HA   THR  66           HA       THR  66   7.538  -5.014  -6.078
  531    HB   THR  66           HB       THR  66   6.936  -7.972  -5.867
  532    HG1  THR  66           1HG      THR  66   8.470  -7.514  -7.485
  533   HG21  THR  66          3HG2      THR  66   5.379  -5.743  -7.193
  534   HG22  THR  66          1HG2      THR  66   4.903  -6.596  -5.723
  535   HG23  THR  66          2HG2      THR  66   4.982  -7.460  -7.259
  536    H    ALA  67           HN       ALA  67   7.978  -7.222  -3.375
  537    HA   ALA  67           HA       ALA  67   5.729  -6.483  -1.860
  538    HB1  ALA  67           1HB      ALA  67   7.153  -8.379  -1.262
  539    HB2  ALA  67           2HB      ALA  67   6.997  -7.255   0.088
  540    HB3  ALA  67           3HB      ALA  67   8.474  -7.275  -0.879
  541    H    SER  68           HN       SER  68   8.936  -5.062  -2.180
  542    HA   SER  68           HA       SER  68   8.566  -3.025  -0.239
  543    HB2  SER  68           2HB      SER  68  10.448  -3.070  -2.614
  544    HB3  SER  68           1HB      SER  68  10.586  -2.028  -1.197
  545    HG   SER  68           HG       SER  68  10.522  -4.839  -0.951
  546    H    ARG  69           HN       ARG  69   8.103  -3.167  -3.749
  547    HA   ARG  69           HA       ARG  69   7.470  -0.437  -4.081
  548    HB2  ARG  69           2HB      ARG  69   6.879  -2.853  -5.791
  549    HB3  ARG  69           1HB      ARG  69   6.570  -1.202  -6.286
  550    HG2  ARG  69           2HG      ARG  69   8.980  -0.709  -5.992
  551    HG3  ARG  69           1HG      ARG  69   9.234  -2.420  -5.654
  552    HD2  ARG  69           2HD      ARG  69   8.052  -1.325  -8.199
  553    HD3  ARG  69           1HD      ARG  69   9.740  -1.786  -7.996
  554    HE   ARG  69           HE       ARG  69   8.022  -3.936  -7.308
  555   HH11  ARG  69          1HH1      ARG  69   9.314  -2.199 -10.043
  556   HH12  ARG  69          2HH1      ARG  69   9.179  -3.538 -11.136
  557   HH21  ARG  69          1HH2      ARG  69   7.821  -5.731  -8.758
  558   HH22  ARG  69          2HH2      ARG  69   8.301  -5.527 -10.418
  559    H    LEU  70           HN       LEU  70   5.523  -3.301  -3.426
  560    HA   LEU  70           HA       LEU  70   2.997  -2.034  -3.646
  561    HB2  LEU  70           2HB      LEU  70   3.247  -4.475  -3.592
  562    HB3  LEU  70           1HB      LEU  70   3.833  -4.388  -1.942
  563    HG   LEU  70           HG       LEU  70   1.622  -3.467  -1.256
  564   HD11  LEU  70          1HD1      LEU  70  -0.266  -3.685  -2.788
  565   HD12  LEU  70          2HD1      LEU  70   0.832  -4.166  -4.081
  566   HD13  LEU  70          3HD1      LEU  70   0.928  -2.541  -3.399
  567   HD21  LEU  70          3HD2      LEU  70   2.130  -5.825  -0.983
  568   HD22  LEU  70          1HD2      LEU  70   1.587  -6.148  -2.632
  569   HD23  LEU  70          2HD2      LEU  70   0.433  -5.605  -1.415
  570    H    ARG  71           HN       ARG  71   5.196  -2.584  -0.933
  571    HA   ARG  71           HA       ARG  71   3.644  -1.408   1.085
  572    HB2  ARG  71           2HB      ARG  71   5.563  -2.771   1.627
  573    HB3  ARG  71           1HB      ARG  71   6.643  -1.678   0.782
  574    HG2  ARG  71           2HG      ARG  71   5.060  -0.552   3.015
  575    HG3  ARG  71           1HG      ARG  71   6.370  -1.664   3.424
  576    HD2  ARG  71           2HD      ARG  71   7.993  -0.293   2.430
  577    HD3  ARG  71           1HD      ARG  71   6.787   0.638   1.542
  578    HE   ARG  71           HE       ARG  71   6.812   0.780   4.472
  579   HH11  ARG  71          1HH1      ARG  71   7.423   2.287   1.377
  580   HH12  ARG  71          2HH1      ARG  71   7.475   3.900   2.013
  581   HH21  ARG  71          1HH2      ARG  71   6.887   2.890   5.333
  582   HH22  ARG  71          2HH2      ARG  71   7.133   4.252   4.273
  583    H    GLY  72           HN       GLY  72   5.922  -0.038  -1.205
  584    HA2  GLY  72           2HA      GLY  72   6.097   2.553  -0.152
  585    HA3  GLY  72           1HA      GLY  72   6.357   2.123  -1.835
  586    H    ARG  73           HN       ARG  73   3.789   1.233  -2.532
  587    HA   ARG  73           HA       ARG  73   2.507   3.764  -2.865
  588    HB2  ARG  73           2HB      ARG  73   0.816   2.582  -4.163
  589    HB3  ARG  73           1HB      ARG  73   2.435   2.122  -4.664
  590    HG2  ARG  73           2HG      ARG  73   2.232   0.042  -3.405
  591    HG3  ARG  73           1HG      ARG  73   0.604   0.507  -2.904
  592    HD2  ARG  73           2HD      ARG  73   0.499  -1.023  -4.782
  593    HD3  ARG  73           1HD      ARG  73  -0.087   0.570  -5.258
  594    HE   ARG  73           HE       ARG  73   2.671   0.328  -5.846
  595   HH11  ARG  73          1HH1      ARG  73  -0.477  -0.710  -6.958
  596   HH12  ARG  73          2HH1      ARG  73   0.045  -0.988  -8.592
  597   HH21  ARG  73          1HH2      ARG  73   3.365   0.008  -7.992
  598   HH22  ARG  73          2HH2      ARG  73   2.232  -0.565  -9.180
  599    H    ILE  74           HN       ILE  74   1.974   0.969  -0.811
  600    HA   ILE  74           HA       ILE  74  -0.564   1.620   0.179
  601    HB   ILE  74           HB       ILE  74   1.728   0.184   1.528
  602   HG12  ILE  74          2HG1      ILE  74  -0.797  -0.848   0.219
  603   HG13  ILE  74          1HG1      ILE  74   0.813  -0.887  -0.499
  604   HG21  ILE  74          1HG2      ILE  74  -1.156   0.307   2.408
  605   HG22  ILE  74          2HG2      ILE  74   0.196   1.117   3.202
  606   HG23  ILE  74          3HG2      ILE  74   0.129  -0.645   3.151
  607   HD11  ILE  74          3HD1      ILE  74  -0.045  -2.333   2.002
  608   HD12  ILE  74          1HD1      ILE  74   1.569  -2.366   1.290
  609   HD13  ILE  74          2HD1      ILE  74   0.202  -3.050   0.410
  610    H    GLU  75           HN       GLU  75   2.662   2.669   1.183
  611    HA   GLU  75           HA       GLU  75   2.046   4.104   3.475
  612    HB2  GLU  75           2HB      GLU  75   4.339   3.692   2.670
  613    HB3  GLU  75           1HB      GLU  75   4.069   4.796   1.332
  614    HG2  GLU  75           2HG      GLU  75   3.669   6.599   3.027
  615    HG3  GLU  75           1HG      GLU  75   4.219   5.464   4.257
  616    H    SER  76           HN       SER  76   2.048   5.177   0.104
  617    HA   SER  76           HA       SER  76   1.323   7.838   0.573
  618    HB2  SER  76           2HB      SER  76   0.875   6.125  -1.861
  619    HB3  SER  76           1HB      SER  76   0.730   7.880  -1.823
  620    HG   SER  76           HG       SER  76   2.898   6.535  -2.302
  621    H    VAL  77           HN       VAL  77  -0.632   4.951   0.134
  622    HA   VAL  77           HA       VAL  77  -3.116   6.323  -0.145
  623    HB   VAL  77           HB       VAL  77  -2.580   3.460   0.669
  624   HG11  VAL  77          1HG1      VAL  77  -4.800   4.187   1.371
  625   HG12  VAL  77          2HG1      VAL  77  -4.913   3.045   0.031
  626   HG13  VAL  77          3HG1      VAL  77  -5.136   4.770  -0.259
  627   HG21  VAL  77          3HG2      VAL  77  -3.283   4.652  -2.014
  628   HG22  VAL  77          1HG2      VAL  77  -3.108   2.931  -1.662
  629   HG23  VAL  77          2HG2      VAL  77  -1.710   4.001  -1.547
  630    H    LEU  78           HN       LEU  78  -1.538   4.670   2.576
  631    HA   LEU  78           HA       LEU  78  -3.668   5.041   4.385
  632    HB2  LEU  78           2HB      LEU  78  -0.738   4.546   4.877
  633    HB3  LEU  78           1HB      LEU  78  -1.958   4.531   6.137
  634    HG   LEU  78           HG       LEU  78  -1.855   2.654   3.773
  635   HD11  LEU  78          1HD1      LEU  78  -1.347   0.950   5.472
  636   HD12  LEU  78          2HD1      LEU  78  -1.263   2.216   6.698
  637   HD13  LEU  78          3HD1      LEU  78  -0.095   2.188   5.377
  638   HD21  LEU  78          3HD2      LEU  78  -3.666   1.471   4.931
  639   HD22  LEU  78          1HD2      LEU  78  -4.141   3.104   4.462
  640   HD23  LEU  78          2HD2      LEU  78  -3.721   2.755   6.139
  641    H    ASP  79           HN       ASP  79  -0.736   6.961   3.790
  642    HA   ASP  79           HA       ASP  79  -1.239   8.787   5.910
  643    HB2  ASP  79           2HB      ASP  79   0.675   8.621   3.675
  644    HB3  ASP  79           1HB      ASP  79   0.297  10.255   4.214
  645    H    TRP  80           HN       TRP  80  -2.309   8.612   2.593
  646    HA   TRP  80           HA       TRP  80  -3.343  11.258   2.445
  647    HB2  TRP  80           2HB      TRP  80  -2.946   9.944   0.423
  648    HB3  TRP  80           1HB      TRP  80  -4.144   8.762   0.933
  649    HD1  TRP  80           1HD      TRP  80  -3.955  12.470  -0.153
  650    HE1  TRP  80           1HE      TRP  80  -6.204  13.112  -1.231
  651    HE3  TRP  80           3HE      TRP  80  -6.514   8.125   0.688
  652    HZ2  TRP  80           2HZ      TRP  80  -8.728  11.916  -1.672
  653    HZ3  TRP  80           3HZ      TRP  80  -8.839   7.957  -0.098
  654    HH2  TRP  80           2HH      TRP  80  -9.921   9.814  -1.251
  655    H    ALA  81           HN       ALA  81  -4.683   8.139   3.397
  656    HA   ALA  81           HA       ALA  81  -7.331   8.917   3.863
  657    HB1  ALA  81           1HB      ALA  81  -5.693   6.839   5.317
  658    HB2  ALA  81           2HB      ALA  81  -6.631   6.581   3.845
  659    HB3  ALA  81           3HB      ALA  81  -7.451   6.974   5.357
  660    H    THR  82           HN       THR  82  -4.440   9.130   5.867
  661    HA   THR  82           HA       THR  82  -5.645  10.063   8.225
  662    HB   THR  82           HB       THR  82  -2.890  10.747   7.192
  663    HG1  THR  82           1HG      THR  82  -2.249   8.844   8.250
  664   HG21  THR  82          3HG2      THR  82  -3.570  12.092   9.118
  665   HG22  THR  82          1HG2      THR  82  -2.320  10.931   9.575
  666   HG23  THR  82          2HG2      THR  82  -4.004  10.626   9.998
  667    H    VAL  83           HN       VAL  83  -4.372  11.799   5.400
  668    HA   VAL  83           HA       VAL  83  -4.823  14.412   6.339
  669    HB   VAL  83           HB       VAL  83  -4.875  13.421   3.479
  670   HG11  VAL  83          1HG1      VAL  83  -5.899  15.623   3.703
  671   HG12  VAL  83          2HG1      VAL  83  -4.348  15.737   2.870
  672   HG13  VAL  83          3HG1      VAL  83  -4.476  16.210   4.565
  673   HG21  VAL  83          3HG2      VAL  83  -2.604  14.533   5.129
  674   HG22  VAL  83          1HG2      VAL  83  -2.531  14.144   3.410
  675   HG23  VAL  83          2HG2      VAL  83  -2.788  12.862   4.592
  676    H    ARG  84           HN       ARG  84  -6.885  12.124   4.617
  677    HA   ARG  84           HA       ARG  84  -9.104  13.933   4.407
  678    HB2  ARG  84           2HB      ARG  84  -8.718  11.007   3.898
  679    HB3  ARG  84           1HB      ARG  84 -10.333  11.696   3.920
  680    HG2  ARG  84           2HG      ARG  84  -8.081  12.542   2.113
  681    HG3  ARG  84           1HG      ARG  84  -9.465  11.546   1.657
  682    HD2  ARG  84           2HD      ARG  84 -10.844  13.565   2.575
  683    HD3  ARG  84           1HD      ARG  84  -9.348  14.457   2.306
  684    HE   ARG  84           HE       ARG  84 -10.459  12.887   0.104
  685   HH11  ARG  84          1HH1      ARG  84  -9.699  16.013   1.499
  686   HH12  ARG  84          2HH1      ARG  84 -10.123  16.890   0.058
  687   HH21  ARG  84          1HH2      ARG  84 -10.973  14.024  -1.786
  688   HH22  ARG  84          2HH2      ARG  84 -10.793  15.754  -1.835
  689    H    GLY  85           HN       GLY  85  -7.803  12.305   7.007
  690    HA2  GLY  85           2HA      GLY  85  -8.556  12.238   9.189
  691    HA3  GLY  85           1HA      GLY  85 -10.069  12.949   8.650
  692    H    TYR  86           HN       TYR  86  -8.807  10.028   7.208
  693    HA   TYR  86           HA       TYR  86 -11.120   8.551   8.143
  694    HB2  TYR  86           2HB      TYR  86  -8.871   7.922   6.249
  695    HB3  TYR  86           1HB      TYR  86  -9.928   6.647   6.845
  696    HD1  TYR  86           1HD      TYR  86 -12.422   6.870   6.423
  697    HD2  TYR  86           2HD      TYR  86  -9.522   9.267   4.446
  698    HE1  TYR  86           1HE      TYR  86 -14.057   7.381   4.661
  699    HE2  TYR  86           2HE      TYR  86 -11.150   9.791   2.678
  700    HH   TYR  86           HH       TYR  86 -14.490   9.064   2.998
  701    H    ARG  87           HN       ARG  87  -7.780   8.893   8.928
  702    HA   ARG  87           HA       ARG  87  -8.128   7.096  11.181
  703    HB2  ARG  87           2HB      ARG  87  -5.899   6.024  10.718
  704    HB3  ARG  87           1HB      ARG  87  -7.198   5.552   9.633
  705    HG2  ARG  87           2HG      ARG  87  -6.248   6.572   7.829
  706    HG3  ARG  87           1HG      ARG  87  -5.451   7.807   8.804
  707    HD2  ARG  87           2HD      ARG  87  -3.959   6.062   7.711
  708    HD3  ARG  87           1HD      ARG  87  -3.721   6.343   9.433
  709    HE   ARG  87           HE       ARG  87  -5.204   4.041   8.328
  710   HH11  ARG  87          1HH1      ARG  87  -3.108   5.496  10.718
  711   HH12  ARG  87          2HH1      ARG  87  -2.911   4.029  11.634
  712   HH21  ARG  87          1HH2      ARG  87  -4.930   2.089   9.515
  713   HH22  ARG  87          2HH2      ARG  87  -3.931   2.092  10.933
  714    H    GLU  88           HN       GLU  88  -6.018   7.138  12.516
  715    HA   GLU  88           HA       GLU  88  -5.438   9.886  13.090
  716    HB2  GLU  88           2HB      GLU  88  -4.612   7.273  14.342
  717    HB3  GLU  88           1HB      GLU  88  -3.949   8.808  14.884
  718    HG2  GLU  88           2HG      GLU  88  -5.811   8.018  16.276
  719    HG3  GLU  88           1HG      GLU  88  -6.133   9.580  15.530
  720    H    GLY  89           HN       GLY  89  -3.097  10.476  13.585
  721    HA2  GLY  89           2HA      GLY  89  -1.734  10.385  11.082
  722    HA3  GLY  89           1HA      GLY  89  -1.193  11.211  12.532
  723    H    ASP  90           HN       ASP  90   0.656  10.136  11.035
  724    HA   ASP  90           HA       ASP  90   2.453   8.815  10.930
  725    HB2  ASP  90           2HB      ASP  90   2.514   9.240  13.370
  726    HB3  ASP  90           1HB      ASP  90   1.628   7.744  13.616
  727    H    ASN  91           HN       ASN  91   2.847   7.098   9.810
  728    HA   ASN  91           HA       ASN  91   0.514   5.545   9.067
  729    HB2  ASN  91           2HB      ASN  91   2.135   6.754   7.502
  730    HB3  ASN  91           1HB      ASN  91   3.285   5.478   7.861
  731   HD21  ASN  91          1HD2      ASN  91   1.816   6.411   5.423
  732   HD22  ASN  91          2HD2      ASN  91   1.130   4.963   4.758
  733    HA   PRO  92           HA       PRO  92   1.908   1.838  11.184
  734    HB2  PRO  92           2HB      PRO  92   0.224   0.077  10.000
  735    HB3  PRO  92           1HB      PRO  92  -0.303   1.208  11.254
  736    HG2  PRO  92           2HG      PRO  92  -0.584   1.404   8.278
  737    HG3  PRO  92           1HG      PRO  92  -1.770   1.776   9.545
  738    HD2  PRO  92           2HD      PRO  92  -0.318   3.692   8.284
  739    HD3  PRO  92           1HD      PRO  92  -0.852   3.843   9.971
  740    H    ALA  93           HN       ALA  93   1.876   2.281   7.733
  741    HA   ALA  93           HA       ALA  93   3.493  -0.120   7.275
  742    HB1  ALA  93           1HB      ALA  93   1.644   0.346   5.724
  743    HB2  ALA  93           2HB      ALA  93   3.205   0.367   4.901
  744    HB3  ALA  93           3HB      ALA  93   2.395   1.883   5.299
  745    H    ARG  94           HN       ARG  94   4.229   2.604   8.554
  746    HA   ARG  94           HA       ARG  94   6.052   3.917   6.847
  747    HB2  ARG  94           2HB      ARG  94   4.948   4.887   8.856
  748    HB3  ARG  94           1HB      ARG  94   5.990   3.894   9.864
  749    HG2  ARG  94           2HG      ARG  94   7.939   5.049   9.072
  750    HG3  ARG  94           1HG      ARG  94   6.963   5.970   7.919
  751    HD2  ARG  94           2HD      ARG  94   5.679   6.877   9.849
  752    HD3  ARG  94           1HD      ARG  94   6.815   6.070  10.928
  753    HE   ARG  94           HE       ARG  94   8.402   7.574   9.319
  754   HH11  ARG  94          1HH1      ARG  94   5.579   8.260  11.284
  755   HH12  ARG  94          2HH1      ARG  94   6.088   9.883  11.669
  756   HH21  ARG  94          1HH2      ARG  94   9.090   9.684   9.844
  757   HH22  ARG  94          2HH2      ARG  94   8.102  10.679  10.875
  758    H    TRP  95           HN       TRP  95   6.947   2.283   9.871
  759    HA   TRP  95           HA       TRP  95   8.601   0.864  10.439
  760    HB2  TRP  95           2HB      TRP  95   8.589   0.382   7.493
  761    HB3  TRP  95           1HB      TRP  95   9.921  -0.246   8.458
  762    HD1  TRP  95           1HD      TRP  95   8.826  -1.603  10.822
  763    HE1  TRP  95           1HE      TRP  95   7.087  -3.493  10.740
  764    HE3  TRP  95           3HE      TRP  95   6.831  -0.658   6.212
  765    HZ2  TRP  95           2HZ      TRP  95   5.120  -4.458   8.948
  766    HZ3  TRP  95           3HZ      TRP  95   5.026  -2.114   5.387
  767    HH2  TRP  95           2HH      TRP  95   4.192  -3.975   6.729
  768    H    ARG  96           HN       ARG  96  10.508   1.273  11.233
  769    HA   ARG  96           HA       ARG  96  12.189   3.305   9.967
  770    HB2  ARG  96           2HB      ARG  96  12.258   2.036  12.709
  771    HB3  ARG  96           1HB      ARG  96  13.423   3.214  12.136
  772    HG2  ARG  96           2HG      ARG  96  11.689   4.891  11.950
  773    HG3  ARG  96           1HG      ARG  96  10.471   3.707  12.436
  774    HD2  ARG  96           2HD      ARG  96  11.157   5.163  14.299
  775    HD3  ARG  96           1HD      ARG  96  11.523   3.466  14.605
  776    HE   ARG  96           HE       ARG  96  13.549   5.438  13.731
  777   HH11  ARG  96          1HH1      ARG  96  12.580   2.679  15.675
  778   HH12  ARG  96          2HH1      ARG  96  14.134   2.511  16.434
  779   HH21  ARG  96          1HH2      ARG  96  15.581   5.212  14.706
  780   HH22  ARG  96          2HH2      ARG  96  15.856   3.948  15.876
  781    H    GLY  97           HN       GLY  97  12.039  -0.028  10.914
  782    HA2  GLY  97           2HA      GLY  97  14.235  -0.713   9.185
  783    HA3  GLY  97           1HA      GLY  97  14.602  -0.915  10.894
  784    H    TYR  98           HN       TYR  98  12.219  -1.804   8.419
  785    HA   TYR  98           HA       TYR  98  11.194  -4.033   9.871
  786    HB2  TYR  98           2HB      TYR  98   9.936  -2.914   8.064
  787    HB3  TYR  98           1HB      TYR  98  11.131  -3.459   6.895
  788    HD1  TYR  98           2HD      TYR  98   8.887  -4.904   9.519
  789    HD2  TYR  98           1HD      TYR  98  10.618  -5.329   5.658
  790    HE1  TYR  98           2HE      TYR  98   7.595  -6.967   9.174
  791    HE2  TYR  98           1HE      TYR  98   9.331  -7.393   5.302
  792    HH   TYR  98           HH       TYR  98   6.772  -8.346   7.355
  793    H    LEU  99           HN       LEU  99  13.200  -3.943   6.924
  794    HA   LEU  99           HA       LEU  99  14.547  -6.381   7.843
  795    HB2  LEU  99           2HB      LEU  99  14.529  -5.053   5.128
  796    HB3  LEU  99           1HB      LEU  99  15.412  -6.510   5.524
  797    HG   LEU  99           HG       LEU  99  12.407  -6.215   5.529
  798   HD11  LEU  99          1HD1      LEU  99  13.396  -6.241   3.290
  799   HD12  LEU  99          2HD1      LEU  99  12.474  -7.709   3.613
  800   HD13  LEU  99          3HD1      LEU  99  14.237  -7.741   3.680
  801   HD21  LEU  99          3HD2      LEU  99  14.114  -8.652   6.027
  802   HD22  LEU  99          1HD2      LEU  99  12.353  -8.610   5.948
  803   HD23  LEU  99          2HD2      LEU  99  13.197  -7.774   7.251
  804    H    GLU 100           HN       GLU 100  14.943  -3.051   6.986
  805    HA   GLU 100           HA       GLU 100  17.184  -2.617   8.593
  806    HB2  GLU 100           2HB      GLU 100  18.117  -3.939   6.516
  807    HB3  GLU 100           1HB      GLU 100  17.948  -2.392   5.697
  808    HG2  GLU 100           2HG      GLU 100  19.454  -1.346   7.241
  809    HG3  GLU 100           1HG      GLU 100  19.529  -2.810   8.222
  810    H    HIS 101           HN       HIS 101  18.168  -0.319   7.837
  811    HA   HIS 101           HA       HIS 101  15.790   1.327   7.524
  812    HB2  HIS 101           2HB      HIS 101  17.288   3.230   8.179
  813    HB3  HIS 101           1HB      HIS 101  17.130   1.968   9.390
  814    HD1  HIS 101           1HD      HIS 101  19.592   4.002   7.774
  815    HD2  HIS 101           2HD      HIS 101  19.489   0.138   9.305
  816    HE1  HIS 101           1HE      HIS 101  21.996   3.345   8.131
  817    HE2  HIS 101           2HE      HIS 101  21.875   1.117   9.310
  818    H    HIS 102           HN       HIS 102  15.933   0.348   5.240
  819    HA   HIS 102           HA       HIS 102  17.698   1.532   3.355
  820    HB2  HIS 102           2HB      HIS 102  16.217  -0.598   3.130
  821    HB3  HIS 102           1HB      HIS 102  14.940   0.523   2.678
  822    HD1  HIS 102           1HD      HIS 102  17.532  -1.485   1.246
  823    HD2  HIS 102           2HD      HIS 102  15.817   2.197   0.343
  824    HE1  HIS 102           1HE      HIS 102  18.110  -1.033  -1.160
  825    HE2  HIS 102           2HE      HIS 102  17.285   1.308  -1.589
  826    H    HIS 103           HN       HIS 103  17.712   3.584   2.717
  827    HA   HIS 103           HA       HIS 103  15.240   5.146   3.095
  828    HB2  HIS 103           2HB      HIS 103  16.788   7.090   3.641
  829    HB3  HIS 103           1HB      HIS 103  16.651   5.823   4.852
  830    HD1  HIS 103           1HD      HIS 103  18.735   4.176   5.048
  831    HD2  HIS 103           2HD      HIS 103  19.331   7.582   2.737
  832    HE1  HIS 103           1HE      HIS 103  21.229   4.413   4.820
  833    HE2  HIS 103           2HE      HIS 103  21.561   6.612   3.631
  834    H    HIS 104           HN       HIS 104  17.020   7.477   2.119
  835    HA   HIS 104           HA       HIS 104  15.978   7.596  -0.481
  836    HB2  HIS 104           2HB      HIS 104  16.432   9.578   0.828
  837    HB3  HIS 104           1HB      HIS 104  18.147   9.206   0.869
  838    HD1  HIS 104           1HD      HIS 104  18.950  11.309  -0.240
  839    HD2  HIS 104           2HD      HIS 104  16.100   9.294  -2.505
  840    HE1  HIS 104           1HE      HIS 104  18.931  12.450  -2.482
  841    HE2  HIS 104           2HE      HIS 104  17.284  11.152  -3.873
  842    H    HIS 105           HN       HIS 105  16.763   5.493  -1.233
  843    HA   HIS 105           HA       HIS 105  18.528   5.801  -3.342
  844    HB2  HIS 105           2HB      HIS 105  19.973   5.353  -0.959
  845    HB3  HIS 105           1HB      HIS 105  19.976   3.817  -1.818
  846    HD1  HIS 105           1HD      HIS 105  20.788   4.052  -4.452
  847    HD2  HIS 105           2HD      HIS 105  21.863   7.086  -1.813
  848    HE1  HIS 105           1HE      HIS 105  22.678   5.284  -5.565
  849    HE2  HIS 105           2HE      HIS 105  23.163   7.234  -4.042
  850    H    HIS 106           HN       HIS 106  16.836   4.742  -4.366
  851    HA   HIS 106           HA       HIS 106  16.027   2.123  -3.404
  852    HB2  HIS 106           2HB      HIS 106  15.051   3.831  -5.693
  853    HB3  HIS 106           1HB      HIS 106  14.453   2.203  -5.392
  854    HD1  HIS 106           1HD      HIS 106  12.809   1.879  -3.444
  855    HD2  HIS 106           2HD      HIS 106  14.233   5.775  -3.809
  856    HE1  HIS 106           1HE      HIS 106  11.376   3.273  -1.921
  857    HE2  HIS 106           2HE      HIS 106  12.172   5.642  -2.243
  Start of MODEL   19
    1    H1   MET   1           H1       MET   1 -15.486   5.457   5.901
    2    H2   MET   1           H2       MET   1 -14.514   4.381   6.785
    3    H3   MET   1           H3       MET   1 -15.773   3.789   5.819
    4    HA   MET   1           HA       MET   1 -14.680   4.453   3.829
    5    HB2  MET   1           2HB      MET   1 -13.641   6.508   4.636
    6    HB3  MET   1           1HB      MET   1 -12.574   5.585   5.688
    7    HG2  MET   1           2HG      MET   1 -11.358   6.302   3.741
    8    HG3  MET   1           1HG      MET   1 -11.550   4.553   3.702
    9    HE1  MET   1           2HE      MET   1 -13.988   7.490   1.104
   10    HE2  MET   1           3HE      MET   1 -12.707   7.983   2.213
   11    HE3  MET   1           1HE      MET   1 -14.220   7.335   2.846
   12    H    THR   2           HN       THR   2 -13.848   2.676   2.892
   13    HA   THR   2           HA       THR   2 -12.285   0.855   4.595
   14    HB   THR   2           HB       THR   2 -12.741  -0.866   2.851
   15    HG1  THR   2           1HG      THR   2 -14.610   1.016   1.792
   16   HG21  THR   2          3HG2      THR   2 -15.110  -1.193   3.412
   17   HG22  THR   2          1HG2      THR   2 -15.193   0.465   4.005
   18   HG23  THR   2          2HG2      THR   2 -14.171  -0.714   4.826
   19    H    PHE   3           HN       PHE   3 -10.533  -0.360   3.403
   20    HA   PHE   3           HA       PHE   3  -8.652   1.522   2.447
   21    HB2  PHE   3           2HB      PHE   3  -8.045  -0.569   3.635
   22    HB3  PHE   3           1HB      PHE   3  -8.566  -1.495   2.234
   23    HD1  PHE   3           2HD      PHE   3  -6.157   1.124   3.291
   24    HD2  PHE   3           1HD      PHE   3  -7.068  -1.968   0.514
   25    HE1  PHE   3           2HE      PHE   3  -3.905   1.333   2.322
   26    HE2  PHE   3           1HE      PHE   3  -4.818  -1.762  -0.459
   27    HZ   PHE   3           HZ       PHE   3  -3.231  -0.110   0.445
   28    H    SER   4           HN       SER   4 -10.663  -0.888   0.837
   29    HA   SER   4           HA       SER   4  -9.661  -0.625  -1.758
   30    HB2  SER   4           2HB      SER   4 -11.214  -2.411  -1.053
   31    HB3  SER   4           1HB      SER   4 -12.505  -1.220  -0.898
   32    HG   SER   4           HG       SER   4 -12.831  -1.935  -2.892
   33    H    GLU   5           HN       GLU   5 -12.313   1.122  -0.155
   34    HA   GLU   5           HA       GLU   5 -13.045   2.752  -2.315
   35    HB2  GLU   5           2HB      GLU   5 -13.240   3.162   0.663
   36    HB3  GLU   5           1HB      GLU   5 -13.939   4.266  -0.502
   37    HG2  GLU   5           2HG      GLU   5 -15.390   2.524  -1.335
   38    HG3  GLU   5           1HG      GLU   5 -14.641   1.358  -0.246
   39    H    CYS   6           HN       CYS   6 -10.825   3.330   0.378
   40    HA   CYS   6           HA       CYS   6 -10.203   6.001  -0.262
   41    HB2  CYS   6           2HB      CYS   6  -9.805   4.845   1.926
   42    HB3  CYS   6           1HB      CYS   6  -8.451   4.016   1.188
   43    HG   CYS   6           HG       CYS   6  -7.611   6.888   0.449
   44    H    ALA   7           HN       ALA   7  -8.498   2.977  -0.926
   45    HA   ALA   7           HA       ALA   7  -6.304   4.013  -2.298
   46    HB1  ALA   7           1HB      ALA   7  -7.705   1.388  -2.791
   47    HB2  ALA   7           2HB      ALA   7  -6.452   1.684  -1.586
   48    HB3  ALA   7           3HB      ALA   7  -6.069   1.800  -3.304
   49    H    ALA   8           HN       ALA   8  -9.467   2.996  -3.551
   50    HA   ALA   8           HA       ALA   8  -8.950   3.544  -6.262
   51    HB1  ALA   8           1HB      ALA   8 -10.829   2.169  -5.522
   52    HB2  ALA   8           2HB      ALA   8 -11.370   3.493  -6.553
   53    HB3  ALA   8           3HB      ALA   8 -11.592   3.589  -4.805
   54    H    LEU   9           HN       LEU   9 -10.360   5.553  -3.690
   55    HA   LEU   9           HA       LEU   9 -10.941   7.786  -5.306
   56    HB2  LEU   9           2HB      LEU   9 -10.309   7.624  -2.359
   57    HB3  LEU   9           1HB      LEU   9 -10.888   9.069  -3.159
   58    HG   LEU   9           HG       LEU   9 -12.401   6.468  -2.911
   59   HD11  LEU   9          1HD1      LEU   9 -13.888   7.752  -1.457
   60   HD12  LEU   9          2HD1      LEU   9 -12.825   9.150  -1.603
   61   HD13  LEU   9          3HD1      LEU   9 -12.250   7.685  -0.808
   62   HD21  LEU   9          3HD2      LEU   9 -13.221   9.103  -4.131
   63   HD22  LEU   9          1HD2      LEU   9 -14.271   7.706  -3.886
   64   HD23  LEU   9          2HD2      LEU   9 -12.914   7.602  -5.006
   65    H    TYR  10           HN       TYR  10  -8.048   6.867  -3.510
   66    HA   TYR  10           HA       TYR  10  -6.527   9.183  -3.846
   67    HB2  TYR  10           2HB      TYR  10  -5.819   7.384  -2.383
   68    HB3  TYR  10           1HB      TYR  10  -5.673   6.282  -3.744
   69    HD1  TYR  10           2HD      TYR  10  -4.212   9.312  -2.192
   70    HD2  TYR  10           1HD      TYR  10  -3.677   6.164  -5.002
   71    HE1  TYR  10           2HE      TYR  10  -1.846   9.934  -2.431
   72    HE2  TYR  10           1HE      TYR  10  -1.311   6.777  -5.248
   73    HH   TYR  10           HH       TYR  10   0.268   8.915  -3.122
   74    H    ILE  11           HN       ILE  11  -6.727   6.308  -5.893
   75    HA   ILE  11           HA       ILE  11  -4.933   7.261  -7.870
   76    HB   ILE  11           HB       ILE  11  -7.056   5.116  -8.074
   77   HG12  ILE  11          2HG1      ILE  11  -4.088   4.867  -7.520
   78   HG13  ILE  11          1HG1      ILE  11  -5.339   4.789  -6.286
   79   HG21  ILE  11          1HG2      ILE  11  -4.665   5.665  -9.827
   80   HG22  ILE  11          2HG2      ILE  11  -6.356   5.884 -10.273
   81   HG23  ILE  11          3HG2      ILE  11  -5.732   4.266  -9.957
   82   HD11  ILE  11          3HD1      ILE  11  -5.045   2.887  -8.595
   83   HD12  ILE  11          1HD1      ILE  11  -6.256   2.794  -7.318
   84   HD13  ILE  11          2HD1      ILE  11  -4.548   2.576  -6.932
   85    H    LYS  12           HN       LYS  12  -8.483   7.160  -7.692
   86    HA   LYS  12           HA       LYS  12  -8.906   8.232 -10.267
   87    HB2  LYS  12           2HB      LYS  12 -10.666   8.031  -7.834
   88    HB3  LYS  12           1HB      LYS  12 -11.229   8.752  -9.336
   89    HG2  LYS  12           2HG      LYS  12 -10.825   6.675 -10.519
   90    HG3  LYS  12           1HG      LYS  12 -10.177   5.943  -9.052
   91    HD2  LYS  12           2HD      LYS  12 -12.494   5.252  -9.470
   92    HD3  LYS  12           1HD      LYS  12 -12.344   6.160  -7.964
   93    HE2  LYS  12           2HE      LYS  12 -13.204   8.146  -9.024
   94    HE3  LYS  12           1HE      LYS  12 -13.221   7.345 -10.595
   95    HZ1  LYS  12           3HZ      LYS  12 -15.017   6.048 -10.014
   96    HZ2  LYS  12           1HZ      LYS  12 -15.393   7.515  -9.250
   97    HZ3  LYS  12           2HZ      LYS  12 -14.764   6.222  -8.345
   98    H    ALA  13           HN       ALA  13  -8.435   9.784  -7.136
   99    HA   ALA  13           HA       ALA  13  -9.267  12.366  -8.040
  100    HB1  ALA  13           1HB      ALA  13  -7.560  11.651  -5.661
  101    HB2  ALA  13           2HB      ALA  13  -9.319  11.759  -5.672
  102    HB3  ALA  13           3HB      ALA  13  -8.346  13.201  -5.950
  103    H    HIS  14           HN       HIS  14  -6.215  10.646  -7.968
  104    HA   HIS  14           HA       HIS  14  -4.791  13.073  -8.773
  105    HB2  HIS  14           2HB      HIS  14  -4.009  11.315  -6.978
  106    HB3  HIS  14           1HB      HIS  14  -3.451  10.419  -8.383
  107    HD1  HIS  14           1HD      HIS  14  -2.089  12.476  -5.941
  108    HD2  HIS  14           2HD      HIS  14  -1.857  12.522 -10.098
  109    HE1  HIS  14           1HE      HIS  14  -0.009  13.776  -6.497
  110    HE2  HIS  14           2HE      HIS  14   0.162  13.713  -9.011
  111    H    ARG  15           HN       ARG  15  -6.529  10.787 -10.319
  112    HA   ARG  15           HA       ARG  15  -4.752   9.838 -12.301
  113    HB2  ARG  15           2HB      ARG  15  -6.638   8.954 -13.419
  114    HB3  ARG  15           1HB      ARG  15  -6.994   8.832 -11.705
  115    HG2  ARG  15           2HG      ARG  15  -8.387  10.841 -11.862
  116    HG3  ARG  15           1HG      ARG  15  -8.047  10.930 -13.589
  117    HD2  ARG  15           2HD      ARG  15  -9.487   8.719 -12.131
  118    HD3  ARG  15           1HD      ARG  15 -10.199   9.889 -13.238
  119    HE   ARG  15           HE       ARG  15  -8.169   8.492 -14.582
  120   HH11  ARG  15          1HH1      ARG  15 -11.394   8.006 -13.288
  121   HH12  ARG  15          2HH1      ARG  15 -11.767   6.694 -14.370
  122   HH21  ARG  15          1HH2      ARG  15  -8.650   6.740 -15.989
  123   HH22  ARG  15          2HH2      ARG  15 -10.219   5.984 -15.903
  124    H    SER  16           HN       SER  16  -6.505  12.784 -11.934
  125    HA   SER  16           HA       SER  16  -6.602  13.720 -14.550
  126    HB2  SER  16           2HB      SER  16  -7.697  14.871 -12.682
  127    HB3  SER  16           1HB      SER  16  -6.124  15.289 -12.000
  128    HG   SER  16           HG       SER  16  -7.289  16.919 -13.357
  129    H    SER  17           HN       SER  17  -3.979  13.846 -12.185
  130    HA   SER  17           HA       SER  17  -2.223  15.213 -14.026
  131    HB2  SER  17           2HB      SER  17  -1.644  14.067 -11.288
  132    HB3  SER  17           1HB      SER  17  -0.678  15.237 -12.174
  133    HG   SER  17           HG       SER  17  -2.973  16.362 -12.113
  134    H    TRP  18           HN       TRP  18  -3.192  12.087 -13.509
  135    HA   TRP  18           HA       TRP  18  -0.614  10.893 -14.212
  136    HB2  TRP  18           2HB      TRP  18  -3.151   9.766 -13.057
  137    HB3  TRP  18           1HB      TRP  18  -1.924   8.722 -13.757
  138    HD1  TRP  18           1HD      TRP  18   0.030  11.318 -12.198
  139    HE1  TRP  18           1HE      TRP  18   0.800  10.655  -9.827
  140    HE3  TRP  18           3HE      TRP  18  -3.136   7.383 -11.402
  141    HZ2  TRP  18           2HZ      TRP  18   0.135   8.713  -7.885
  142    HZ3  TRP  18           3HZ      TRP  18  -3.004   6.176  -9.267
  143    HH2  TRP  18           2HH      TRP  18  -1.404   6.827  -7.542
  144    H    LYS  19           HN       LYS  19  -2.465  12.356 -16.092
  145    HA   LYS  19           HA       LYS  19  -2.895  12.236 -18.242
  146    HB2  LYS  19           2HB      LYS  19  -1.404   9.644 -18.138
  147    HB3  LYS  19           1HB      LYS  19  -2.002  10.383 -19.622
  148    HG2  LYS  19           2HG      LYS  19  -0.684  12.456 -18.380
  149    HG3  LYS  19           1HG      LYS  19   0.322  11.057 -18.008
  150    HD2  LYS  19           2HD      LYS  19  -0.621  11.684 -20.795
  151    HD3  LYS  19           1HD      LYS  19   0.872  12.341 -20.130
  152    HE2  LYS  19           2HE      LYS  19   1.636  10.025 -19.695
  153    HE3  LYS  19           1HE      LYS  19   0.182   9.434 -20.498
  154    HZ1  LYS  19           3HZ      LYS  19   0.874  10.445 -22.535
  155    HZ2  LYS  19           1HZ      LYS  19   2.162   9.507 -21.952
  156    HZ3  LYS  19           2HZ      LYS  19   2.201  11.194 -21.783
  157    H    ASN  20           HN       ASN  20  -5.248  10.314 -19.507
  158    HA   ASN  20           HA       ASN  20  -4.608   7.886 -18.475
  159    HB2  ASN  20           2HB      ASN  20  -4.936   8.842 -21.272
  160    HB3  ASN  20           1HB      ASN  20  -4.541   7.160 -20.927
  161   HD21  ASN  20          1HD2      ASN  20  -6.950   8.261 -22.104
  162   HD22  ASN  20          2HD2      ASN  20  -8.257   7.776 -21.077
  163    H    THR  21           HN       THR  21  -2.658   7.851 -17.480
  164    HA   THR  21           HA       THR  21  -0.936   6.378 -19.368
  165    HB   THR  21           HB       THR  21   0.571   6.634 -17.013
  166    HG1  THR  21           1HG      THR  21  -0.948   8.675 -16.988
  167   HG21  THR  21          3HG2      THR  21   2.166   7.793 -18.472
  168   HG22  THR  21          1HG2      THR  21   0.898   7.995 -19.682
  169   HG23  THR  21          2HG2      THR  21   1.462   6.379 -19.261
  170    H    LYS  22           HN       LYS  22  -0.552   4.242 -18.818
  171    HA   LYS  22           HA       LYS  22  -2.747   3.191 -17.329
  172    HB2  LYS  22           2HB      LYS  22  -2.083   1.048 -18.158
  173    HB3  LYS  22           1HB      LYS  22  -1.999   2.235 -19.444
  174    HG2  LYS  22           2HG      LYS  22   0.428   2.358 -19.165
  175    HG3  LYS  22           1HG      LYS  22   0.330   1.137 -17.894
  176    HD2  LYS  22           2HD      LYS  22  -0.466   0.789 -20.783
  177    HD3  LYS  22           1HD      LYS  22   0.953   0.097 -19.995
  178    HE2  LYS  22           2HE      LYS  22  -0.396  -1.295 -18.610
  179    HE3  LYS  22           1HE      LYS  22  -1.869  -0.464 -19.106
  180    HZ1  LYS  22           3HZ      LYS  22  -1.624  -2.602 -20.212
  181    HZ2  LYS  22           1HZ      LYS  22  -0.141  -2.111 -20.879
  182    HZ3  LYS  22           2HZ      LYS  22  -1.575  -1.332 -21.337
  183    H    HIS  23           HN       HIS  23   0.310   4.057 -16.284
  184    HA   HIS  23           HA       HIS  23   0.878   2.069 -14.407
  185    HB2  HIS  23           2HB      HIS  23   2.210   3.650 -13.208
  186    HB3  HIS  23           1HB      HIS  23   2.388   3.985 -14.922
  187    HD1  HIS  23           1HD      HIS  23   1.978   5.664 -11.820
  188    HD2  HIS  23           2HD      HIS  23   0.561   6.272 -15.683
  189    HE1  HIS  23           1HE      HIS  23   1.307   8.078 -11.926
  190    HE2  HIS  23           2HE      HIS  23   0.743   8.479 -14.346
  191    H    ALA  24           HN       ALA  24  -1.584   4.545 -14.345
  192    HA   ALA  24           HA       ALA  24  -2.314   4.394 -11.628
  193    HB1  ALA  24           1HB      ALA  24  -4.489   5.269 -12.363
  194    HB2  ALA  24           2HB      ALA  24  -4.050   4.940 -14.041
  195    HB3  ALA  24           3HB      ALA  24  -3.150   6.140 -13.113
  196    H    ASP  25           HN       ASP  25  -3.137   2.413 -14.418
  197    HA   ASP  25           HA       ASP  25  -5.110   0.806 -13.165
  198    HB2  ASP  25           2HB      ASP  25  -4.846   0.931 -15.617
  199    HB3  ASP  25           1HB      ASP  25  -3.290   0.128 -15.489
  200    H    GLN  26           HN       GLN  26  -1.636   0.489 -13.620
  201    HA   GLN  26           HA       GLN  26  -1.275  -2.064 -12.579
  202    HB2  GLN  26           2HB      GLN  26   0.556   0.329 -12.611
  203    HB3  GLN  26           1HB      GLN  26   1.065  -1.274 -12.116
  204    HG2  GLN  26           2HG      GLN  26  -0.041  -0.561 -14.819
  205    HG3  GLN  26           1HG      GLN  26   1.666  -0.774 -14.434
  206   HE21  GLN  26          1HE2      GLN  26   1.148  -3.019 -12.625
  207   HE22  GLN  26          2HE2      GLN  26   0.777  -4.368 -13.638
  208    H    TRP  27           HN       TRP  27  -1.394   1.062 -10.931
  209    HA   TRP  27           HA       TRP  27  -0.786   0.225  -8.326
  210    HB2  TRP  27           2HB      TRP  27  -2.476   2.434  -9.463
  211    HB3  TRP  27           1HB      TRP  27  -2.461   2.148  -7.729
  212    HD1  TRP  27           1HD      TRP  27   0.215   2.750 -10.515
  213    HE1  TRP  27           1HE      TRP  27   2.045   4.255  -9.491
  214    HE3  TRP  27           3HE      TRP  27  -1.624   3.156  -5.759
  215    HZ2  TRP  27           2HZ      TRP  27   2.625   5.442  -7.001
  216    HZ3  TRP  27           3HZ      TRP  27  -0.373   4.495  -4.118
  217    HH2  TRP  27           2HH      TRP  27   1.710   5.613  -4.728
  218    H    THR  28           HN       THR  28  -3.944   0.492  -9.932
  219    HA   THR  28           HA       THR  28  -5.460  -0.521  -7.784
  220    HB   THR  28           HB       THR  28  -6.178  -0.677 -10.718
  221    HG1  THR  28           1HG      THR  28  -5.626   1.464 -10.256
  222   HG21  THR  28          3HG2      THR  28  -7.883  -0.456  -8.235
  223   HG22  THR  28          1HG2      THR  28  -7.690  -1.895  -9.236
  224   HG23  THR  28          2HG2      THR  28  -8.479  -0.462  -9.893
  225    H    ASN  29           HN       ASN  29  -4.092  -2.007 -10.662
  226    HA   ASN  29           HA       ASN  29  -5.277  -4.522 -10.490
  227    HB2  ASN  29           2HB      ASN  29  -3.967  -3.440 -12.408
  228    HB3  ASN  29           1HB      ASN  29  -2.516  -3.993 -11.584
  229   HD21  ASN  29          1HD2      ASN  29  -3.713  -4.654 -14.198
  230   HD22  ASN  29          2HD2      ASN  29  -3.842  -6.376 -14.213
  231    H    THR  30           HN       THR  30  -2.169  -3.384  -9.182
  232    HA   THR  30           HA       THR  30  -1.420  -5.947  -8.193
  233    HB   THR  30           HB       THR  30   0.299  -4.630  -6.865
  234    HG1  THR  30           1HG      THR  30  -0.611  -2.447  -8.461
  235   HG21  THR  30          3HG2      THR  30   0.794  -5.625  -9.050
  236   HG22  THR  30          1HG2      THR  30   1.632  -4.086  -8.844
  237   HG23  THR  30          2HG2      THR  30   0.185  -4.176  -9.848
  238    H    ILE  31           HN       ILE  31  -2.752  -3.036  -6.637
  239    HA   ILE  31           HA       ILE  31  -2.756  -4.091  -4.023
  240    HB   ILE  31           HB       ILE  31  -4.471  -1.912  -5.221
  241   HG12  ILE  31          2HG1      ILE  31  -1.979  -1.774  -3.505
  242   HG13  ILE  31          1HG1      ILE  31  -2.027  -1.506  -5.246
  243   HG21  ILE  31          1HG2      ILE  31  -5.556  -2.797  -3.239
  244   HG22  ILE  31          2HG2      ILE  31  -4.883  -1.204  -2.894
  245   HG23  ILE  31          3HG2      ILE  31  -4.057  -2.653  -2.324
  246   HD11  ILE  31          3HD1      ILE  31  -1.944   0.590  -4.031
  247   HD12  ILE  31          1HD1      ILE  31  -3.419   0.161  -3.162
  248   HD13  ILE  31          2HD1      ILE  31  -3.467   0.431  -4.905
  249    H    LYS  32           HN       LYS  32  -5.212  -4.085  -6.561
  250    HA   LYS  32           HA       LYS  32  -7.346  -5.157  -5.104
  251    HB2  LYS  32           2HB      LYS  32  -7.420  -4.189  -7.434
  252    HB3  LYS  32           1HB      LYS  32  -6.717  -5.686  -8.017
  253    HG2  LYS  32           2HG      LYS  32  -9.247  -5.777  -6.440
  254    HG3  LYS  32           1HG      LYS  32  -9.290  -5.287  -8.132
  255    HD2  LYS  32           2HD      LYS  32  -8.129  -7.870  -7.091
  256    HD3  LYS  32           1HD      LYS  32  -9.721  -7.693  -7.830
  257    HE2  LYS  32           2HE      LYS  32  -8.611  -6.874  -9.895
  258    HE3  LYS  32           1HE      LYS  32  -7.049  -7.198  -9.146
  259    HZ1  LYS  32           3HZ      LYS  32  -7.737  -9.016 -10.587
  260    HZ2  LYS  32           1HZ      LYS  32  -9.160  -9.221  -9.687
  261    HZ3  LYS  32           2HZ      LYS  32  -7.653  -9.533  -8.974
  262    H    THR  33           HN       THR  33  -4.596  -6.684  -6.645
  263    HA   THR  33           HA       THR  33  -5.668  -9.344  -6.336
  264    HB   THR  33           HB       THR  33  -2.866  -8.532  -7.125
  265    HG1  THR  33           1HG      THR  33  -4.097  -7.633  -8.687
  266   HG21  THR  33          3HG2      THR  33  -2.824 -10.721  -8.238
  267   HG22  THR  33          1HG2      THR  33  -4.442 -11.064  -7.622
  268   HG23  THR  33          2HG2      THR  33  -3.090 -10.887  -6.503
  269    H    TYR  34           HN       TYR  34  -2.905  -7.544  -4.939
  270    HA   TYR  34           HA       TYR  34  -2.280  -9.742  -3.192
  271    HB2  TYR  34           2HB      TYR  34  -1.120  -6.964  -3.377
  272    HB3  TYR  34           1HB      TYR  34  -0.509  -8.227  -2.313
  273    HD1  TYR  34           1HD      TYR  34  -0.193 -10.582  -3.720
  274    HD2  TYR  34           2HD      TYR  34   0.141  -6.635  -5.280
  275    HE1  TYR  34           1HE      TYR  34   1.250 -11.423  -5.527
  276    HE2  TYR  34           2HE      TYR  34   1.578  -7.469  -7.094
  277    HH   TYR  34           HH       TYR  34   1.863 -10.704  -7.886
  278    H    CYS  35           HN       CYS  35  -3.577  -6.463  -2.697
  279    HA   CYS  35           HA       CYS  35  -3.687  -6.980   0.172
  280    HB2  CYS  35           2HB      CYS  35  -4.241  -4.438  -1.362
  281    HB3  CYS  35           1HB      CYS  35  -4.114  -4.584   0.390
  282    HG   CYS  35           HG       CYS  35  -1.363  -5.559   0.084
  283    H    GLY  36           HN       GLY  36  -5.766  -6.788  -2.558
  284    HA2  GLY  36           2HA      GLY  36  -8.167  -5.893  -1.557
  285    HA3  GLY  36           1HA      GLY  36  -8.022  -7.107  -2.814
  286    HA   PRO  37           HA       PRO  37  -9.688 -10.279  -0.319
  287    HB2  PRO  37           2HB      PRO  37  -7.257 -11.951  -0.329
  288    HB3  PRO  37           1HB      PRO  37  -8.857 -12.285  -0.999
  289    HG2  PRO  37           2HG      PRO  37  -6.781 -11.748  -2.593
  290    HG3  PRO  37           1HG      PRO  37  -8.411 -11.164  -2.975
  291    HD2  PRO  37           2HD      PRO  37  -6.105  -9.678  -1.772
  292    HD3  PRO  37           1HD      PRO  37  -7.252  -9.153  -3.023
  293    H    VAL  38           HN       VAL  38  -6.990  -8.680   0.910
  294    HA   VAL  38           HA       VAL  38  -7.154 -10.135   3.465
  295    HB   VAL  38           HB       VAL  38  -4.891  -8.366   2.532
  296   HG11  VAL  38          1HG1      VAL  38  -5.130 -10.231   4.890
  297   HG12  VAL  38          2HG1      VAL  38  -5.087  -8.469   4.949
  298   HG13  VAL  38          3HG1      VAL  38  -3.669  -9.369   4.414
  299   HG21  VAL  38          3HG2      VAL  38  -5.073 -11.378   2.582
  300   HG22  VAL  38          1HG2      VAL  38  -3.624 -10.443   2.207
  301   HG23  VAL  38          2HG2      VAL  38  -5.029 -10.363   1.142
  302    H    ILE  39           HN       ILE  39  -6.358  -6.812   2.369
  303    HA   ILE  39           HA       ILE  39  -7.691  -5.847   4.815
  304    HB   ILE  39           HB       ILE  39  -6.195  -3.877   4.709
  305   HG12  ILE  39          2HG1      ILE  39  -4.774  -5.463   2.557
  306   HG13  ILE  39          1HG1      ILE  39  -5.665  -3.965   2.311
  307   HG21  ILE  39          1HG2      ILE  39  -5.674  -5.727   6.181
  308   HG22  ILE  39          2HG2      ILE  39  -4.190  -5.034   5.528
  309   HG23  ILE  39          3HG2      ILE  39  -4.815  -6.550   4.880
  310   HD11  ILE  39          3HD1      ILE  39  -3.249  -3.614   2.368
  311   HD12  ILE  39          1HD1      ILE  39  -3.196  -4.262   4.006
  312   HD13  ILE  39          2HD1      ILE  39  -4.067  -2.762   3.680
  313    H    GLY  40           HN       GLY  40  -8.246  -6.086   1.647
  314    HA2  GLY  40           2HA      GLY  40  -8.800  -3.559   0.646
  315    HA3  GLY  40           1HA      GLY  40  -9.642  -5.024   0.177
  316    HA   PRO  41           HA       PRO  41 -13.305  -3.618   2.146
  317    HB2  PRO  41           2HB      PRO  41 -14.307  -5.709   3.514
  318    HB3  PRO  41           1HB      PRO  41 -14.196  -5.706   1.749
  319    HG2  PRO  41           2HG      PRO  41 -12.385  -6.984   3.762
  320    HG3  PRO  41           1HG      PRO  41 -12.998  -7.642   2.234
  321    HD2  PRO  41           2HD      PRO  41 -10.506  -6.578   2.523
  322    HD3  PRO  41           1HD      PRO  41 -11.402  -6.567   0.991
  323    H    LEU  42           HN       LEU  42 -10.683  -4.097   4.095
  324    HA   LEU  42           HA       LEU  42 -11.993  -3.644   6.638
  325    HB2  LEU  42           2HB      LEU  42  -9.069  -3.501   5.880
  326    HB3  LEU  42           1HB      LEU  42  -9.694  -3.400   7.514
  327    HG   LEU  42           HG       LEU  42  -9.858  -5.808   5.698
  328   HD11  LEU  42          1HD1      LEU  42  -8.265  -5.318   8.209
  329   HD12  LEU  42          2HD1      LEU  42  -7.617  -5.380   6.569
  330   HD13  LEU  42          3HD1      LEU  42  -8.325  -6.823   7.291
  331   HD21  LEU  42          3HD2      LEU  42 -10.745  -6.970   7.666
  332   HD22  LEU  42          1HD2      LEU  42 -11.817  -5.673   7.132
  333   HD23  LEU  42          2HD2      LEU  42 -10.787  -5.440   8.543
  334    H    SER  43           HN       SER  43 -11.408  -1.672   7.946
  335    HA   SER  43           HA       SER  43 -11.895   0.687   6.418
  336    HB2  SER  43           2HB      SER  43 -12.690   0.494   8.740
  337    HB3  SER  43           1HB      SER  43 -11.030   0.418   9.310
  338    HG   SER  43           HG       SER  43 -12.475   2.599   8.288
  339    H    VAL  44           HN       VAL  44 -10.526   2.482   6.139
  340    HA   VAL  44           HA       VAL  44  -7.879   1.817   5.406
  341    HB   VAL  44           HB       VAL  44  -9.239   3.588   4.315
  342   HG11  VAL  44          1HG1      VAL  44  -9.320   5.827   5.332
  343   HG12  VAL  44          2HG1      VAL  44  -8.657   5.149   6.820
  344   HG13  VAL  44          3HG1      VAL  44 -10.239   4.627   6.242
  345   HG21  VAL  44          3HG2      VAL  44  -6.568   4.487   5.380
  346   HG22  VAL  44          1HG2      VAL  44  -7.396   5.176   3.983
  347   HG23  VAL  44          2HG2      VAL  44  -6.844   3.501   3.944
  348    H    GLN  45           HN       GLN  45  -9.274   2.861   8.391
  349    HA   GLN  45           HA       GLN  45  -6.613   3.426   9.441
  350    HB2  GLN  45           2HB      GLN  45  -7.909   4.160  11.471
  351    HB3  GLN  45           1HB      GLN  45  -8.052   5.159  10.046
  352    HG2  GLN  45           2HG      GLN  45 -10.227   4.207   9.575
  353    HG3  GLN  45           1HG      GLN  45 -10.067   3.120  10.954
  354   HE21  GLN  45          1HE2      GLN  45  -8.820   5.063  12.661
  355   HE22  GLN  45          2HE2      GLN  45 -10.033   6.202  13.128
  356    H    ASP  46           HN       ASP  46  -8.851   0.918   9.234
  357    HA   ASP  46           HA       ASP  46  -7.906  -0.360  11.677
  358    HB2  ASP  46           2HB      ASP  46 -10.037  -1.027   9.683
  359    HB3  ASP  46           1HB      ASP  46  -9.398  -2.281  10.737
  360    H    VAL  47           HN       VAL  47  -6.671   0.078   8.717
  361    HA   VAL  47           HA       VAL  47  -5.563  -2.505   8.233
  362    HB   VAL  47           HB       VAL  47  -4.510   0.209   7.386
  363   HG11  VAL  47          1HG1      VAL  47  -3.314  -1.057   5.640
  364   HG12  VAL  47          2HG1      VAL  47  -3.881  -2.562   6.363
  365   HG13  VAL  47          3HG1      VAL  47  -2.787  -1.511   7.263
  366   HG21  VAL  47          3HG2      VAL  47  -6.245  -1.759   5.897
  367   HG22  VAL  47          1HG2      VAL  47  -5.578  -0.265   5.240
  368   HG23  VAL  47          2HG2      VAL  47  -6.766  -0.202   6.544
  369    H    ASP  48           HN       ASP  48  -4.420  -3.429   9.822
  370    HA   ASP  48           HA       ASP  48  -2.873  -1.777  11.633
  371    HB2  ASP  48           2HB      ASP  48  -3.562  -4.709  11.671
  372    HB3  ASP  48           1HB      ASP  48  -2.451  -3.976  12.819
  373    H    THR  49           HN       THR  49  -0.772  -2.560  12.337
  374    HA   THR  49           HA       THR  49   1.043  -2.610  10.172
  375    HB   THR  49           HB       THR  49   1.591  -3.224  13.087
  376    HG1  THR  49           1HG      THR  49   2.166  -0.693  12.417
  377   HG21  THR  49          3HG2      THR  49   3.808  -2.306  12.607
  378   HG22  THR  49          1HG2      THR  49   3.345  -2.069  10.922
  379   HG23  THR  49          2HG2      THR  49   3.456  -3.699  11.584
  380    H    LYS  50           HN       LYS  50  -0.115  -5.029  12.481
  381    HA   LYS  50           HA       LYS  50   1.542  -7.143  11.554
  382    HB2  LYS  50           2HB      LYS  50  -0.076  -6.772  13.718
  383    HB3  LYS  50           1HB      LYS  50  -1.053  -7.871  12.754
  384    HG2  LYS  50           2HG      LYS  50   1.786  -8.367  13.636
  385    HG3  LYS  50           1HG      LYS  50   0.339  -9.048  14.378
  386    HD2  LYS  50           2HD      LYS  50  -0.199 -10.202  12.306
  387    HD3  LYS  50           1HD      LYS  50   1.216  -9.491  11.527
  388    HE2  LYS  50           2HE      LYS  50   1.242 -11.364  13.891
  389    HE3  LYS  50           1HE      LYS  50   1.650 -11.788  12.231
  390    HZ1  LYS  50           3HZ      LYS  50   3.512 -10.263  12.323
  391    HZ2  LYS  50           1HZ      LYS  50   3.622 -11.397  13.577
  392    HZ3  LYS  50           2HZ      LYS  50   3.112  -9.819  13.911
  393    H    LEU  51           HN       LEU  51  -1.603  -5.917  10.604
  394    HA   LEU  51           HA       LEU  51  -2.407  -8.146   9.072
  395    HB2  LEU  51           2HB      LEU  51  -3.194  -5.245   8.997
  396    HB3  LEU  51           1HB      LEU  51  -3.910  -6.442   7.942
  397    HG   LEU  51           HG       LEU  51  -4.059  -6.378  10.949
  398   HD11  LEU  51          1HD1      LEU  51  -6.470  -6.113  10.548
  399   HD12  LEU  51          2HD1      LEU  51  -6.153  -6.014   8.816
  400   HD13  LEU  51          3HD1      LEU  51  -5.528  -4.775   9.899
  401   HD21  LEU  51          3HD2      LEU  51  -3.877  -8.679  10.183
  402   HD22  LEU  51          1HD2      LEU  51  -5.174  -8.410   9.020
  403   HD23  LEU  51          2HD2      LEU  51  -5.512  -8.341  10.749
  404    H    ILE  52           HN       ILE  52  -0.581  -5.224   8.268
  405    HA   ILE  52           HA       ILE  52  -0.373  -5.787   5.495
  406    HB   ILE  52           HB       ILE  52   1.595  -4.189   7.142
  407   HG12  ILE  52          2HG1      ILE  52  -0.904  -3.237   5.721
  408   HG13  ILE  52          1HG1      ILE  52  -0.750  -3.428   7.465
  409   HG21  ILE  52          1HG2      ILE  52   2.023  -3.030   5.019
  410   HG22  ILE  52          2HG2      ILE  52   0.882  -4.102   4.208
  411   HG23  ILE  52          3HG2      ILE  52   2.370  -4.755   4.893
  412   HD11  ILE  52          3HD1      ILE  52  -0.505  -1.108   6.827
  413   HD12  ILE  52          1HD1      ILE  52   0.821  -1.526   5.741
  414   HD13  ILE  52          2HD1      ILE  52   1.012  -1.726   7.482
  415    H    MET  53           HN       MET  53   1.536  -6.695   8.309
  416    HA   MET  53           HA       MET  53   3.744  -7.878   7.090
  417    HB2  MET  53           2HB      MET  53   2.248  -8.761   9.566
  418    HB3  MET  53           1HB      MET  53   3.807  -9.399   9.078
  419    HG2  MET  53           2HG      MET  53   4.806  -7.203   9.343
  420    HG3  MET  53           1HG      MET  53   3.237  -6.532   9.788
  421    HE1  MET  53           3HE      MET  53   4.363  -5.536  12.034
  422    HE2  MET  53           1HE      MET  53   5.903  -6.235  11.539
  423    HE3  MET  53           2HE      MET  53   5.284  -6.526  13.168
  424    H    LYS  54           HN       LYS  54   0.525  -9.181   7.690
  425    HA   LYS  54           HA       LYS  54   0.908 -11.837   6.961
  426    HB2  LYS  54           2HB      LYS  54  -1.499 -10.048   6.625
  427    HB3  LYS  54           1HB      LYS  54  -1.533 -11.784   6.356
  428    HG2  LYS  54           2HG      LYS  54  -1.138 -12.245   8.633
  429    HG3  LYS  54           1HG      LYS  54  -0.690 -10.571   8.970
  430    HD2  LYS  54           2HD      LYS  54  -2.959 -11.126   9.771
  431    HD3  LYS  54           1HD      LYS  54  -2.960  -9.841   8.565
  432    HE2  LYS  54           2HE      LYS  54  -4.760 -11.308   8.044
  433    HE3  LYS  54           1HE      LYS  54  -3.499 -11.578   6.843
  434    HZ1  LYS  54           3HZ      LYS  54  -2.828 -13.564   8.007
  435    HZ2  LYS  54           1HZ      LYS  54  -4.488 -13.643   7.676
  436    HZ3  LYS  54           2HZ      LYS  54  -3.952 -13.272   9.237
  437    H    VAL  55           HN       VAL  55   0.322  -8.998   4.974
  438    HA   VAL  55           HA       VAL  55  -0.028 -10.497   2.550
  439    HB   VAL  55           HB       VAL  55   0.512  -7.538   2.857
  440   HG11  VAL  55          1HG1      VAL  55  -0.577  -7.344   0.671
  441   HG12  VAL  55          2HG1      VAL  55  -0.720  -9.100   0.593
  442   HG13  VAL  55          3HG1      VAL  55   0.874  -8.344   0.597
  443   HG21  VAL  55          3HG2      VAL  55  -1.920  -7.241   2.720
  444   HG22  VAL  55          1HG2      VAL  55  -1.443  -8.151   4.154
  445   HG23  VAL  55          2HG2      VAL  55  -2.126  -8.992   2.763
  446    H    LEU  56           HN       LEU  56   2.553  -8.518   3.971
  447    HA   LEU  56           HA       LEU  56   4.156  -8.606   1.619
  448    HB2  LEU  56           2HB      LEU  56   4.779  -7.739   4.431
  449    HB3  LEU  56           1HB      LEU  56   5.899  -7.580   3.094
  450    HG   LEU  56           HG       LEU  56   3.234  -6.197   3.398
  451   HD11  LEU  56          1HD1      LEU  56   4.597  -4.167   3.380
  452   HD12  LEU  56          2HD1      LEU  56   6.059  -5.147   3.280
  453   HD13  LEU  56          3HD1      LEU  56   5.040  -5.229   4.715
  454   HD21  LEU  56          3HD2      LEU  56   3.731  -5.105   1.270
  455   HD22  LEU  56          1HD2      LEU  56   3.575  -6.852   1.070
  456   HD23  LEU  56          2HD2      LEU  56   5.173  -6.105   1.090
  457    H    ASP  57           HN       ASP  57   4.123 -10.505   4.589
  458    HA   ASP  57           HA       ASP  57   6.716 -11.464   4.607
  459    HB2  ASP  57           2HB      ASP  57   4.951 -11.866   6.365
  460    HB3  ASP  57           1HB      ASP  57   4.342 -13.156   5.353
  461    HA   PRO  58           HA       PRO  58   5.497 -15.254   1.889
  462    HB2  PRO  58           2HB      PRO  58   3.198 -15.066   0.424
  463    HB3  PRO  58           1HB      PRO  58   3.283 -15.817   2.020
  464    HG2  PRO  58           2HG      PRO  58   2.337 -13.091   1.251
  465    HG3  PRO  58           1HG      PRO  58   1.678 -14.212   2.457
  466    HD2  PRO  58           2HD      PRO  58   3.232 -12.078   3.110
  467    HD3  PRO  58           1HD      PRO  58   3.194 -13.566   4.068
  468    H    ILE  59           HN       ILE  59   4.826 -11.979   0.886
  469    HA   ILE  59           HA       ILE  59   5.335 -12.426  -1.896
  470    HB   ILE  59           HB       ILE  59   5.355  -9.814  -0.368
  471   HG12  ILE  59          2HG1      ILE  59   3.181 -11.151  -1.996
  472   HG13  ILE  59          1HG1      ILE  59   3.187 -10.949  -0.248
  473   HG21  ILE  59          1HG2      ILE  59   6.570  -9.631  -2.466
  474   HG22  ILE  59          2HG2      ILE  59   5.031  -8.777  -2.578
  475   HG23  ILE  59          3HG2      ILE  59   5.217 -10.359  -3.335
  476   HD11  ILE  59          3HD1      ILE  59   1.734  -9.327  -1.323
  477   HD12  ILE  59          1HD1      ILE  59   3.092  -8.726  -2.276
  478   HD13  ILE  59          2HD1      ILE  59   3.089  -8.529  -0.524
  479    H    TRP  60           HN       TRP  60   7.305 -11.758   0.900
  480    HA   TRP  60           HA       TRP  60   9.609 -10.772  -0.362
  481    HB2  TRP  60           2HB      TRP  60   9.307 -12.436   2.139
  482    HB3  TRP  60           1HB      TRP  60  10.847 -11.780   1.603
  483    HD1  TRP  60           1HD      TRP  60   8.064 -10.985   3.810
  484    HE1  TRP  60           1HE      TRP  60   8.077  -8.505   4.484
  485    HE3  TRP  60           3HE      TRP  60  11.383  -9.232   0.338
  486    HZ2  TRP  60           2HZ      TRP  60   9.333  -6.113   3.641
  487    HZ3  TRP  60           3HZ      TRP  60  11.937  -6.836   0.341
  488    HH2  TRP  60           2HH      TRP  60  10.932  -5.311   1.959
  489    H    GLU  61           HN       GLU  61   8.307 -13.987  -0.226
  490    HA   GLU  61           HA       GLU  61  10.713 -15.275  -1.084
  491    HB2  GLU  61           2HB      GLU  61   7.847 -16.190  -0.858
  492    HB3  GLU  61           1HB      GLU  61   9.181 -17.227  -1.301
  493    HG2  GLU  61           2HG      GLU  61   8.840 -15.792   1.313
  494    HG3  GLU  61           1HG      GLU  61   8.636 -17.520   1.028
  495    H    GLN  62           HN       GLN  62   7.856 -13.908  -2.533
  496    HA   GLN  62           HA       GLN  62   8.387 -15.142  -5.109
  497    HB2  GLN  62           2HB      GLN  62   6.184 -13.321  -4.143
  498    HB3  GLN  62           1HB      GLN  62   6.300 -13.935  -5.784
  499    HG2  GLN  62           2HG      GLN  62   6.085 -15.664  -3.335
  500    HG3  GLN  62           1HG      GLN  62   4.723 -15.182  -4.344
  501   HE21  GLN  62          1HE2      GLN  62   4.219 -17.277  -4.901
  502   HE22  GLN  62          2HE2      GLN  62   5.197 -18.215  -5.988
  503    H    LYS  63           HN       LYS  63   7.909 -11.842  -3.870
  504    HA   LYS  63           HA       LYS  63   9.765 -10.825  -5.890
  505    HB2  LYS  63           2HB      LYS  63   6.953  -9.800  -5.473
  506    HB3  LYS  63           1HB      LYS  63   8.179  -8.981  -6.427
  507    HG2  LYS  63           2HG      LYS  63   8.230 -10.804  -8.004
  508    HG3  LYS  63           1HG      LYS  63   7.096 -11.726  -7.013
  509    HD2  LYS  63           2HD      LYS  63   5.370 -10.084  -7.382
  510    HD3  LYS  63           1HD      LYS  63   6.497  -9.037  -8.243
  511    HE2  LYS  63           2HE      LYS  63   5.626 -11.787  -9.121
  512    HE3  LYS  63           1HE      LYS  63   5.025 -10.263  -9.773
  513    HZ1  LYS  63           3HZ      LYS  63   7.415  -9.770 -10.345
  514    HZ2  LYS  63           1HZ      LYS  63   6.673 -10.997 -11.251
  515    HZ3  LYS  63           2HZ      LYS  63   7.755 -11.394 -10.004
  516    HA   PRO  64           HA       PRO  64  10.572  -9.011  -1.704
  517    HB2  PRO  64           2HB      PRO  64  13.221  -8.677  -2.981
  518    HB3  PRO  64           1HB      PRO  64  12.817  -9.337  -1.394
  519    HG2  PRO  64           2HG      PRO  64  13.593 -10.921  -3.408
  520    HG3  PRO  64           1HG      PRO  64  12.367 -11.443  -2.237
  521    HD2  PRO  64           2HD      PRO  64  12.029 -10.495  -5.048
  522    HD3  PRO  64           1HD      PRO  64  11.138 -11.748  -4.162
  523    H    GLU  65           HN       GLU  65  11.584  -7.894  -4.892
  524    HA   GLU  65           HA       GLU  65  11.967  -5.187  -4.247
  525    HB2  GLU  65           2HB      GLU  65  10.930  -5.417  -6.906
  526    HB3  GLU  65           1HB      GLU  65  12.564  -5.077  -6.387
  527    HG2  GLU  65           2HG      GLU  65  12.643  -6.925  -7.854
  528    HG3  GLU  65           1HG      GLU  65  12.970  -7.516  -6.229
  529    H    THR  66           HN       THR  66   9.183  -6.961  -5.437
  530    HA   THR  66           HA       THR  66   7.507  -4.669  -5.653
  531    HB   THR  66           HB       THR  66   6.721  -7.587  -5.534
  532    HG1  THR  66           1HG      THR  66   8.196  -7.110  -7.253
  533   HG21  THR  66          3HG2      THR  66   4.832  -6.060  -5.170
  534   HG22  THR  66          1HG2      THR  66   4.712  -6.867  -6.733
  535   HG23  THR  66          2HG2      THR  66   5.253  -5.192  -6.647
  536    H    ALA  67           HN       ALA  67   8.069  -7.076  -3.155
  537    HA   ALA  67           HA       ALA  67   5.933  -6.454  -1.450
  538    HB1  ALA  67           1HB      ALA  67   7.245  -7.481   0.317
  539    HB2  ALA  67           2HB      ALA  67   8.699  -7.374  -0.675
  540    HB3  ALA  67           3HB      ALA  67   7.372  -8.428  -1.166
  541    H    SER  68           HN       SER  68   9.196  -5.081  -1.650
  542    HA   SER  68           HA       SER  68   8.812  -3.298   0.533
  543    HB2  SER  68           2HB      SER  68  10.901  -2.183  -0.602
  544    HB3  SER  68           1HB      SER  68  11.053  -3.754   0.183
  545    HG   SER  68           HG       SER  68  11.112  -4.743  -1.767
  546    H    ARG  69           HN       ARG  69   8.375  -3.054  -2.951
  547    HA   ARG  69           HA       ARG  69   7.948  -0.248  -2.984
  548    HB2  ARG  69           2HB      ARG  69   7.199  -2.414  -4.947
  549    HB3  ARG  69           1HB      ARG  69   7.001  -0.702  -5.250
  550    HG2  ARG  69           2HG      ARG  69   9.481  -0.470  -4.831
  551    HG3  ARG  69           1HG      ARG  69   9.543  -2.231  -4.898
  552    HD2  ARG  69           2HD      ARG  69  10.070  -1.494  -7.072
  553    HD3  ARG  69           1HD      ARG  69   8.399  -2.051  -7.150
  554    HE   ARG  69           HE       ARG  69   9.029   0.811  -6.805
  555   HH11  ARG  69          1HH1      ARG  69   7.468  -1.777  -8.575
  556   HH12  ARG  69          2HH1      ARG  69   6.664  -0.711  -9.683
  557   HH21  ARG  69          1HH2      ARG  69   7.962   2.221  -8.259
  558   HH22  ARG  69          2HH2      ARG  69   6.943   1.563  -9.506
  559    H    LEU  70           HN       LEU  70   5.858  -3.052  -2.619
  560    HA   LEU  70           HA       LEU  70   3.374  -1.764  -2.887
  561    HB2  LEU  70           2HB      LEU  70   3.699  -4.220  -2.842
  562    HB3  LEU  70           1HB      LEU  70   4.078  -4.121  -1.134
  563    HG   LEU  70           HG       LEU  70   1.787  -3.267  -0.703
  564   HD11  LEU  70          1HD1      LEU  70   1.372  -3.873  -3.629
  565   HD12  LEU  70          2HD1      LEU  70   1.335  -2.279  -2.874
  566   HD13  LEU  70          3HD1      LEU  70   0.100  -3.474  -2.472
  567   HD21  LEU  70          3HD2      LEU  70   2.292  -5.636  -0.453
  568   HD22  LEU  70          1HD2      LEU  70   1.922  -5.904  -2.157
  569   HD23  LEU  70          2HD2      LEU  70   0.647  -5.400  -1.047
  570    H    ARG  71           HN       ARG  71   5.507  -2.221  -0.124
  571    HA   ARG  71           HA       ARG  71   3.910  -1.227   1.926
  572    HB2  ARG  71           2HB      ARG  71   6.124  -2.322   2.230
  573    HB3  ARG  71           1HB      ARG  71   6.898  -0.876   1.599
  574    HG2  ARG  71           2HG      ARG  71   5.753   0.372   3.491
  575    HG3  ARG  71           1HG      ARG  71   5.407  -1.218   4.172
  576    HD2  ARG  71           2HD      ARG  71   8.131  -0.098   3.527
  577    HD3  ARG  71           1HD      ARG  71   7.436  -0.282   5.135
  578    HE   ARG  71           HE       ARG  71   7.478  -2.777   3.819
  579   HH11  ARG  71          1HH1      ARG  71   9.635  -0.452   5.306
  580   HH12  ARG  71          2HH1      ARG  71  10.823  -1.640   5.737
  581   HH21  ARG  71          1HH2      ARG  71   9.061  -4.342   4.390
  582   HH22  ARG  71          2HH2      ARG  71  10.495  -3.842   5.241
  583    H    GLY  72           HN       GLY  72   6.071   0.490  -0.297
  584    HA2  GLY  72           2HA      GLY  72   5.796   3.039   0.887
  585    HA3  GLY  72           1HA      GLY  72   6.387   2.713  -0.732
  586    H    ARG  73           HN       ARG  73   4.030   1.480  -1.781
  587    HA   ARG  73           HA       ARG  73   2.637   3.882  -2.429
  588    HB2  ARG  73           2HB      ARG  73   1.305   2.572  -3.955
  589    HB3  ARG  73           1HB      ARG  73   2.995   2.131  -4.112
  590    HG2  ARG  73           2HG      ARG  73   2.534   0.128  -2.706
  591    HG3  ARG  73           1HG      ARG  73   0.820   0.552  -2.761
  592    HD2  ARG  73           2HD      ARG  73   1.305  -1.087  -4.480
  593    HD3  ARG  73           1HD      ARG  73   0.899   0.459  -5.221
  594    HE   ARG  73           HE       ARG  73   3.606   0.541  -5.039
  595   HH11  ARG  73          1HH1      ARG  73   1.360  -1.764  -6.436
  596   HH12  ARG  73          2HH1      ARG  73   2.474  -2.284  -7.657
  597   HH21  ARG  73          1HH2      ARG  73   5.051  -0.124  -6.641
  598   HH22  ARG  73          2HH2      ARG  73   4.571  -1.349  -7.790
  599    H    ILE  74           HN       ILE  74   1.951   1.140  -0.329
  600    HA   ILE  74           HA       ILE  74  -0.713   1.851   0.302
  601    HB   ILE  74           HB       ILE  74   1.340   0.394   1.981
  602   HG12  ILE  74          2HG1      ILE  74  -0.976  -0.634   0.322
  603   HG13  ILE  74          1HG1      ILE  74   0.720  -0.713  -0.143
  604   HG21  ILE  74          1HG2      ILE  74  -1.639   0.652   2.399
  605   HG22  ILE  74          2HG2      ILE  74  -0.379   1.365   3.407
  606   HG23  ILE  74          3HG2      ILE  74  -0.557  -0.389   3.325
  607   HD11  ILE  74          3HD1      ILE  74   1.171  -2.160   1.779
  608   HD12  ILE  74          1HD1      ILE  74  -0.047  -2.845   0.702
  609   HD13  ILE  74          2HD1      ILE  74  -0.537  -2.091   2.217
  610    H    GLU  75           HN       GLU  75   2.395   2.699   1.790
  611    HA   GLU  75           HA       GLU  75   1.552   4.363   3.852
  612    HB2  GLU  75           2HB      GLU  75   3.910   3.694   3.384
  613    HB3  GLU  75           1HB      GLU  75   3.926   4.812   2.028
  614    HG2  GLU  75           2HG      GLU  75   3.335   6.619   3.696
  615    HG3  GLU  75           1HG      GLU  75   3.717   5.443   4.951
  616    H    SER  76           HN       SER  76   2.061   5.093   0.438
  617    HA   SER  76           HA       SER  76   1.628   7.849   0.559
  618    HB2  SER  76           2HB      SER  76   1.076   5.962  -1.723
  619    HB3  SER  76           1HB      SER  76   1.222   7.712  -1.859
  620    HG   SER  76           HG       SER  76   3.244   5.878  -1.044
  621    H    VAL  77           HN       VAL  77  -0.656   5.185   0.113
  622    HA   VAL  77           HA       VAL  77  -2.923   6.856  -0.329
  623    HB   VAL  77           HB       VAL  77  -2.835   3.977   0.594
  624   HG11  VAL  77          1HG1      VAL  77  -4.988   5.040   1.060
  625   HG12  VAL  77          2HG1      VAL  77  -5.138   3.854  -0.235
  626   HG13  VAL  77          3HG1      VAL  77  -5.094   5.575  -0.618
  627   HG21  VAL  77          3HG2      VAL  77  -1.712   4.297  -1.546
  628   HG22  VAL  77          1HG2      VAL  77  -3.128   5.138  -2.174
  629   HG23  VAL  77          2HG2      VAL  77  -3.233   3.428  -1.758
  630    H    LEU  78           HN       LEU  78  -1.745   5.057   2.511
  631    HA   LEU  78           HA       LEU  78  -3.807   5.796   4.263
  632    HB2  LEU  78           2HB      LEU  78  -0.923   5.171   4.899
  633    HB3  LEU  78           1HB      LEU  78  -2.222   5.240   6.074
  634    HG   LEU  78           HG       LEU  78  -1.983   3.258   3.812
  635   HD11  LEU  78          1HD1      LEU  78  -1.702   2.933   6.794
  636   HD12  LEU  78          2HD1      LEU  78  -0.413   2.809   5.599
  637   HD13  LEU  78          3HD1      LEU  78  -1.713   1.618   5.619
  638   HD21  LEU  78          3HD2      LEU  78  -3.935   2.178   4.810
  639   HD22  LEU  78          1HD2      LEU  78  -4.312   3.808   4.249
  640   HD23  LEU  78          2HD2      LEU  78  -4.073   3.499   5.970
  641    H    ASP  79           HN       ASP  79  -0.714   7.342   3.548
  642    HA   ASP  79           HA       ASP  79  -0.886   9.419   5.447
  643    HB2  ASP  79           2HB      ASP  79   1.224   8.932   4.422
  644    HB3  ASP  79           1HB      ASP  79   0.570   9.198   2.811
  645    H    TRP  80           HN       TRP  80  -1.891   9.220   2.066
  646    HA   TRP  80           HA       TRP  80  -2.792  11.845   1.730
  647    HB2  TRP  80           2HB      TRP  80  -2.503  10.393  -0.165
  648    HB3  TRP  80           1HB      TRP  80  -3.678   9.249   0.466
  649    HD1  TRP  80           1HD      TRP  80  -3.520  12.776  -1.099
  650    HE1  TRP  80           1HE      TRP  80  -5.788  13.254  -2.220
  651    HE3  TRP  80           3HE      TRP  80  -6.071   8.615   0.423
  652    HZ2  TRP  80           2HZ      TRP  80  -8.325  12.023  -2.428
  653    HZ3  TRP  80           3HZ      TRP  80  -8.410   8.342  -0.281
  654    HH2  TRP  80           2HH      TRP  80  -9.514  10.013  -1.677
  655    H    ALA  81           HN       ALA  81  -4.522   8.936   2.793
  656    HA   ALA  81           HA       ALA  81  -7.047  10.136   3.090
  657    HB1  ALA  81           1HB      ALA  81  -6.723   7.716   2.990
  658    HB2  ALA  81           2HB      ALA  81  -7.619   8.185   4.434
  659    HB3  ALA  81           3HB      ALA  81  -5.913   7.758   4.556
  660    H    THR  82           HN       THR  82  -4.314   9.849   5.314
  661    HA   THR  82           HA       THR  82  -5.611  10.826   7.609
  662    HB   THR  82           HB       THR  82  -2.711  10.977   6.782
  663    HG1  THR  82           1HG      THR  82  -3.808   9.354   8.830
  664   HG21  THR  82          3HG2      THR  82  -3.942  11.569   9.481
  665   HG22  THR  82          1HG2      THR  82  -3.173  12.740   8.412
  666   HG23  THR  82          2HG2      THR  82  -2.216  11.454   9.141
  667    H    VAL  83           HN       VAL  83  -3.753  12.519   5.085
  668    HA   VAL  83           HA       VAL  83  -4.053  15.116   6.114
  669    HB   VAL  83           HB       VAL  83  -3.759  14.263   3.226
  670   HG11  VAL  83          1HG1      VAL  83  -2.885  16.525   2.853
  671   HG12  VAL  83          2HG1      VAL  83  -3.260  16.940   4.525
  672   HG13  VAL  83          3HG1      VAL  83  -4.562  16.558   3.400
  673   HG21  VAL  83          3HG2      VAL  83  -1.940  13.439   4.615
  674   HG22  VAL  83          1HG2      VAL  83  -1.690  15.055   5.274
  675   HG23  VAL  83          2HG2      VAL  83  -1.373  14.740   3.568
  676    H    ARG  84           HN       ARG  84  -6.024  13.277   3.816
  677    HA   ARG  84           HA       ARG  84  -7.907  15.343   3.339
  678    HB2  ARG  84           2HB      ARG  84  -8.124  12.351   2.993
  679    HB3  ARG  84           1HB      ARG  84  -9.329  13.499   2.432
  680    HG2  ARG  84           2HG      ARG  84  -6.458  13.429   1.541
  681    HG3  ARG  84           1HG      ARG  84  -7.822  12.762   0.646
  682    HD2  ARG  84           2HD      ARG  84  -7.560  15.657   1.444
  683    HD3  ARG  84           1HD      ARG  84  -7.092  15.015  -0.128
  684    HE   ARG  84           HE       ARG  84  -9.688  14.235   0.158
  685   HH11  ARG  84          1HH1      ARG  84  -8.046  17.324   0.372
  686   HH12  ARG  84          2HH1      ARG  84  -9.391  18.220  -0.285
  687   HH21  ARG  84          1HH2      ARG  84 -11.450  15.401  -0.686
  688   HH22  ARG  84          2HH2      ARG  84 -11.334  17.130  -0.856
  689    H    GLY  85           HN       GLY  85  -7.576  12.974   5.861
  690    HA2  GLY  85           2HA      GLY  85  -8.567  13.283   7.986
  691    HA3  GLY  85           1HA      GLY  85  -9.823  14.255   7.235
  692    H    TYR  86           HN       TYR  86  -8.862  11.121   5.988
  693    HA   TYR  86           HA       TYR  86 -11.538  10.107   6.654
  694    HB2  TYR  86           2HB      TYR  86  -9.490   9.180   4.631
  695    HB3  TYR  86           1HB      TYR  86 -10.981   8.311   4.972
  696    HD1  TYR  86           2HD      TYR  86 -13.175   9.767   4.775
  697    HD2  TYR  86           1HD      TYR  86  -9.478  10.711   2.891
  698    HE1  TYR  86           2HE      TYR  86 -14.370  11.153   3.135
  699    HE2  TYR  86           1HE      TYR  86 -10.664  12.106   1.246
  700    HH   TYR  86           HH       TYR  86 -13.887  13.066   1.641
  701    H    ARG  87           HN       ARG  87  -8.608  10.088   8.025
  702    HA   ARG  87           HA       ARG  87  -9.173   7.814   9.645
  703    HB2  ARG  87           2HB      ARG  87  -7.140   6.535   9.154
  704    HB3  ARG  87           1HB      ARG  87  -8.174   6.640   7.736
  705    HG2  ARG  87           2HG      ARG  87  -6.739   8.485   6.901
  706    HG3  ARG  87           1HG      ARG  87  -5.660   8.205   8.269
  707    HD2  ARG  87           2HD      ARG  87  -6.351   6.241   6.086
  708    HD3  ARG  87           1HD      ARG  87  -4.818   7.088   6.289
  709    HE   ARG  87           HE       ARG  87  -5.725   4.749   7.711
  710   HH11  ARG  87          1HH1      ARG  87  -3.524   7.479   7.719
  711   HH12  ARG  87          2HH1      ARG  87  -2.437   6.744   8.861
  712   HH21  ARG  87          1HH2      ARG  87  -4.254   3.779   9.183
  713   HH22  ARG  87          2HH2      ARG  87  -2.840   4.661   9.670
  714    H    GLU  88           HN       GLU  88  -7.168   7.450  11.161
  715    HA   GLU  88           HA       GLU  88  -6.618  10.017  12.302
  716    HB2  GLU  88           2HB      GLU  88  -6.267   7.194  13.129
  717    HB3  GLU  88           1HB      GLU  88  -5.192   8.375  13.865
  718    HG2  GLU  88           2HG      GLU  88  -7.148   8.004  15.249
  719    HG3  GLU  88           1HG      GLU  88  -7.106   9.658  14.652
  720    H    GLY  89           HN       GLY  89  -4.156   9.964  13.367
  721    HA2  GLY  89           2HA      GLY  89  -2.706  10.688  10.937
  722    HA3  GLY  89           1HA      GLY  89  -2.407  11.292  12.548
  723    H    ASP  90           HN       ASP  90  -2.657   7.881  12.069
  724    HA   ASP  90           HA       ASP  90   0.283   7.701  12.277
  725    HB2  ASP  90           2HB      ASP  90  -0.792   6.871  14.307
  726    HB3  ASP  90           1HB      ASP  90  -1.786   5.773  13.355
  727    H    ASN  91           HN       ASN  91   1.377   6.303  10.930
  728    HA   ASN  91           HA       ASN  91  -0.270   5.044   8.833
  729    HB2  ASN  91           2HB      ASN  91   1.003   7.090   8.076
  730    HB3  ASN  91           1HB      ASN  91   2.487   6.191   8.378
  731   HD21  ASN  91          1HD2      ASN  91   1.370   7.253   5.872
  732   HD22  ASN  91          2HD2      ASN  91   1.255   5.909   4.805
  733    HA   PRO  92           HA       PRO  92   1.868   1.586  10.940
  734    HB2  PRO  92           2HB      PRO  92  -0.167   0.118   9.359
  735    HB3  PRO  92           1HB      PRO  92   0.228   0.003  11.077
  736    HG2  PRO  92           2HG      PRO  92  -1.999   1.216  10.281
  737    HG3  PRO  92           1HG      PRO  92  -1.046   1.859  11.632
  738    HD2  PRO  92           2HD      PRO  92  -1.178   2.797   8.791
  739    HD3  PRO  92           1HD      PRO  92  -1.126   3.747  10.291
  740    H    ALA  93           HN       ALA  93   1.513   2.377   7.625
  741    HA   ALA  93           HA       ALA  93   2.864   0.058   6.585
  742    HB1  ALA  93           1HB      ALA  93   1.312   1.335   5.185
  743    HB2  ALA  93           2HB      ALA  93   2.922   1.268   4.469
  744    HB3  ALA  93           3HB      ALA  93   2.378   2.735   5.280
  745    H    ARG  94           HN       ARG  94   3.844   2.797   8.268
  746    HA   ARG  94           HA       ARG  94   6.584   2.619   7.282
  747    HB2  ARG  94           2HB      ARG  94   5.276   4.462   9.287
  748    HB3  ARG  94           1HB      ARG  94   6.992   4.476   8.918
  749    HG2  ARG  94           2HG      ARG  94   6.489   4.991   6.585
  750    HG3  ARG  94           1HG      ARG  94   4.767   4.993   6.963
  751    HD2  ARG  94           2HD      ARG  94   5.038   6.886   8.417
  752    HD3  ARG  94           1HD      ARG  94   6.792   6.823   8.238
  753    HE   ARG  94           HE       ARG  94   6.142   7.181   5.729
  754   HH11  ARG  94          1HH1      ARG  94   4.628   8.682   8.515
  755   HH12  ARG  94          2HH1      ARG  94   4.238  10.146   7.655
  756   HH21  ARG  94          1HH2      ARG  94   5.614   9.080   4.609
  757   HH22  ARG  94          2HH2      ARG  94   4.797  10.373   5.443
  758    H    TRP  95           HN       TRP  95   8.186   1.671   8.427
  759    HA   TRP  95           HA       TRP  95   7.271   0.121  10.754
  760    HB2  TRP  95           2HB      TRP  95   8.239  -0.762   8.161
  761    HB3  TRP  95           1HB      TRP  95   9.145  -1.468   9.496
  762    HD1  TRP  95           1HD      TRP  95   7.263  -2.387  11.556
  763    HE1  TRP  95           1HE      TRP  95   5.322  -4.010  11.108
  764    HE3  TRP  95           3HE      TRP  95   6.706  -1.626   6.534
  765    HZ2  TRP  95           2HZ      TRP  95   3.750  -4.846   8.926
  766    HZ3  TRP  95           3HZ      TRP  95   4.955  -2.875   5.343
  767    HH2  TRP  95           2HH      TRP  95   3.510  -4.450   6.517
  768    H    ARG  96           HN       ARG  96   8.458   0.308  12.489
  769    HA   ARG  96           HA       ARG  96  11.360   0.664  12.202
  770    HB2  ARG  96           2HB      ARG  96   9.534   1.310  14.521
  771    HB3  ARG  96           1HB      ARG  96  11.282   1.410  14.577
  772    HG2  ARG  96           2HG      ARG  96  11.170   3.074  12.717
  773    HG3  ARG  96           1HG      ARG  96   9.415   3.061  12.907
  774    HD2  ARG  96           2HD      ARG  96   9.719   3.703  15.280
  775    HD3  ARG  96           1HD      ARG  96  11.454   3.831  14.986
  776    HE   ARG  96           HE       ARG  96   9.363   5.626  13.993
  777   HH11  ARG  96          1HH1      ARG  96  12.759   4.745  14.131
  778   HH12  ARG  96          2HH1      ARG  96  13.319   6.316  13.630
  779   HH21  ARG  96          1HH2      ARG  96  10.092   7.685  13.295
  780   HH22  ARG  96          2HH2      ARG  96  11.802   7.992  13.159
  781    H    GLY  97           HN       GLY  97   8.852  -1.457  13.035
  782    HA2  GLY  97           2HA      GLY  97  10.757  -3.216  14.443
  783    HA3  GLY  97           1HA      GLY  97   9.082  -3.060  14.949
  784    H    TYR  98           HN       TYR  98  10.434  -3.364  11.675
  785    HA   TYR  98           HA       TYR  98   8.847  -5.836  11.374
  786    HB2  TYR  98           2HB      TYR  98   8.308  -3.890   9.865
  787    HB3  TYR  98           1HB      TYR  98   9.916  -4.059   9.175
  788    HD1  TYR  98           1HD      TYR  98   7.253  -6.534  10.072
  789    HD2  TYR  98           2HD      TYR  98   9.759  -4.905   7.045
  790    HE1  TYR  98           1HE      TYR  98   6.360  -8.163   8.462
  791    HE2  TYR  98           2HE      TYR  98   8.874  -6.534   5.428
  792    HH   TYR  98           HH       TYR  98   6.123  -8.492   6.122
  793    H    LEU  99           HN       LEU  99   9.869  -7.692  10.873
  794    HA   LEU  99           HA       LEU  99  11.559  -9.179  10.817
  795    HB2  LEU  99           2HB      LEU  99  12.681  -7.201   8.852
  796    HB3  LEU  99           1HB      LEU  99  13.088  -8.887   9.001
  797    HG   LEU  99           HG       LEU  99  10.388  -7.847   8.175
  798   HD11  LEU  99          1HD1      LEU  99  12.067  -7.420   6.475
  799   HD12  LEU  99          2HD1      LEU  99  10.979  -8.707   5.960
  800   HD13  LEU  99          3HD1      LEU  99  12.594  -9.101   6.547
  801   HD21  LEU  99          3HD2      LEU  99  10.242  -9.984   9.327
  802   HD22  LEU  99          1HD2      LEU  99  11.494 -10.653   8.279
  803   HD23  LEU  99          2HD2      LEU  99   9.932 -10.191   7.602
  804    H    GLU 100           HN       GLU 100  11.828  -7.764  12.999
  805    HA   GLU 100           HA       GLU 100  14.262  -6.373  13.320
  806    HB2  GLU 100           2HB      GLU 100  12.594  -7.813  15.397
  807    HB3  GLU 100           1HB      GLU 100  13.889  -6.676  15.743
  808    HG2  GLU 100           2HG      GLU 100  12.638  -4.913  14.582
  809    HG3  GLU 100           1HG      GLU 100  11.329  -6.053  14.289
  810    H    HIS 101           HN       HIS 101  15.965  -7.424  12.527
  811    HA   HIS 101           HA       HIS 101  16.883  -9.853  13.848
  812    HB2  HIS 101           2HB      HIS 101  15.449 -10.491  11.843
  813    HB3  HIS 101           1HB      HIS 101  16.646  -9.697  10.829
  814    HD1  HIS 101           1HD      HIS 101  16.103 -12.724  12.956
  815    HD2  HIS 101           2HD      HIS 101  18.999 -11.158  10.411
  816    HE1  HIS 101           1HE      HIS 101  17.704 -14.613  12.503
  817    HE2  HIS 101           2HE      HIS 101  19.336 -13.698  10.812
  818    H    HIS 102           HN       HIS 102  18.546  -8.590  14.659
  819    HA   HIS 102           HA       HIS 102  20.012  -6.775  13.009
  820    HB2  HIS 102           2HB      HIS 102  20.429  -7.802  15.813
  821    HB3  HIS 102           1HB      HIS 102  21.579  -6.717  15.037
  822    HD1  HIS 102           1HD      HIS 102  21.181  -4.330  15.523
  823    HD2  HIS 102           2HD      HIS 102  17.672  -6.557  15.748
  824    HE1  HIS 102           1HE      HIS 102  19.386  -2.707  16.205
  825    HE2  HIS 102           2HE      HIS 102  17.248  -4.033  16.158
  826    H    HIS 103           HN       HIS 103  20.963  -7.721  11.330
  827    HA   HIS 103           HA       HIS 103  23.036  -9.730  11.908
  828    HB2  HIS 103           2HB      HIS 103  20.984 -10.482  10.550
  829    HB3  HIS 103           1HB      HIS 103  21.585  -9.434   9.272
  830    HD1  HIS 103           1HD      HIS 103  22.314 -12.644  11.055
  831    HD2  HIS 103           2HD      HIS 103  23.786 -10.410   7.869
  832    HE1  HIS 103           1HE      HIS 103  23.913 -14.163   9.842
  833    HE2  HIS 103           2HE      HIS 103  24.794 -12.799   7.912
  834    H    HIS 104           HN       HIS 104  25.015  -8.935  11.593
  835    HA   HIS 104           HA       HIS 104  25.402  -6.265  10.756
  836    HB2  HIS 104           2HB      HIS 104  26.830  -7.341  12.421
  837    HB3  HIS 104           1HB      HIS 104  27.421  -8.474  11.213
  838    HD1  HIS 104           1HD      HIS 104  28.094  -5.199  12.685
  839    HD2  HIS 104           2HD      HIS 104  29.081  -7.200   9.172
  840    HE1  HIS 104           1HE      HIS 104  30.054  -3.952  11.718
  841    HE2  HIS 104           2HE      HIS 104  30.706  -5.246   9.651
  842    H    HIS 105           HN       HIS 105  26.591  -9.292   9.256
  843    HA   HIS 105           HA       HIS 105  27.516  -7.752   6.975
  844    HB2  HIS 105           2HB      HIS 105  28.946  -9.522   7.939
  845    HB3  HIS 105           1HB      HIS 105  27.726 -10.721   7.523
  846    HD1  HIS 105           1HD      HIS 105  29.031 -12.046   5.823
  847    HD2  HIS 105           2HD      HIS 105  29.017  -7.958   5.032
  848    HE1  HIS 105           1HE      HIS 105  30.067 -11.787   3.543
  849    HE2  HIS 105           2HE      HIS 105  30.185  -9.297   3.150
  850    H    HIS 106           HN       HIS 106  26.258  -7.335   5.323
  851    HA   HIS 106           HA       HIS 106  23.952  -9.062   4.794
  852    HB2  HIS 106           2HB      HIS 106  24.664  -6.341   3.679
  853    HB3  HIS 106           1HB      HIS 106  23.203  -7.237   3.289
  854    HD1  HIS 106           1HD      HIS 106  24.503  -4.767   5.578
  855    HD2  HIS 106           2HD      HIS 106  21.517  -7.661   5.672
  856    HE1  HIS 106           1HE      HIS 106  22.996  -4.125   7.490
  857    HE2  HIS 106           2HE      HIS 106  21.084  -5.773   7.384
  Start of MODEL   20
    1    H1   MET   1           H1       MET   1 -15.625   2.969   5.937
    2    H2   MET   1           H2       MET   1 -15.641   4.659   5.929
    3    H3   MET   1           H3       MET   1 -14.482   3.830   6.851
    4    HA   MET   1           HA       MET   1 -14.700   3.798   3.895
    5    HB2  MET   1           2HB      MET   1 -13.874   5.943   4.824
    6    HB3  MET   1           1HB      MET   1 -12.617   5.066   5.685
    7    HG2  MET   1           2HG      MET   1 -11.585   5.930   3.763
    8    HG3  MET   1           1HG      MET   1 -11.836   4.219   3.447
    9    HE1  MET   1           2HE      MET   1 -14.478   7.128   3.379
   10    HE2  MET   1           3HE      MET   1 -14.470   7.556   1.669
   11    HE3  MET   1           1HE      MET   1 -13.050   7.878   2.663
   12    H    THR   2           HN       THR   2 -13.819   2.056   3.010
   13    HA   THR   2           HA       THR   2 -12.123   0.341   4.676
   14    HB   THR   2           HB       THR   2 -12.391  -1.325   2.828
   15    HG1  THR   2           1HG      THR   2 -14.268   0.575   1.802
   16   HG21  THR   2          3HG2      THR   2 -14.965  -0.224   3.968
   17   HG22  THR   2          1HG2      THR   2 -13.887  -1.371   4.762
   18   HG23  THR   2          2HG2      THR   2 -14.747  -1.839   3.295
   19    H    PHE   3           HN       PHE   3 -10.206  -0.663   3.590
   20    HA   PHE   3           HA       PHE   3  -8.436   1.337   2.721
   21    HB2  PHE   3           2HB      PHE   3  -7.698  -0.746   3.821
   22    HB3  PHE   3           1HB      PHE   3  -8.182  -1.663   2.397
   23    HD1  PHE   3           1HD      PHE   3  -5.890   1.035   3.522
   24    HD2  PHE   3           2HD      PHE   3  -6.697  -1.994   0.645
   25    HE1  PHE   3           1HE      PHE   3  -3.658   1.380   2.543
   26    HE2  PHE   3           2HE      PHE   3  -4.469  -1.654  -0.344
   27    HZ   PHE   3           HZ       PHE   3  -2.948   0.032   0.605
   28    H    SER   4           HN       SER   4 -10.293  -1.089   0.944
   29    HA   SER   4           HA       SER   4  -9.252  -0.649  -1.611
   30    HB2  SER   4           2HB      SER   4 -12.097  -1.387  -0.872
   31    HB3  SER   4           1HB      SER   4 -11.349  -1.610  -2.453
   32    HG   SER   4           HG       SER   4 -10.582  -2.850  -0.016
   33    H    GLU   5           HN       GLU   5 -11.982   0.915   0.037
   34    HA   GLU   5           HA       GLU   5 -12.741   2.599  -2.072
   35    HB2  GLU   5           2HB      GLU   5 -13.051   2.836   0.913
   36    HB3  GLU   5           1HB      GLU   5 -13.757   3.979  -0.210
   37    HG2  GLU   5           2HG      GLU   5 -15.105   2.272  -1.195
   38    HG3  GLU   5           1HG      GLU   5 -14.303   1.033  -0.234
   39    H    CYS   6           HN       CYS   6 -10.605   3.155   0.697
   40    HA   CYS   6           HA       CYS   6 -10.062   5.868   0.149
   41    HB2  CYS   6           2HB      CYS   6  -9.638   4.608   2.309
   42    HB3  CYS   6           1HB      CYS   6  -8.212   3.941   1.550
   43    HG   CYS   6           HG       CYS   6  -7.614   6.916   0.988
   44    H    ALA   7           HN       ALA   7  -8.270   2.905  -0.593
   45    HA   ALA   7           HA       ALA   7  -6.150   4.093  -2.004
   46    HB1  ALA   7           1HB      ALA   7  -5.749   1.905  -2.970
   47    HB2  ALA   7           2HB      ALA   7  -7.349   1.365  -2.466
   48    HB3  ALA   7           3HB      ALA   7  -6.125   1.746  -1.253
   49    H    ALA   8           HN       ALA   8  -9.280   2.855  -3.132
   50    HA   ALA   8           HA       ALA   8  -8.906   3.371  -5.866
   51    HB1  ALA   8           1HB      ALA   8 -10.723   1.965  -4.999
   52    HB2  ALA   8           2HB      ALA   8 -11.321   3.231  -6.071
   53    HB3  ALA   8           3HB      ALA   8 -11.499   3.400  -4.324
   54    H    LEU   9           HN       LEU   9 -10.163   5.409  -3.257
   55    HA   LEU   9           HA       LEU   9 -10.889   7.607  -4.870
   56    HB2  LEU   9           2HB      LEU   9 -10.056   7.469  -1.975
   57    HB3  LEU   9           1HB      LEU   9 -10.639   8.933  -2.743
   58    HG   LEU   9           HG       LEU   9 -12.204   6.380  -2.368
   59   HD11  LEU   9          1HD1      LEU   9 -13.578   7.736  -0.860
   60   HD12  LEU   9          2HD1      LEU   9 -12.475   9.095  -1.083
   61   HD13  LEU   9          3HD1      LEU   9 -11.910   7.619  -0.301
   62   HD21  LEU   9          3HD2      LEU   9 -12.820   7.470  -4.450
   63   HD22  LEU   9          1HD2      LEU   9 -13.028   9.004  -3.607
   64   HD23  LEU   9          2HD2      LEU   9 -14.105   7.652  -3.256
   65    H    TYR  10           HN       TYR  10  -7.867   6.785  -3.217
   66    HA   TYR  10           HA       TYR  10  -6.407   9.089  -3.823
   67    HB2  TYR  10           2HB      TYR  10  -5.564   7.380  -2.295
   68    HB3  TYR  10           1HB      TYR  10  -5.464   6.220  -3.611
   69    HD1  TYR  10           2HD      TYR  10  -4.123   9.536  -2.553
   70    HD2  TYR  10           1HD      TYR  10  -3.457   5.967  -4.774
   71    HE1  TYR  10           2HE      TYR  10  -1.817  10.255  -3.006
   72    HE2  TYR  10           1HE      TYR  10  -1.147   6.680  -5.234
   73    HH   TYR  10           HH       TYR  10   0.168   8.724  -5.325
   74    H    ILE  11           HN       ILE  11  -6.831   6.099  -5.634
   75    HA   ILE  11           HA       ILE  11  -5.217   6.852  -7.848
   76    HB   ILE  11           HB       ILE  11  -7.389   4.764  -7.606
   77   HG12  ILE  11          2HG1      ILE  11  -4.376   4.477  -7.581
   78   HG13  ILE  11          1HG1      ILE  11  -5.383   4.519  -6.138
   79   HG21  ILE  11          1HG2      ILE  11  -7.133   5.323  -9.938
   80   HG22  ILE  11          2HG2      ILE  11  -6.382   3.757  -9.631
   81   HG23  ILE  11          3HG2      ILE  11  -5.380   5.193  -9.816
   82   HD11  ILE  11          3HD1      ILE  11  -6.503   2.492  -6.837
   83   HD12  ILE  11          1HD1      ILE  11  -4.757   2.252  -6.764
   84   HD13  ILE  11          2HD1      ILE  11  -5.555   2.463  -8.323
   85    H    LYS  12           HN       LYS  12  -8.732   6.821  -7.348
   86    HA   LYS  12           HA       LYS  12  -9.417   7.665  -9.954
   87    HB2  LYS  12           2HB      LYS  12 -10.958   6.469  -8.491
   88    HB3  LYS  12           1HB      LYS  12 -10.960   7.809  -7.358
   89    HG2  LYS  12           2HG      LYS  12 -12.156   9.193  -8.865
   90    HG3  LYS  12           1HG      LYS  12 -11.934   8.046 -10.191
   91    HD2  LYS  12           2HD      LYS  12 -13.339   6.428  -9.105
   92    HD3  LYS  12           1HD      LYS  12 -13.440   7.423  -7.652
   93    HE2  LYS  12           2HE      LYS  12 -14.438   8.305 -10.352
   94    HE3  LYS  12           1HE      LYS  12 -15.451   7.494  -9.159
   95    HZ1  LYS  12           3HZ      LYS  12 -14.037  10.082  -8.759
   96    HZ2  LYS  12           1HZ      LYS  12 -15.013   9.301  -7.612
   97    HZ3  LYS  12           2HZ      LYS  12 -15.699   9.890  -9.044
   98    H    ALA  13           HN       ALA  13  -8.747   9.466  -6.987
   99    HA   ALA  13           HA       ALA  13  -9.597  11.970  -8.130
  100    HB1  ALA  13           1HB      ALA  13  -8.754  12.981  -6.094
  101    HB2  ALA  13           2HB      ALA  13  -7.957  11.472  -5.647
  102    HB3  ALA  13           3HB      ALA  13  -9.718  11.554  -5.713
  103    H    HIS  14           HN       HIS  14  -7.041  10.093  -8.885
  104    HA   HIS  14           HA       HIS  14  -5.496  12.436  -9.749
  105    HB2  HIS  14           2HB      HIS  14  -4.343   9.968  -8.436
  106    HB3  HIS  14           1HB      HIS  14  -3.379  11.149  -9.313
  107    HD1  HIS  14           1HD      HIS  14  -4.770  10.419  -6.034
  108    HD2  HIS  14           2HD      HIS  14  -3.435  13.795  -8.055
  109    HE1  HIS  14           1HE      HIS  14  -4.395  12.163  -4.261
  110    HE2  HIS  14           2HE      HIS  14  -3.857  14.263  -5.545
  111    H    ARG  15           HN       ARG  15  -7.265   9.975 -10.791
  112    HA   ARG  15           HA       ARG  15  -5.563   8.555 -12.537
  113    HB2  ARG  15           2HB      ARG  15  -7.683   7.896 -13.710
  114    HB3  ARG  15           1HB      ARG  15  -7.670   7.574 -11.987
  115    HG2  ARG  15           2HG      ARG  15  -9.070   9.478 -11.566
  116    HG3  ARG  15           1HG      ARG  15  -8.973   9.969 -13.258
  117    HD2  ARG  15           2HD      ARG  15 -10.095   7.318 -12.388
  118    HD3  ARG  15           1HD      ARG  15 -11.087   8.767 -12.549
  119    HE   ARG  15           HE       ARG  15  -9.904   8.675 -14.942
  120   HH11  ARG  15          1HH1      ARG  15 -11.497   6.159 -13.080
  121   HH12  ARG  15          2HH1      ARG  15 -12.050   5.294 -14.484
  122   HH21  ARG  15          1HH2      ARG  15 -10.648   7.552 -16.775
  123   HH22  ARG  15          2HH2      ARG  15 -11.601   6.113 -16.588
  124    H    SER  16           HN       SER  16  -7.532  11.464 -12.997
  125    HA   SER  16           HA       SER  16  -6.910  11.772 -15.739
  126    HB2  SER  16           2HB      SER  16  -7.805  13.806 -13.690
  127    HB3  SER  16           1HB      SER  16  -7.840  14.017 -15.432
  128    HG   SER  16           HG       SER  16  -9.512  12.558 -13.787
  129    H    SER  17           HN       SER  17  -5.222  12.451 -12.828
  130    HA   SER  17           HA       SER  17  -3.395  14.345 -13.977
  131    HB2  SER  17           2HB      SER  17  -3.064  12.743 -11.438
  132    HB3  SER  17           1HB      SER  17  -2.319  14.286 -11.847
  133    HG   SER  17           HG       SER  17  -4.894  14.688 -12.063
  134    H    TRP  18           HN       TRP  18  -3.451  10.896 -13.223
  135    HA   TRP  18           HA       TRP  18  -0.713  10.461 -13.944
  136    HB2  TRP  18           2HB      TRP  18  -2.974   8.510 -13.481
  137    HB3  TRP  18           1HB      TRP  18  -1.294   8.051 -13.725
  138    HD1  TRP  18           1HD      TRP  18  -0.586  10.811 -11.737
  139    HE1  TRP  18           1HE      TRP  18  -0.594  10.307  -9.206
  140    HE3  TRP  18           3HE      TRP  18  -3.199   6.432 -11.808
  141    HZ2  TRP  18           2HZ      TRP  18  -1.571   8.291  -7.478
  142    HZ3  TRP  18           3HZ      TRP  18  -3.615   5.267  -9.687
  143    HH2  TRP  18           2HH      TRP  18  -2.825   6.180  -7.564
  144    H    LYS  19           HN       LYS  19  -3.809  10.206 -15.597
  145    HA   LYS  19           HA       LYS  19  -4.321  10.076 -17.753
  146    HB2  LYS  19           2HB      LYS  19  -1.362  10.427 -18.078
  147    HB3  LYS  19           1HB      LYS  19  -2.468  10.254 -19.440
  148    HG2  LYS  19           2HG      LYS  19  -2.670  12.379 -17.333
  149    HG3  LYS  19           1HG      LYS  19  -1.978  12.593 -18.945
  150    HD2  LYS  19           2HD      LYS  19  -4.109  12.035 -19.965
  151    HD3  LYS  19           1HD      LYS  19  -4.813  11.718 -18.380
  152    HE2  LYS  19           2HE      LYS  19  -4.455  14.060 -17.762
  153    HE3  LYS  19           1HE      LYS  19  -3.768  14.372 -19.357
  154    HZ1  LYS  19           3HZ      LYS  19  -5.867  13.862 -20.366
  155    HZ2  LYS  19           1HZ      LYS  19  -6.121  15.021 -19.153
  156    HZ3  LYS  19           2HZ      LYS  19  -6.537  13.402 -18.877
  157    H    ASN  20           HN       ASN  20  -4.048   7.062 -19.206
  158    HA   ASN  20           HA       ASN  20  -2.527   6.996 -20.802
  159    HB2  ASN  20           2HB      ASN  20  -2.184   9.368 -20.945
  160    HB3  ASN  20           1HB      ASN  20  -1.167   9.345 -19.508
  161   HD21  ASN  20          1HD2      ASN  20   0.933   8.965 -19.687
  162   HD22  ASN  20          2HD2      ASN  20   1.741   8.607 -21.179
  163    H    THR  21           HN       THR  21  -1.069   5.586 -21.096
  164    HA   THR  21           HA       THR  21   0.309   3.852 -20.719
  165    HB   THR  21           HB       THR  21   2.171   3.936 -19.231
  166    HG1  THR  21           1HG      THR  21   0.792   6.073 -17.955
  167   HG21  THR  21          3HG2      THR  21   3.232   6.063 -19.833
  168   HG22  THR  21          1HG2      THR  21   1.665   6.690 -20.349
  169   HG23  THR  21          2HG2      THR  21   2.394   5.326 -21.200
  170    H    LYS  22           HN       LYS  22   0.963   2.183 -19.012
  171    HA   LYS  22           HA       LYS  22  -1.487   1.399 -17.682
  172    HB2  LYS  22           2HB      LYS  22   1.175   0.049 -18.107
  173    HB3  LYS  22           1HB      LYS  22  -0.117  -0.673 -17.160
  174    HG2  LYS  22           2HG      LYS  22  -0.618   0.239 -19.963
  175    HG3  LYS  22           1HG      LYS  22   0.149  -1.317 -19.646
  176    HD2  LYS  22           2HD      LYS  22  -2.463  -0.503 -18.391
  177    HD3  LYS  22           1HD      LYS  22  -2.370  -1.339 -19.942
  178    HE2  LYS  22           2HE      LYS  22  -1.144  -3.174 -18.854
  179    HE3  LYS  22           1HE      LYS  22  -1.287  -2.340 -17.310
  180    HZ1  LYS  22           3HZ      LYS  22  -2.951  -4.121 -17.674
  181    HZ2  LYS  22           1HZ      LYS  22  -3.612  -3.210 -18.940
  182    HZ3  LYS  22           2HZ      LYS  22  -3.644  -2.606 -17.355
  183    H    HIS  23           HN       HIS  23   0.590   3.533 -16.720
  184    HA   HIS  23           HA       HIS  23   1.643   2.681 -14.251
  185    HB2  HIS  23           2HB      HIS  23   1.737   4.996 -15.756
  186    HB3  HIS  23           1HB      HIS  23   0.825   5.503 -14.339
  187    HD1  HIS  23           1HD      HIS  23   2.296   6.482 -12.617
  188    HD2  HIS  23           2HD      HIS  23   4.233   3.515 -14.808
  189    HE1  HIS  23           1HE      HIS  23   4.619   6.333 -11.656
  190    HE2  HIS  23           2HE      HIS  23   5.746   4.464 -12.919
  191    H    ALA  24           HN       ALA  24  -1.425   4.314 -15.019
  192    HA   ALA  24           HA       ALA  24  -2.367   4.411 -12.346
  193    HB1  ALA  24           1HB      ALA  24  -3.272   5.846 -14.119
  194    HB2  ALA  24           2HB      ALA  24  -4.546   4.913 -13.336
  195    HB3  ALA  24           3HB      ALA  24  -3.950   4.430 -14.923
  196    H    ASP  25           HN       ASP  25  -2.612   2.057 -14.930
  197    HA   ASP  25           HA       ASP  25  -4.472   0.298 -13.750
  198    HB2  ASP  25           2HB      ASP  25  -3.795   0.178 -16.124
  199    HB3  ASP  25           1HB      ASP  25  -2.184  -0.330 -15.635
  200    H    GLN  26           HN       GLN  26  -0.943   0.405 -13.703
  201    HA   GLN  26           HA       GLN  26  -0.438  -1.862 -12.191
  202    HB2  GLN  26           2HB      GLN  26   1.036   0.722 -12.591
  203    HB3  GLN  26           1HB      GLN  26   1.677  -0.519 -11.533
  204    HG2  GLN  26           2HG      GLN  26   1.656  -2.109 -13.395
  205    HG3  GLN  26           1HG      GLN  26   1.037  -0.841 -14.452
  206   HE21  GLN  26          1HE2      GLN  26   2.820  -0.978 -15.804
  207   HE22  GLN  26          2HE2      GLN  26   4.376  -0.365 -15.354
  208    H    TRP  27           HN       TRP  27  -1.123   1.446 -11.116
  209    HA   TRP  27           HA       TRP  27  -0.704   1.043  -8.374
  210    HB2  TRP  27           2HB      TRP  27  -2.316   2.975  -9.982
  211    HB3  TRP  27           1HB      TRP  27  -2.580   2.901  -8.244
  212    HD1  TRP  27           1HD      TRP  27   0.062   3.920 -10.831
  213    HE1  TRP  27           1HE      TRP  27   1.837   5.370  -9.641
  214    HE3  TRP  27           3HE      TRP  27  -1.489   3.308  -5.997
  215    HZ2  TRP  27           2HZ      TRP  27   2.490   6.134  -7.007
  216    HZ3  TRP  27           3HZ      TRP  27  -0.233   4.428  -4.203
  217    HH2  TRP  27           2HH      TRP  27   1.715   5.811  -4.698
  218    H    THR  28           HN       THR  28  -3.698   0.764 -10.276
  219    HA   THR  28           HA       THR  28  -5.300  -0.028  -8.064
  220    HB   THR  28           HB       THR  28  -5.881  -0.534 -10.982
  221    HG1  THR  28           1HG      THR  28  -5.657   1.811  -9.583
  222   HG21  THR  28          3HG2      THR  28  -7.679  -0.112  -8.592
  223   HG22  THR  28          1HG2      THR  28  -7.414  -1.636  -9.439
  224   HG23  THR  28          2HG2      THR  28  -8.223  -0.300 -10.258
  225    H    ASN  29           HN       ASN  29  -3.710  -1.798 -10.678
  226    HA   ASN  29           HA       ASN  29  -4.961  -4.270 -10.328
  227    HB2  ASN  29           2HB      ASN  29  -3.569  -3.436 -12.285
  228    HB3  ASN  29           1HB      ASN  29  -2.144  -3.847 -11.343
  229   HD21  ASN  29          1HD2      ASN  29  -3.092  -4.854 -13.902
  230   HD22  ASN  29          2HD2      ASN  29  -3.234  -6.571 -13.717
  231    H    THR  30           HN       THR  30  -1.823  -3.149  -9.033
  232    HA   THR  30           HA       THR  30  -1.175  -5.629  -7.845
  233    HB   THR  30           HB       THR  30  -0.181  -2.931  -6.953
  234    HG1  THR  30           1HG      THR  30   0.582  -4.554  -9.175
  235   HG21  THR  30          3HG2      THR  30   1.143  -5.642  -6.949
  236   HG22  THR  30          1HG2      THR  30   0.437  -4.853  -5.540
  237   HG23  THR  30          2HG2      THR  30   1.833  -4.136  -6.342
  238    H    ILE  31           HN       ILE  31  -2.628  -2.666  -6.492
  239    HA   ILE  31           HA       ILE  31  -2.732  -3.594  -3.827
  240    HB   ILE  31           HB       ILE  31  -4.446  -1.511  -5.193
  241   HG12  ILE  31          2HG1      ILE  31  -1.988  -1.207  -3.455
  242   HG13  ILE  31          1HG1      ILE  31  -2.020  -1.023  -5.208
  243   HG21  ILE  31          1HG2      ILE  31  -5.535  -2.324  -3.177
  244   HG22  ILE  31          2HG2      ILE  31  -4.934  -0.684  -2.935
  245   HG23  ILE  31          3HG2      ILE  31  -4.058  -2.053  -2.252
  246   HD11  ILE  31          3HD1      ILE  31  -2.025   1.132  -4.083
  247   HD12  ILE  31          1HD1      ILE  31  -3.499   0.694  -3.219
  248   HD13  ILE  31          2HD1      ILE  31  -3.526   0.883  -4.971
  249    H    LYS  32           HN       LYS  32  -5.107  -3.619  -6.444
  250    HA   LYS  32           HA       LYS  32  -7.276  -4.661  -5.027
  251    HB2  LYS  32           2HB      LYS  32  -7.269  -3.723  -7.382
  252    HB3  LYS  32           1HB      LYS  32  -6.590  -5.254  -7.911
  253    HG2  LYS  32           2HG      LYS  32  -8.853  -5.919  -6.405
  254    HG3  LYS  32           1HG      LYS  32  -9.324  -4.550  -7.414
  255    HD2  LYS  32           2HD      LYS  32  -9.774  -6.538  -8.654
  256    HD3  LYS  32           1HD      LYS  32  -8.351  -5.785  -9.375
  257    HE2  LYS  32           2HE      LYS  32  -6.923  -7.315  -8.065
  258    HE3  LYS  32           1HE      LYS  32  -8.372  -8.104  -7.448
  259    HZ1  LYS  32           3HZ      LYS  32  -7.350  -8.073 -10.221
  260    HZ2  LYS  32           1HZ      LYS  32  -8.945  -8.524  -9.853
  261    HZ3  LYS  32           2HZ      LYS  32  -7.649  -9.409  -9.222
  262    H    THR  33           HN       THR  33  -4.502  -6.219  -6.503
  263    HA   THR  33           HA       THR  33  -5.671  -8.854  -6.335
  264    HB   THR  33           HB       THR  33  -2.865  -8.033  -7.125
  265    HG1  THR  33           1HG      THR  33  -4.129  -7.179  -8.675
  266   HG21  THR  33          3HG2      THR  33  -2.817 -10.229  -8.258
  267   HG22  THR  33          1HG2      THR  33  -4.387 -10.611  -7.552
  268   HG23  THR  33          2HG2      THR  33  -2.983 -10.387  -6.508
  269    H    TYR  34           HN       TYR  34  -2.842  -7.240  -4.862
  270    HA   TYR  34           HA       TYR  34  -2.350  -9.541  -3.203
  271    HB2  TYR  34           2HB      TYR  34  -0.966  -6.877  -3.450
  272    HB3  TYR  34           1HB      TYR  34  -0.470  -8.118  -2.298
  273    HD1  TYR  34           2HD      TYR  34   0.196 -10.391  -3.191
  274    HD2  TYR  34           1HD      TYR  34  -0.265  -6.990  -5.703
  275    HE1  TYR  34           2HE      TYR  34   1.519 -11.510  -4.937
  276    HE2  TYR  34           1HE      TYR  34   1.052  -8.098  -7.461
  277    HH   TYR  34           HH       TYR  34   1.750 -11.393  -7.422
  278    H    CYS  35           HN       CYS  35  -3.371  -6.181  -2.601
  279    HA   CYS  35           HA       CYS  35  -3.510  -6.667   0.242
  280    HB2  CYS  35           2HB      CYS  35  -4.390  -4.258  -1.363
  281    HB3  CYS  35           1HB      CYS  35  -4.228  -4.329   0.390
  282    HG   CYS  35           HG       CYS  35  -1.388  -5.018   0.047
  283    H    GLY  36           HN       GLY  36  -5.670  -6.686  -2.448
  284    HA2  GLY  36           2HA      GLY  36  -8.132  -6.089  -1.449
  285    HA3  GLY  36           1HA      GLY  36  -7.857  -7.329  -2.658
  286    HA   PRO  37           HA       PRO  37  -9.189 -10.596  -0.116
  287    HB2  PRO  37           2HB      PRO  37  -7.110 -12.336   0.235
  288    HB3  PRO  37           1HB      PRO  37  -8.037 -12.185  -1.262
  289    HG2  PRO  37           2HG      PRO  37  -5.394 -10.972  -0.541
  290    HG3  PRO  37           1HG      PRO  37  -5.888 -11.760  -2.052
  291    HD2  PRO  37           2HD      PRO  37  -5.800  -9.090  -1.839
  292    HD3  PRO  37           1HD      PRO  37  -7.076  -9.899  -2.776
  293    H    VAL  38           HN       VAL  38  -6.669  -8.712   1.195
  294    HA   VAL  38           HA       VAL  38  -7.050  -9.993   3.821
  295    HB   VAL  38           HB       VAL  38  -4.640  -8.389   2.957
  296   HG11  VAL  38          1HG1      VAL  38  -3.633  -9.234   5.029
  297   HG12  VAL  38          2HG1      VAL  38  -5.145 -10.051   5.431
  298   HG13  VAL  38          3HG1      VAL  38  -5.086  -8.290   5.362
  299   HG21  VAL  38          3HG2      VAL  38  -4.947 -11.379   3.263
  300   HG22  VAL  38          1HG2      VAL  38  -3.443 -10.528   2.917
  301   HG23  VAL  38          2HG2      VAL  38  -4.757 -10.509   1.740
  302    H    ILE  39           HN       ILE  39  -5.718  -6.822   2.861
  303    HA   ILE  39           HA       ILE  39  -7.224  -5.657   5.074
  304    HB   ILE  39           HB       ILE  39  -5.787  -3.665   4.745
  305   HG12  ILE  39          2HG1      ILE  39  -4.396  -5.388   2.681
  306   HG13  ILE  39          1HG1      ILE  39  -5.360  -3.955   2.335
  307   HG21  ILE  39          1HG2      ILE  39  -3.711  -4.700   5.556
  308   HG22  ILE  39          2HG2      ILE  39  -4.327  -6.281   5.072
  309   HG23  ILE  39          3HG2      ILE  39  -5.140  -5.367   6.344
  310   HD11  ILE  39          3HD1      ILE  39  -2.973  -3.479   2.253
  311   HD12  ILE  39          1HD1      ILE  39  -2.803  -4.011   3.924
  312   HD13  ILE  39          2HD1      ILE  39  -3.758  -2.576   3.549
  313    H    GLY  40           HN       GLY  40  -7.642  -6.073   1.838
  314    HA2  GLY  40           2HA      GLY  40  -8.414  -3.666   0.757
  315    HA3  GLY  40           1HA      GLY  40  -9.132  -5.208   0.332
  316    HA   PRO  41           HA       PRO  41 -12.886  -3.957   2.246
  317    HB2  PRO  41           2HB      PRO  41 -13.429  -6.367   3.718
  318    HB3  PRO  41           1HB      PRO  41 -14.046  -5.887   2.137
  319    HG2  PRO  41           2HG      PRO  41 -12.316  -7.981   2.542
  320    HG3  PRO  41           1HG      PRO  41 -12.474  -7.097   1.015
  321    HD2  PRO  41           2HD      PRO  41 -10.416  -6.808   3.171
  322    HD3  PRO  41           1HD      PRO  41 -10.216  -6.764   1.405
  323    H    LEU  42           HN       LEU  42 -10.294  -4.267   4.211
  324    HA   LEU  42           HA       LEU  42 -11.700  -4.014   6.741
  325    HB2  LEU  42           2HB      LEU  42  -8.750  -3.864   6.099
  326    HB3  LEU  42           1HB      LEU  42  -9.432  -3.790   7.712
  327    HG   LEU  42           HG       LEU  42  -9.533  -6.151   5.835
  328   HD11  LEU  42          1HD1      LEU  42  -8.109  -5.796   8.468
  329   HD12  LEU  42          2HD1      LEU  42  -7.345  -5.732   6.880
  330   HD13  LEU  42          3HD1      LEU  42  -8.086  -7.230   7.444
  331   HD21  LEU  42          3HD2      LEU  42 -10.586  -7.355   7.678
  332   HD22  LEU  42          1HD2      LEU  42 -11.584  -5.999   7.158
  333   HD23  LEU  42          2HD2      LEU  42 -10.628  -5.874   8.635
  334    H    SER  43           HN       SER  43 -11.412  -2.157   8.129
  335    HA   SER  43           HA       SER  43 -11.839   0.300   6.925
  336    HB2  SER  43           2HB      SER  43 -10.813  -0.204   9.721
  337    HB3  SER  43           1HB      SER  43 -11.837   1.104   9.161
  338    HG   SER  43           HG       SER  43 -13.002  -0.572  10.255
  339    H    VAL  44           HN       VAL  44 -10.509   1.977   6.410
  340    HA   VAL  44           HA       VAL  44  -7.832   1.396   5.761
  341    HB   VAL  44           HB       VAL  44  -9.192   3.022   4.513
  342   HG11  VAL  44          1HG1      VAL  44  -9.520   5.291   5.380
  343   HG12  VAL  44          2HG1      VAL  44  -8.856   4.785   6.933
  344   HG13  VAL  44          3HG1      VAL  44 -10.366   4.084   6.349
  345   HG21  VAL  44          3HG2      VAL  44  -7.451   4.761   4.236
  346   HG22  VAL  44          1HG2      VAL  44  -6.790   3.126   4.260
  347   HG23  VAL  44          2HG2      VAL  44  -6.653   4.151   5.686
  348    H    GLN  45           HN       GLN  45  -9.243   2.737   8.636
  349    HA   GLN  45           HA       GLN  45  -6.786   3.884   9.604
  350    HB2  GLN  45           2HB      GLN  45  -9.149   4.669  10.159
  351    HB3  GLN  45           1HB      GLN  45  -9.264   3.271  11.214
  352    HG2  GLN  45           2HG      GLN  45  -6.926   5.036  11.592
  353    HG3  GLN  45           1HG      GLN  45  -8.498   5.687  12.043
  354   HE21  GLN  45          1HE2      GLN  45  -6.061   3.321  12.757
  355   HE22  GLN  45          2HE2      GLN  45  -6.699   2.840  14.289
  356    H    ASP  46           HN       ASP  46  -8.540   0.891   9.907
  357    HA   ASP  46           HA       ASP  46  -7.189  -0.095  12.203
  358    HB2  ASP  46           2HB      ASP  46  -8.960  -1.352  10.127
  359    HB3  ASP  46           1HB      ASP  46  -8.175  -2.324  11.366
  360    H    VAL  47           HN       VAL  47  -6.360   0.041   8.887
  361    HA   VAL  47           HA       VAL  47  -4.716  -2.225   8.659
  362    HB   VAL  47           HB       VAL  47  -4.377   0.442   7.274
  363   HG11  VAL  47          1HG1      VAL  47  -3.363  -2.298   6.526
  364   HG12  VAL  47          2HG1      VAL  47  -2.385  -0.942   7.088
  365   HG13  VAL  47          3HG1      VAL  47  -3.220  -0.845   5.537
  366   HG21  VAL  47          3HG2      VAL  47  -5.656  -0.572   5.447
  367   HG22  VAL  47          1HG2      VAL  47  -6.604  -0.471   6.930
  368   HG23  VAL  47          2HG2      VAL  47  -5.909  -2.014   6.431
  369    H    ASP  48           HN       ASP  48  -3.146  -2.695  10.053
  370    HA   ASP  48           HA       ASP  48  -1.232  -0.567  10.757
  371    HB2  ASP  48           2HB      ASP  48  -0.977  -1.444  12.941
  372    HB3  ASP  48           1HB      ASP  48  -2.711  -1.409  12.659
  373    H    THR  49           HN       THR  49   0.736  -1.982  11.909
  374    HA   THR  49           HA       THR  49   2.213  -2.899   9.726
  375    HB   THR  49           HB       THR  49   2.779  -3.649  12.591
  376    HG1  THR  49           1HG      THR  49   3.961  -1.559  12.521
  377   HG21  THR  49          3HG2      THR  49   4.560  -3.048  10.225
  378   HG22  THR  49          1HG2      THR  49   4.262  -4.636  10.932
  379   HG23  THR  49          2HG2      THR  49   5.120  -3.406  11.859
  380    H    LYS  50           HN       LYS  50   0.428  -4.690  12.208
  381    HA   LYS  50           HA       LYS  50   1.430  -7.253  11.640
  382    HB2  LYS  50           2HB      LYS  50   0.184  -6.560  13.681
  383    HB3  LYS  50           1HB      LYS  50  -1.280  -6.472  12.726
  384    HG2  LYS  50           2HG      LYS  50   0.235  -9.031  12.818
  385    HG3  LYS  50           1HG      LYS  50  -0.761  -8.558  14.192
  386    HD2  LYS  50           2HD      LYS  50  -2.664  -8.252  12.578
  387    HD3  LYS  50           1HD      LYS  50  -1.643  -8.989  11.342
  388    HE2  LYS  50           2HE      LYS  50  -3.124 -10.645  12.311
  389    HE3  LYS  50           1HE      LYS  50  -1.448 -11.009  12.724
  390    HZ1  LYS  50           3HZ      LYS  50  -3.335  -9.581  14.524
  391    HZ2  LYS  50           1HZ      LYS  50  -1.784 -10.140  14.913
  392    HZ3  LYS  50           2HZ      LYS  50  -3.031 -11.243  14.598
  393    H    LEU  51           HN       LEU  51  -1.429  -5.543  10.472
  394    HA   LEU  51           HA       LEU  51  -2.430  -7.638   8.878
  395    HB2  LEU  51           2HB      LEU  51  -2.825  -4.657   8.677
  396    HB3  LEU  51           1HB      LEU  51  -3.757  -5.842   7.792
  397    HG   LEU  51           HG       LEU  51  -3.700  -5.503  10.783
  398   HD11  LEU  51          1HD1      LEU  51  -5.849  -4.959   8.744
  399   HD12  LEU  51          2HD1      LEU  51  -4.941  -3.751   9.656
  400   HD13  LEU  51          3HD1      LEU  51  -6.044  -4.846  10.494
  401   HD21  LEU  51          3HD2      LEU  51  -5.288  -7.424   9.089
  402   HD22  LEU  51          1HD2      LEU  51  -5.442  -7.208  10.833
  403   HD23  LEU  51          2HD2      LEU  51  -3.946  -7.852  10.152
  404    H    ILE  52           HN       ILE  52  -0.235  -4.961   8.199
  405    HA   ILE  52           HA       ILE  52  -0.104  -5.402   5.398
  406    HB   ILE  52           HB       ILE  52   1.831  -3.968   7.224
  407   HG12  ILE  52          2HG1      ILE  52  -0.353  -2.910   5.414
  408   HG13  ILE  52          1HG1      ILE  52  -0.458  -3.032   7.164
  409   HG21  ILE  52          1HG2      ILE  52   2.692  -2.900   5.201
  410   HG22  ILE  52          2HG2      ILE  52   1.625  -3.900   4.216
  411   HG23  ILE  52          3HG2      ILE  52   2.922  -4.649   5.148
  412   HD11  ILE  52          3HD1      ILE  52   0.030  -0.762   6.456
  413   HD12  ILE  52          1HD1      ILE  52   1.490  -1.320   5.641
  414   HD13  ILE  52          2HD1      ILE  52   1.364  -1.432   7.397
  415    H    MET  53           HN       MET  53   1.885  -6.479   8.128
  416    HA   MET  53           HA       MET  53   3.957  -7.665   6.664
  417    HB2  MET  53           2HB      MET  53   2.847  -8.202   9.402
  418    HB3  MET  53           1HB      MET  53   4.133  -9.204   8.743
  419    HG2  MET  53           2HG      MET  53   5.505  -7.172   8.440
  420    HG3  MET  53           1HG      MET  53   4.230  -6.233   9.213
  421    HE1  MET  53           3HE      MET  53   7.157  -6.445  11.881
  422    HE2  MET  53           1HE      MET  53   6.232  -5.366  10.838
  423    HE3  MET  53           2HE      MET  53   7.401  -6.485  10.135
  424    H    LYS  54           HN       LYS  54   0.851  -9.006   7.718
  425    HA   LYS  54           HA       LYS  54   1.270 -11.653   6.986
  426    HB2  LYS  54           2HB      LYS  54  -1.251 -10.003   7.017
  427    HB3  LYS  54           1HB      LYS  54  -1.246 -11.724   6.653
  428    HG2  LYS  54           2HG      LYS  54  -0.064 -12.020   8.893
  429    HG3  LYS  54           1HG      LYS  54  -0.544 -10.355   9.227
  430    HD2  LYS  54           2HD      LYS  54  -2.150 -11.980  10.140
  431    HD3  LYS  54           1HD      LYS  54  -2.885 -10.946   8.912
  432    HE2  LYS  54           2HE      LYS  54  -2.617 -12.698   7.250
  433    HE3  LYS  54           1HE      LYS  54  -1.822 -13.726   8.438
  434    HZ1  LYS  54           3HZ      LYS  54  -4.576 -12.718   8.831
  435    HZ2  LYS  54           1HZ      LYS  54  -3.802 -14.008   9.616
  436    HZ3  LYS  54           2HZ      LYS  54  -4.251 -14.154   7.986
  437    H    VAL  55           HN       VAL  55   0.318  -8.900   5.016
  438    HA   VAL  55           HA       VAL  55  -0.274 -10.425   2.678
  439    HB   VAL  55           HB       VAL  55   0.425  -7.491   2.870
  440   HG11  VAL  55          1HG1      VAL  55  -0.878  -7.308   0.783
  441   HG12  VAL  55          2HG1      VAL  55  -1.037  -9.065   0.753
  442   HG13  VAL  55          3HG1      VAL  55   0.555  -8.318   0.601
  443   HG21  VAL  55          3HG2      VAL  55  -2.269  -8.836   3.025
  444   HG22  VAL  55          1HG2      VAL  55  -1.992  -7.095   2.948
  445   HG23  VAL  55          2HG2      VAL  55  -1.434  -8.016   4.345
  446    H    LEU  56           HN       LEU  56   2.510  -8.502   3.744
  447    HA   LEU  56           HA       LEU  56   3.909  -8.791   1.264
  448    HB2  LEU  56           2HB      LEU  56   4.828  -7.799   3.958
  449    HB3  LEU  56           1HB      LEU  56   5.787  -7.719   2.495
  450    HG   LEU  56           HG       LEU  56   3.145  -6.329   2.928
  451   HD11  LEU  56          1HD1      LEU  56   4.884  -5.353   4.283
  452   HD12  LEU  56          2HD1      LEU  56   4.516  -4.287   2.925
  453   HD13  LEU  56          3HD1      LEU  56   5.969  -5.287   2.895
  454   HD21  LEU  56          3HD2      LEU  56   5.105  -6.134   0.643
  455   HD22  LEU  56          1HD2      LEU  56   3.623  -5.198   0.831
  456   HD23  LEU  56          2HD2      LEU  56   3.538  -6.942   0.584
  457    H    ASP  57           HN       ASP  57   3.945 -10.495   4.304
  458    HA   ASP  57           HA       ASP  57   6.487 -11.500   4.433
  459    HB2  ASP  57           2HB      ASP  57   4.520 -11.778   6.068
  460    HB3  ASP  57           1HB      ASP  57   4.133 -13.218   5.148
  461    HA   PRO  58           HA       PRO  58   5.445 -15.411   1.871
  462    HB2  PRO  58           2HB      PRO  58   3.167 -15.508   0.415
  463    HB3  PRO  58           1HB      PRO  58   3.247 -16.033   2.100
  464    HG2  PRO  58           2HG      PRO  58   2.251 -13.451   0.965
  465    HG3  PRO  58           1HG      PRO  58   1.557 -14.447   2.258
  466    HD2  PRO  58           2HD      PRO  58   3.036 -12.215   2.732
  467    HD3  PRO  58           1HD      PRO  58   2.980 -13.592   3.847
  468    H    ILE  59           HN       ILE  59   4.868 -12.220   0.698
  469    HA   ILE  59           HA       ILE  59   5.123 -12.884  -2.098
  470    HB   ILE  59           HB       ILE  59   5.312 -10.148  -0.815
  471   HG12  ILE  59          2HG1      ILE  59   2.907 -11.561  -1.998
  472   HG13  ILE  59          1HG1      ILE  59   3.173 -11.259  -0.284
  473   HG21  ILE  59          1HG2      ILE  59   6.215 -10.255  -3.087
  474   HG22  ILE  59          2HG2      ILE  59   4.723  -9.316  -3.031
  475   HG23  ILE  59          3HG2      ILE  59   4.702 -10.964  -3.658
  476   HD11  ILE  59          3HD1      ILE  59   3.107  -8.842  -0.724
  477   HD12  ILE  59          1HD1      ILE  59   1.614  -9.657  -1.186
  478   HD13  ILE  59          2HD1      ILE  59   2.778  -9.180  -2.424
  479    H    TRP  60           HN       TRP  60   7.260 -11.934   0.494
  480    HA   TRP  60           HA       TRP  60   9.408 -10.914  -0.965
  481    HB2  TRP  60           2HB      TRP  60   9.436 -12.500   1.606
  482    HB3  TRP  60           1HB      TRP  60  10.828 -11.644   0.957
  483    HD1  TRP  60           1HD      TRP  60   8.241 -11.200   3.433
  484    HE1  TRP  60           1HE      TRP  60   7.891  -8.720   4.022
  485    HE3  TRP  60           3HE      TRP  60  10.707  -9.069  -0.507
  486    HZ2  TRP  60           2HZ      TRP  60   8.561  -6.192   2.956
  487    HZ3  TRP  60           3HZ      TRP  60  10.807  -6.612  -0.648
  488    HH2  TRP  60           2HH      TRP  60   9.755  -5.206   1.049
  489    H    GLU  61           HN       GLU  61   8.440 -14.236  -0.422
  490    HA   GLU  61           HA       GLU  61  10.885 -15.373  -1.351
  491    HB2  GLU  61           2HB      GLU  61   8.164 -16.426  -0.653
  492    HB3  GLU  61           1HB      GLU  61   9.375 -17.457  -1.378
  493    HG2  GLU  61           2HG      GLU  61   9.639 -15.971   1.218
  494    HG3  GLU  61           1HG      GLU  61   9.374 -17.703   1.026
  495    H    GLN  62           HN       GLN  62   7.828 -14.475  -2.767
  496    HA   GLN  62           HA       GLN  62   8.360 -15.974  -5.202
  497    HB2  GLN  62           2HB      GLN  62   6.002 -14.361  -4.237
  498    HB3  GLN  62           1HB      GLN  62   6.092 -15.042  -5.854
  499    HG2  GLN  62           2HG      GLN  62   6.135 -17.260  -5.008
  500    HG3  GLN  62           1HG      GLN  62   6.351 -16.689  -3.355
  501   HE21  GLN  62          1HE2      GLN  62   4.544 -17.858  -2.690
  502   HE22  GLN  62          2HE2      GLN  62   2.937 -17.311  -3.038
  503    H    LYS  63           HN       LYS  63   7.600 -12.607  -4.333
  504    HA   LYS  63           HA       LYS  63   9.203 -11.679  -6.595
  505    HB2  LYS  63           2HB      LYS  63   6.320 -10.879  -6.123
  506    HB3  LYS  63           1HB      LYS  63   7.392 -10.132  -7.299
  507    HG2  LYS  63           2HG      LYS  63   7.410 -12.026  -8.663
  508    HG3  LYS  63           1HG      LYS  63   6.816 -13.072  -7.373
  509    HD2  LYS  63           2HD      LYS  63   5.056 -12.671  -8.976
  510    HD3  LYS  63           1HD      LYS  63   4.658 -11.883  -7.448
  511    HE2  LYS  63           2HE      LYS  63   5.425  -9.745  -8.362
  512    HE3  LYS  63           1HE      LYS  63   5.828 -10.543  -9.884
  513    HZ1  LYS  63           3HZ      LYS  63   3.487 -11.135 -10.134
  514    HZ2  LYS  63           1HZ      LYS  63   3.692  -9.454 -10.038
  515    HZ3  LYS  63           2HZ      LYS  63   3.111 -10.316  -8.695
  516    HA   PRO  64           HA       PRO  64   9.965  -9.517  -2.568
  517    HB2  PRO  64           2HB      PRO  64  12.562  -8.864  -3.230
  518    HB3  PRO  64           1HB      PRO  64  12.075 -10.341  -2.393
  519    HG2  PRO  64           2HG      PRO  64  12.688  -9.911  -5.287
  520    HG3  PRO  64           1HG      PRO  64  13.103 -11.283  -4.243
  521    HD2  PRO  64           2HD      PRO  64  11.076 -11.409  -6.003
  522    HD3  PRO  64           1HD      PRO  64  10.992 -12.221  -4.426
  523    H    GLU  65           HN       GLU  65  11.095  -8.376  -5.750
  524    HA   GLU  65           HA       GLU  65  11.249  -5.669  -5.096
  525    HB2  GLU  65           2HB      GLU  65  11.157  -5.361  -7.563
  526    HB3  GLU  65           1HB      GLU  65  12.349  -6.527  -7.043
  527    HG2  GLU  65           2HG      GLU  65  10.877  -8.344  -7.670
  528    HG3  GLU  65           1HG      GLU  65   9.627  -7.191  -8.136
  529    H    THR  66           HN       THR  66   8.632  -7.651  -6.357
  530    HA   THR  66           HA       THR  66   6.802  -5.559  -6.849
  531    HB   THR  66           HB       THR  66   6.154  -8.430  -6.158
  532    HG1  THR  66           1HG      THR  66   7.170  -7.217  -8.496
  533   HG21  THR  66          3HG2      THR  66   4.152  -8.054  -7.511
  534   HG22  THR  66          1HG2      THR  66   4.651  -6.387  -7.802
  535   HG23  THR  66          2HG2      THR  66   4.220  -6.908  -6.173
  536    H    ALA  67           HN       ALA  67   7.527  -7.532  -4.030
  537    HA   ALA  67           HA       ALA  67   5.388  -6.703  -2.403
  538    HB1  ALA  67           1HB      ALA  67   6.708  -7.523  -0.537
  539    HB2  ALA  67           2HB      ALA  67   8.147  -7.571  -1.555
  540    HB3  ALA  67           3HB      ALA  67   6.791  -8.648  -1.892
  541    H    SER  68           HN       SER  68   8.656  -5.384  -2.839
  542    HA   SER  68           HA       SER  68   8.324  -3.323  -0.908
  543    HB2  SER  68           2HB      SER  68  10.540  -4.165  -1.776
  544    HB3  SER  68           1HB      SER  68  10.219  -3.281  -3.269
  545    HG   SER  68           HG       SER  68  10.509  -1.407  -2.255
  546    H    ARG  69           HN       ARG  69   7.860  -3.482  -4.424
  547    HA   ARG  69           HA       ARG  69   7.149  -0.803  -4.822
  548    HB2  ARG  69           2HB      ARG  69   6.392  -3.341  -6.258
  549    HB3  ARG  69           1HB      ARG  69   5.865  -1.761  -6.796
  550    HG2  ARG  69           2HG      ARG  69   8.207  -1.071  -7.040
  551    HG3  ARG  69           1HG      ARG  69   8.707  -2.687  -6.545
  552    HD2  ARG  69           2HD      ARG  69   7.543  -3.643  -8.472
  553    HD3  ARG  69           1HD      ARG  69   7.031  -2.029  -8.964
  554    HE   ARG  69           HE       ARG  69   9.852  -2.125  -8.714
  555   HH11  ARG  69          1HH1      ARG  69   7.237  -3.139 -10.821
  556   HH12  ARG  69          2HH1      ARG  69   8.238  -3.195 -12.244
  557   HH21  ARG  69          1HH2      ARG  69  11.162  -2.211 -10.574
  558   HH22  ARG  69          2HH2      ARG  69  10.477  -2.683 -12.099
  559    H    LEU  70           HN       LEU  70   5.293  -3.605  -3.750
  560    HA   LEU  70           HA       LEU  70   2.744  -2.414  -3.798
  561    HB2  LEU  70           2HB      LEU  70   3.054  -4.820  -3.543
  562    HB3  LEU  70           1HB      LEU  70   3.823  -4.578  -1.987
  563    HG   LEU  70           HG       LEU  70   1.697  -3.690  -1.091
  564   HD11  LEU  70          1HD1      LEU  70   0.766  -2.840  -3.186
  565   HD12  LEU  70          2HD1      LEU  70  -0.356  -3.934  -2.375
  566   HD13  LEU  70          3HD1      LEU  70   0.570  -4.492  -3.768
  567   HD21  LEU  70          3HD2      LEU  70   1.504  -6.412  -2.370
  568   HD22  LEU  70          1HD2      LEU  70   0.511  -5.830  -1.034
  569   HD23  LEU  70          2HD2      LEU  70   2.248  -6.041  -0.815
  570    H    ARG  71           HN       ARG  71   5.292  -2.463  -1.346
  571    HA   ARG  71           HA       ARG  71   3.916  -1.186   0.722
  572    HB2  ARG  71           2HB      ARG  71   6.834  -0.996  -0.026
  573    HB3  ARG  71           1HB      ARG  71   6.151  -0.448   1.489
  574    HG2  ARG  71           2HG      ARG  71   5.440  -2.784   1.946
  575    HG3  ARG  71           1HG      ARG  71   6.319  -3.276   0.493
  576    HD2  ARG  71           2HD      ARG  71   7.446  -1.973   2.968
  577    HD3  ARG  71           1HD      ARG  71   7.749  -3.614   2.393
  578    HE   ARG  71           HE       ARG  71   8.997  -2.661   0.559
  579   HH11  ARG  71          1HH1      ARG  71   8.180  -0.445   3.154
  580   HH12  ARG  71          2HH1      ARG  71   9.433   0.689   2.751
  581   HH21  ARG  71          1HH2      ARG  71  10.625  -1.171   0.009
  582   HH22  ARG  71          2HH2      ARG  71  10.828   0.276   0.959
  583    H    GLY  72           HN       GLY  72   5.716   0.108  -2.036
  584    HA2  GLY  72           2HA      GLY  72   5.568   2.826  -1.376
  585    HA3  GLY  72           1HA      GLY  72   5.721   2.186  -3.006
  586    H    ARG  73           HN       ARG  73   3.284   0.745  -3.090
  587    HA   ARG  73           HA       ARG  73   1.427   2.746  -3.775
  588    HB2  ARG  73           2HB      ARG  73   1.512  -0.176  -3.698
  589    HB3  ARG  73           1HB      ARG  73  -0.083   0.470  -3.340
  590    HG2  ARG  73           2HG      ARG  73   0.071   0.013  -5.676
  591    HG3  ARG  73           1HG      ARG  73   0.012   1.758  -5.444
  592    HD2  ARG  73           2HD      ARG  73   1.640   1.271  -7.125
  593    HD3  ARG  73           1HD      ARG  73   2.489   1.802  -5.673
  594    HE   ARG  73           HE       ARG  73   3.345  -0.337  -5.396
  595   HH11  ARG  73          1HH1      ARG  73   1.080  -0.261  -8.070
  596   HH12  ARG  73          2HH1      ARG  73   1.575  -1.796  -8.706
  597   HH21  ARG  73          1HH2      ARG  73   4.011  -2.353  -6.253
  598   HH22  ARG  73          2HH2      ARG  73   3.277  -2.969  -7.705
  599    H    ILE  74           HN       ILE  74   1.601   0.557  -0.974
  600    HA   ILE  74           HA       ILE  74  -0.747   1.527   0.280
  601    HB   ILE  74           HB       ILE  74   1.603   0.151   1.593
  602   HG12  ILE  74          2HG1      ILE  74  -0.901  -1.048   0.387
  603   HG13  ILE  74          1HG1      ILE  74   0.705  -1.118  -0.333
  604   HG21  ILE  74          1HG2      ILE  74  -1.286   0.355   2.428
  605   HG22  ILE  74          2HG2      ILE  74   0.069   1.197   3.180
  606   HG23  ILE  74          3HG2      ILE  74  -0.032  -0.563   3.263
  607   HD11  ILE  74          3HD1      ILE  74   0.041  -3.197   0.822
  608   HD12  ILE  74          1HD1      ILE  74  -0.030  -2.298   2.340
  609   HD13  ILE  74          2HD1      ILE  74   1.505  -2.473   1.485
  610    H    GLU  75           HN       GLU  75   2.688   2.273   0.726
  611    HA   GLU  75           HA       GLU  75   2.541   3.996   2.907
  612    HB2  GLU  75           2HB      GLU  75   4.626   3.135   1.866
  613    HB3  GLU  75           1HB      GLU  75   4.370   4.215   0.507
  614    HG2  GLU  75           2HG      GLU  75   4.532   6.136   2.037
  615    HG3  GLU  75           1HG      GLU  75   4.877   5.023   3.359
  616    H    SER  76           HN       SER  76   2.281   4.758  -0.549
  617    HA   SER  76           HA       SER  76   1.967   7.536  -0.198
  618    HB2  SER  76           2HB      SER  76   1.045   5.825  -2.497
  619    HB3  SER  76           1HB      SER  76   1.305   7.568  -2.536
  620    HG   SER  76           HG       SER  76   3.163   5.474  -2.477
  621    H    VAL  77           HN       VAL  77  -0.352   4.884  -0.358
  622    HA   VAL  77           HA       VAL  77  -2.660   6.548  -0.452
  623    HB   VAL  77           HB       VAL  77  -2.385   3.651   0.378
  624   HG11  VAL  77          1HG1      VAL  77  -4.387   4.645   1.377
  625   HG12  VAL  77          2HG1      VAL  77  -4.818   3.511   0.095
  626   HG13  VAL  77          3HG1      VAL  77  -4.882   5.248  -0.205
  627   HG21  VAL  77          3HG2      VAL  77  -3.303   4.934  -2.193
  628   HG22  VAL  77          1HG2      VAL  77  -3.334   3.204  -1.851
  629   HG23  VAL  77          2HG2      VAL  77  -1.792   4.058  -1.945
  630    H    LEU  78           HN       LEU  78  -0.947   4.880   2.186
  631    HA   LEU  78           HA       LEU  78  -2.732   5.651   4.230
  632    HB2  LEU  78           2HB      LEU  78   0.206   4.980   4.402
  633    HB3  LEU  78           1HB      LEU  78  -0.859   5.152   5.782
  634    HG   LEU  78           HG       LEU  78  -1.019   3.037   3.635
  635   HD11  LEU  78          1HD1      LEU  78  -0.553   1.505   5.471
  636   HD12  LEU  78          2HD1      LEU  78  -0.422   2.870   6.583
  637   HD13  LEU  78          3HD1      LEU  78   0.744   2.684   5.274
  638   HD21  LEU  78          3HD2      LEU  78  -2.836   3.519   5.994
  639   HD22  LEU  78          1HD2      LEU  78  -2.871   2.100   4.948
  640   HD23  LEU  78          2HD2      LEU  78  -3.263   3.689   4.292
  641    H    ASP  79           HN       ASP  79   0.168   7.188   2.918
  642    HA   ASP  79           HA       ASP  79   0.297   9.362   4.698
  643    HB2  ASP  79           2HB      ASP  79   2.153   8.980   3.245
  644    HB3  ASP  79           1HB      ASP  79   1.136   9.070   1.811
  645    H    TRP  80           HN       TRP  80  -1.361   8.995   1.586
  646    HA   TRP  80           HA       TRP  80  -2.521  11.545   1.481
  647    HB2  TRP  80           2HB      TRP  80  -2.418  10.002  -0.441
  648    HB3  TRP  80           1HB      TRP  80  -3.561   8.933   0.360
  649    HD1  TRP  80           1HD      TRP  80  -3.439  12.514  -1.118
  650    HE1  TRP  80           1HE      TRP  80  -5.799  13.102  -1.974
  651    HE3  TRP  80           3HE      TRP  80  -5.931   8.329   0.454
  652    HZ2  TRP  80           2HZ      TRP  80  -8.362  11.940  -1.982
  653    HZ3  TRP  80           3HZ      TRP  80  -8.339   8.148  -0.028
  654    HH2  TRP  80           2HH      TRP  80  -9.525   9.918  -1.220
  655    H    ALA  81           HN       ALA  81  -3.767   8.478   2.763
  656    HA   ALA  81           HA       ALA  81  -6.275   9.405   3.597
  657    HB1  ALA  81           1HB      ALA  81  -6.363   7.420   4.992
  658    HB2  ALA  81           2HB      ALA  81  -4.623   7.195   4.816
  659    HB3  ALA  81           3HB      ALA  81  -5.681   7.028   3.414
  660    H    THR  82           HN       THR  82  -3.128   9.593   5.116
  661    HA   THR  82           HA       THR  82  -3.981  10.382   7.690
  662    HB   THR  82           HB       THR  82  -1.401  11.006   6.236
  663    HG1  THR  82           1HG      THR  82  -1.671   8.785   6.531
  664   HG21  THR  82          3HG2      THR  82  -0.461  11.410   8.463
  665   HG22  THR  82          1HG2      THR  82  -2.052  11.170   9.182
  666   HG23  THR  82          2HG2      THR  82  -1.766  12.542   8.110
  667    H    VAL  83           HN       VAL  83  -2.961  12.257   4.848
  668    HA   VAL  83           HA       VAL  83  -3.370  14.805   6.022
  669    HB   VAL  83           HB       VAL  83  -3.372  14.076   3.083
  670   HG11  VAL  83          1HG1      VAL  83  -2.874  16.719   4.449
  671   HG12  VAL  83          2HG1      VAL  83  -4.292  16.294   3.491
  672   HG13  VAL  83          3HG1      VAL  83  -2.708  16.405   2.723
  673   HG21  VAL  83          3HG2      VAL  83  -1.103  14.903   4.890
  674   HG22  VAL  83          1HG2      VAL  83  -0.994  14.703   3.141
  675   HG23  VAL  83          2HG2      VAL  83  -1.341  13.311   4.168
  676    H    ARG  84           HN       ARG  84  -5.452  12.594   4.279
  677    HA   ARG  84           HA       ARG  84  -7.597  14.502   4.005
  678    HB2  ARG  84           2HB      ARG  84  -7.563  11.506   3.603
  679    HB3  ARG  84           1HB      ARG  84  -8.888  12.573   3.160
  680    HG2  ARG  84           2HG      ARG  84  -6.103  12.673   2.021
  681    HG3  ARG  84           1HG      ARG  84  -7.517  11.969   1.235
  682    HD2  ARG  84           2HD      ARG  84  -7.231  14.861   2.045
  683    HD3  ARG  84           1HD      ARG  84  -7.003  14.233   0.412
  684    HE   ARG  84           HE       ARG  84  -9.450  13.416   0.792
  685   HH11  ARG  84          1HH1      ARG  84  -8.043  16.477   1.737
  686   HH12  ARG  84          2HH1      ARG  84  -9.561  17.327   1.730
  687   HH21  ARG  84          1HH2      ARG  84 -11.425  14.502   0.762
  688   HH22  ARG  84          2HH2      ARG  84 -11.507  16.188   1.190
  689    H    GLY  85           HN       GLY  85  -6.437  12.567   6.510
  690    HA2  GLY  85           2HA      GLY  85  -7.172  12.523   8.700
  691    HA3  GLY  85           1HA      GLY  85  -8.594  13.423   8.204
  692    H    TYR  86           HN       TYR  86  -7.572  10.357   6.816
  693    HA   TYR  86           HA       TYR  86 -10.090   9.183   7.738
  694    HB2  TYR  86           2HB      TYR  86  -8.079   8.203   5.704
  695    HB3  TYR  86           1HB      TYR  86  -9.555   7.349   6.138
  696    HD1  TYR  86           2HD      TYR  86 -11.489   9.587   6.273
  697    HD2  TYR  86           1HD      TYR  86  -8.382   8.794   3.479
  698    HE1  TYR  86           2HE      TYR  86 -12.712  10.858   4.561
  699    HE2  TYR  86           1HE      TYR  86  -9.598  10.064   1.758
  700    HH   TYR  86           HH       TYR  86 -12.223  12.086   2.476
  701    H    ARG  87           HN       ARG  87  -6.750   9.157   8.403
  702    HA   ARG  87           HA       ARG  87  -7.138   7.216  10.503
  703    HB2  ARG  87           2HB      ARG  87  -5.196   5.824   9.835
  704    HB3  ARG  87           1HB      ARG  87  -6.540   5.707   8.707
  705    HG2  ARG  87           2HG      ARG  87  -5.430   7.101   7.125
  706    HG3  ARG  87           1HG      ARG  87  -4.157   7.493   8.283
  707    HD2  ARG  87           2HD      ARG  87  -4.718   4.699   7.306
  708    HD3  ARG  87           1HD      ARG  87  -3.545   5.777   6.548
  709    HE   ARG  87           HE       ARG  87  -2.400   5.814   8.756
  710   HH11  ARG  87          1HH1      ARG  87  -4.524   3.128   7.968
  711   HH12  ARG  87          2HH1      ARG  87  -3.664   1.996   8.969
  712   HH21  ARG  87          1HH2      ARG  87  -1.262   4.325  10.053
  713   HH22  ARG  87          2HH2      ARG  87  -1.820   2.682  10.163
  714    H    GLU  88           HN       GLU  88  -4.901   6.892  11.656
  715    HA   GLU  88           HA       GLU  88  -3.986   9.488  12.398
  716    HB2  GLU  88           2HB      GLU  88  -3.355   6.696  13.254
  717    HB3  GLU  88           1HB      GLU  88  -2.277   8.002  13.729
  718    HG2  GLU  88           2HG      GLU  88  -3.995   7.441  15.424
  719    HG3  GLU  88           1HG      GLU  88  -4.026   9.123  14.899
  720    H    GLY  89           HN       GLY  89  -1.502   9.787  12.692
  721    HA2  GLY  89           2HA      GLY  89  -0.619   9.977   9.933
  722    HA3  GLY  89           1HA      GLY  89   0.052  10.822  11.308
  723    H    ASP  90           HN       ASP  90  -0.280   7.477  11.757
  724    HA   ASP  90           HA       ASP  90   2.602   7.153  11.368
  725    HB2  ASP  90           2HB      ASP  90   1.621   6.483  13.558
  726    HB3  ASP  90           1HB      ASP  90   0.696   5.235  12.725
  727    H    ASN  91           HN       ASN  91   3.447   5.822   9.904
  728    HA   ASN  91           HA       ASN  91   1.558   4.513   8.059
  729    HB2  ASN  91           2HB      ASN  91   2.740   6.570   7.176
  730    HB3  ASN  91           1HB      ASN  91   4.247   5.669   7.296
  731   HD21  ASN  91          1HD2      ASN  91   2.858   6.783   4.965
  732   HD22  ASN  91          2HD2      ASN  91   2.617   5.465   3.886
  733    HA   PRO  92           HA       PRO  92   4.082   1.148   9.856
  734    HB2  PRO  92           2HB      PRO  92   1.785  -0.486   9.040
  735    HB3  PRO  92           1HB      PRO  92   2.496  -0.268  10.642
  736    HG2  PRO  92           2HG      PRO  92   0.097   0.762   9.995
  737    HG3  PRO  92           1HG      PRO  92   1.208   1.587  11.103
  738    HD2  PRO  92           2HD      PRO  92   0.676   2.125   8.205
  739    HD3  PRO  92           1HD      PRO  92   0.881   3.275   9.545
  740    H    ALA  93           HN       ALA  93   3.084   1.818   6.704
  741    HA   ALA  93           HA       ALA  93   3.954  -0.685   5.538
  742    HB1  ALA  93           1HB      ALA  93   3.510   0.383   3.390
  743    HB2  ALA  93           2HB      ALA  93   3.264   1.931   4.199
  744    HB3  ALA  93           3HB      ALA  93   2.148   0.598   4.490
  745    H    ARG  94           HN       ARG  94   5.400   2.149   6.647
  746    HA   ARG  94           HA       ARG  94   7.795   1.690   5.014
  747    HB2  ARG  94           2HB      ARG  94   6.951   3.986   4.942
  748    HB3  ARG  94           1HB      ARG  94   7.034   4.086   6.694
  749    HG2  ARG  94           2HG      ARG  94   9.455   3.844   6.599
  750    HG3  ARG  94           1HG      ARG  94   9.380   3.723   4.841
  751    HD2  ARG  94           2HD      ARG  94   8.398   6.092   6.425
  752    HD3  ARG  94           1HD      ARG  94  10.003   5.983   5.704
  753    HE   ARG  94           HE       ARG  94   8.040   5.498   3.728
  754   HH11  ARG  94          1HH1      ARG  94   9.300   8.114   5.714
  755   HH12  ARG  94          2HH1      ARG  94   8.977   9.342   4.520
  756   HH21  ARG  94          1HH2      ARG  94   7.614   7.117   2.165
  757   HH22  ARG  94          2HH2      ARG  94   7.988   8.781   2.519
  758    H    TRP  95           HN       TRP  95   9.585   0.979   5.908
  759    HA   TRP  95           HA       TRP  95   9.616   0.541   8.827
  760    HB2  TRP  95           2HB      TRP  95  10.359  -1.226   6.542
  761    HB3  TRP  95           1HB      TRP  95  11.260  -1.376   8.048
  762    HD1  TRP  95           1HD      TRP  95   9.639  -1.767  10.294
  763    HE1  TRP  95           1HE      TRP  95   7.605  -3.330  10.504
  764    HE3  TRP  95           3HE      TRP  95   8.463  -2.228   5.345
  765    HZ2  TRP  95           2HZ      TRP  95   5.730  -4.572   8.792
  766    HZ3  TRP  95           3HZ      TRP  95   6.531  -3.613   4.717
  767    HH2  TRP  95           2HH      TRP  95   5.196  -4.759   6.404
  768    H    ARG  96           HN       ARG  96  11.536   0.849   9.925
  769    HA   ARG  96           HA       ARG  96  13.648   2.232   8.436
  770    HB2  ARG  96           2HB      ARG  96  12.523   3.325  10.445
  771    HB3  ARG  96           1HB      ARG  96  13.310   2.100  11.432
  772    HG2  ARG  96           2HG      ARG  96  15.486   2.874  10.676
  773    HG3  ARG  96           1HG      ARG  96  14.704   4.088   9.665
  774    HD2  ARG  96           2HD      ARG  96  13.711   5.093  11.688
  775    HD3  ARG  96           1HD      ARG  96  14.575   3.911  12.673
  776    HE   ARG  96           HE       ARG  96  16.011   5.809  10.930
  777   HH11  ARG  96          1HH1      ARG  96  15.421   4.396  14.091
  778   HH12  ARG  96          2HH1      ARG  96  16.789   5.182  14.823
  779   HH21  ARG  96          1HH2      ARG  96  17.794   6.836  11.886
  780   HH22  ARG  96          2HH2      ARG  96  18.154   6.556  13.570
  781    H    GLY  97           HN       GLY  97  12.815  -0.613  10.142
  782    HA2  GLY  97           2HA      GLY  97  15.574  -1.598   9.772
  783    HA3  GLY  97           1HA      GLY  97  14.625  -2.014  11.193
  784    H    TYR  98           HN       TYR  98  12.840  -3.386  10.984
  785    HA   TYR  98           HA       TYR  98  11.764  -5.247  10.317
  786    HB2  TYR  98           2HB      TYR  98  10.852  -3.777   8.588
  787    HB3  TYR  98           1HB      TYR  98  12.215  -4.154   7.537
  788    HD1  TYR  98           2HD      TYR  98   9.891  -6.221   9.619
  789    HD2  TYR  98           1HD      TYR  98  11.557  -5.494   5.771
  790    HE1  TYR  98           2HE      TYR  98   8.673  -8.164   8.733
  791    HE2  TYR  98           1HE      TYR  98  10.344  -7.438   4.874
  792    HH   TYR  98           HH       TYR  98   7.928  -9.130   6.727
  793    H    LEU  99           HN       LEU  99  14.098  -4.969   7.623
  794    HA   LEU  99           HA       LEU  99  14.548  -7.771   7.547
  795    HB2  LEU  99           2HB      LEU  99  16.100  -5.496   6.311
  796    HB3  LEU  99           1HB      LEU  99  16.394  -7.190   5.972
  797    HG   LEU  99           HG       LEU  99  13.827  -5.717   5.378
  798   HD11  LEU  99          1HD1      LEU  99  15.686  -5.003   3.960
  799   HD12  LEU  99          2HD1      LEU  99  14.494  -5.927   3.046
  800   HD13  LEU  99          3HD1      LEU  99  16.010  -6.683   3.536
  801   HD21  LEU  99          3HD2      LEU  99  13.200  -7.737   4.170
  802   HD22  LEU  99          1HD2      LEU  99  13.481  -8.089   5.876
  803   HD23  LEU  99          2HD2      LEU  99  14.699  -8.518   4.674
  804    H    GLU 100           HN       GLU 100  16.256  -5.081   8.995
  805    HA   GLU 100           HA       GLU 100  17.750  -4.967  10.691
  806    HB2  GLU 100           2HB      GLU 100  16.475  -6.766  11.758
  807    HB3  GLU 100           1HB      GLU 100  17.415  -7.963  10.877
  808    HG2  GLU 100           2HG      GLU 100  19.453  -7.063  12.010
  809    HG3  GLU 100           1HG      GLU 100  18.385  -6.070  12.999
  810    H    HIS 101           HN       HIS 101  18.574  -8.034   9.026
  811    HA   HIS 101           HA       HIS 101  21.370  -7.576   9.302
  812    HB2  HIS 101           2HB      HIS 101  20.299  -9.829   9.090
  813    HB3  HIS 101           1HB      HIS 101  19.984  -9.476   7.396
  814    HD1  HIS 101           1HD      HIS 101  21.522 -11.089   6.243
  815    HD2  HIS 101           2HD      HIS 101  23.439  -8.926   9.240
  816    HE1  HIS 101           1HE      HIS 101  23.954 -11.703   6.083
  817    HE2  HIS 101           2HE      HIS 101  25.116 -10.222   7.751
  818    H    HIS 102           HN       HIS 102  22.410  -6.016   8.291
  819    HA   HIS 102           HA       HIS 102  21.417  -5.034   5.733
  820    HB2  HIS 102           2HB      HIS 102  22.861  -3.092   6.109
  821    HB3  HIS 102           1HB      HIS 102  21.815  -3.376   7.492
  822    HD1  HIS 102           1HD      HIS 102  25.209  -2.584   6.701
  823    HD2  HIS 102           2HD      HIS 102  23.341  -4.895   9.615
  824    HE1  HIS 102           1HE      HIS 102  26.906  -2.872   8.536
  825    HE2  HIS 102           2HE      HIS 102  25.795  -4.370  10.231
  826    H    HIS 103           HN       HIS 103  22.484  -5.124   3.858
  827    HA   HIS 103           HA       HIS 103  25.247  -6.152   3.867
  828    HB2  HIS 103           2HB      HIS 103  22.939  -6.751   2.056
  829    HB3  HIS 103           1HB      HIS 103  24.571  -6.792   1.402
  830    HD1  HIS 103           1HD      HIS 103  22.164  -9.018   2.612
  831    HD2  HIS 103           2HD      HIS 103  26.236  -8.536   3.339
  832    HE1  HIS 103           1HE      HIS 103  22.978 -11.245   3.442
  833    HE2  HIS 103           2HE      HIS 103  25.482 -10.992   3.642
  834    H    HIS 104           HN       HIS 104  26.580  -4.487   3.463
  835    HA   HIS 104           HA       HIS 104  25.663  -2.329   1.724
  836    HB2  HIS 104           2HB      HIS 104  26.955  -1.873   3.860
  837    HB3  HIS 104           1HB      HIS 104  28.363  -2.569   3.066
  838    HD1  HIS 104           1HD      HIS 104  29.789  -0.968   1.793
  839    HD2  HIS 104           2HD      HIS 104  25.927   0.478   2.375
  840    HE1  HIS 104           1HE      HIS 104  29.792   1.378   0.882
  841    HE2  HIS 104           2HE      HIS 104  27.486   2.281   1.363
  842    H    HIS 105           HN       HIS 105  25.517  -3.578  -0.161
  843    HA   HIS 105           HA       HIS 105  28.110  -4.297  -1.351
  844    HB2  HIS 105           2HB      HIS 105  26.508  -6.211  -0.705
  845    HB3  HIS 105           1HB      HIS 105  25.490  -5.638  -2.018
  846    HD1  HIS 105           1HD      HIS 105  25.751  -7.276  -3.850
  847    HD2  HIS 105           2HD      HIS 105  29.379  -6.367  -2.041
  848    HE1  HIS 105           1HE      HIS 105  27.497  -8.514  -5.174
  849    HE2  HIS 105           2HE      HIS 105  29.643  -8.144  -3.905
  850    H    HIS 106           HN       HIS 106  28.439  -3.700  -3.452
  851    HA   HIS 106           HA       HIS 106  28.519  -2.034  -4.962
  852    HB2  HIS 106           2HB      HIS 106  26.686  -1.991  -6.603
  853    HB3  HIS 106           1HB      HIS 106  27.201  -3.622  -6.217
  854    HD1  HIS 106           1HD      HIS 106  24.398  -1.226  -5.305
  855    HD2  HIS 106           2HD      HIS 106  25.147  -5.296  -5.633
  856    HE1  HIS 106           1HE      HIS 106  22.166  -2.350  -4.993
  857    HE2  HIS 106           2HE      HIS 106  22.625  -4.813  -5.303