*HEADER    DE NOVO PROTEIN                         19-AUG-14   2MTL              
*TITLE     SOLUTION NMR STRUCTURE OF DE NOVO DESIGNED FR55, NORTHEAST STRUCTURAL 
*TITLE    2 GENOMICS CONSORTIUM (NESG) TARGET OR109                              
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: DE NOVO DESIGNED PROTEIN FR55 OR109;                       
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ARTIFICIAL GENE;                                
*SOURCE   3 ORGANISM_TAXID: 32630;                                               
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)PMGK;                             
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR: PET29B+                                    
*KEYWDS    STRUCTURAL GENOMICS, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM, NESG,  
*KEYWDS   2 PSI-BIOLOGY, PROTEIN STRUCTURE INITIATIVE, DE NOVO PROTEIN           
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    G.LIU, N.KOGA, R.KOGA, R.XIAO, K.HAMILTON, C.CICCOSANTI, S.SAHDEV,    
*AUTHOR   2 E.KOHAN, T.B.ACTON, G.KORNHABER, J.K.EVERETT, D.BAKER,               
*AUTHOR   3 G.T.MONTELIONE, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM (NESG)      
*REVDAT   1   29-OCT-14 2MTL    0                                                


 assign ((resid   3 and name HN   ))   ( (resid   4 and name HN   ))     4.47  2.67  0.67
 assign ((resid   3 and name HA   ))   ( (resid   4 and name HN   ))     3.25  1.45  0.49
 assign ((resid   3 and name HB2  ))   ( (resid   4 and name HN   ))     4.18  2.38  0.63
 assign ((resid   3 and name HB1  ))   ( (resid   4 and name HN   ))     4.18  2.38  0.63
 assign ((resid   3 and name HG*  ))   ( (resid   4 and name HN   ))     3.72  1.92  0.56
 assign ((resid   4 and name HB2  ))   ( (resid   5 and name HN   ))     4.70  2.90  0.70
 assign ((resid   4 and name HB1  ))   ( (resid   5 and name HN   ))     4.61  2.81  0.69
 assign ((resid   5 and name HN   ))   ( (resid   6 and name HN   ))     5.51  3.71  0.83
 assign ((resid   5 and name HB2  ))   ( (resid   6 and name HN   ))     4.61  2.81  0.69
 assign ((resid   6 and name HA   ))   ( (resid   7 and name HN   ))     3.15  1.35  0.47
 assign ((resid   6 and name HB   ))   ( (resid   7 and name HN   ))     4.37  2.57  0.66
 assign ((resid   6 and name HG2* ))   ( (resid   7 and name HN   ))     3.47  1.67  0.52
 assign ((resid   7 and name HA   ))   ( (resid   8 and name HN   ))     3.29  1.49  0.49
 assign ((resid   7 and name HB2  ))   ( (resid   8 and name HN   ))     4.58  2.78  0.69
 assign ((resid   8 and name HN   ))   ( (resid   9 and name HN   ))     4.54  2.74  0.68
 assign ((resid   8 and name HA   ))   ( (resid   9 and name HN   ))     2.78  0.98  0.42
 assign ((resid   8 and name HB*  ))   ( (resid   9 and name HN   ))     3.60  1.80  0.54
 assign ((resid   8 and name HD*  ))   ( (resid   9 and name HN   ))     3.98  2.18  0.60
 assign ((resid  10 and name HA1  ))   ( (resid  11 and name HN   ))     2.81  1.01  0.42
 assign ((resid  10 and name HA2  ))   ( (resid  11 and name HN   ))     2.80  1.00  0.42
 assign ((resid  11 and name HB1  ))   ( (resid  12 and name HN   ))     3.76  1.96  0.56
 assign ((resid  12 and name HA   ))   ( (resid  13 and name HN   ))     2.77  0.97  0.42
 assign ((resid  12 and name HB2  ))   ( (resid  13 and name HN   ))     4.65  2.85  0.70
 assign ((resid  12 and name HB1  ))   ( (resid  13 and name HN   ))     4.65  2.85  0.70
 assign ((resid  13 and name HN   ))   ( (resid  14 and name HN   ))     3.27  1.47  0.49
 assign ((resid  13 and name HB2  ))   ( (resid  14 and name HN   ))     4.46  2.66  0.67
 assign ((resid  13 and name HB1  ))   ( (resid  14 and name HN   ))     3.27  1.47  0.49
 assign ((resid  13 and name HG   ))   ( (resid  14 and name HN   ))     4.90  3.10  0.74
 assign ((resid  13 and name HD1* ))   ( (resid  14 and name HN   ))     5.08  3.28  0.76
 assign ((resid  13 and name HD2* ))   ( (resid  14 and name HN   ))     5.08  3.28  0.76
 assign ((resid  14 and name HB1  ))   ( (resid  15 and name HN   ))     3.53  1.73  0.53
 assign ((resid  14 and name HB2  ))   ( (resid  15 and name HN   ))     3.21  1.41  0.48
 assign ((resid  15 and name HN   ))   ( (resid  16 and name HN   ))     2.93  1.13  0.44
 assign ((resid  16 and name HB2  ))   ( (resid  17 and name HN   ))     3.69  1.89  0.55
 assign ((resid  16 and name HB1  ))   ( (resid  17 and name HN   ))     4.14  2.34  0.62
 assign ((resid  16 and name HG   ))   ( (resid  17 and name HN   ))     4.55  2.75  0.68
 assign ((resid  17 and name HN   ))   ( (resid  43 and name HD2* ))     5.57  3.77  0.84
 assign ((resid  16 and name HD2* ))   ( (resid  17 and name HN   ))     5.15  3.35  0.77
 assign ((resid  17 and name HB1  ))   ( (resid  18 and name HN   ))     5.31  3.51  0.80
 assign ((resid  18 and name HB1  ))   ( (resid  19 and name HN   ))     3.77  1.97  0.57
 assign ((resid  18 and name HB2  ))   ( (resid  19 and name HN   ))     3.37  1.57  0.51
 assign ((resid  19 and name HN   ))   ( (resid  20 and name HN   ))     3.12  1.32  0.47
 assign ((resid  19 and name HB*  ))   ( (resid  20 and name HN   ))     3.02  1.22  0.45
 assign ((resid  22 and name HB2  ))   ( (resid  23 and name HN   ))     3.51  1.71  0.53
 assign ((resid  22 and name HG2  ))   ( (resid  23 and name HN   ))     4.19  2.39  0.63
 assign ((resid  23 and name HN   ))   ( (resid  24 and name HN   ))     2.94  1.14  0.44
 assign ((resid   6 and name HA   ))   ( (resid  74 and name HN   ))     5.52  3.72  0.83
 assign ((resid  23 and name HB1  ))   ( (resid  24 and name HN   ))     3.84  2.04  0.58
 assign ((resid  23 and name HB2  ))   ( (resid  24 and name HN   ))     4.04  2.24  0.61
 assign ((resid  23 and name HG1  ))   ( (resid  24 and name HN   ))     5.88  4.08  0.88
 assign ((resid  74 and name HN   ))   ( (resid  75 and name HB1  ))     6.00  4.20  0.90
 assign ((resid  23 and name HE*  ))   ( (resid  24 and name HN   ))     5.07  3.27  0.76
 assign ((resid  24 and name HN   ))   ( (resid  25 and name HB2  ))     5.53  3.73  0.83
 assign ((resid  24 and name HN   ))   ( (resid  25 and name HN   ))     3.07  1.27  0.46
 assign ((resid  24 and name HB   ))   ( (resid  25 and name HN   ))     3.06  1.26  0.46
 assign ((resid  24 and name HG2* ))   ( (resid  25 and name HN   ))     3.20  1.40  0.48
 assign ((resid  24 and name HG11 ))   ( (resid  25 and name HN   ))     4.43  2.63  0.66
 assign ((resid  24 and name HD1* ))   ( (resid  25 and name HN   ))     4.34  2.54  0.65
 assign ((resid  26 and name HN   ))   ( (resid  26 and name HE21 ))     4.11  2.31  0.62
 assign ((resid  25 and name HB2  ))   ( (resid  26 and name HN   ))     3.61  1.81  0.54
 assign ((resid  25 and name HB1  ))   ( (resid  26 and name HN   ))     3.76  1.96  0.56
 assign ((resid  26 and name HN   ))   ( (resid  28 and name HG1  ))     5.54  3.74  0.83
 assign ((resid  26 and name HN   ))   ( (resid  27 and name HN   ))     3.16  1.36  0.47
 assign ((resid  26 and name HB2  ))   ( (resid  27 and name HN   ))     3.85  2.05  0.58
 assign ((resid  26 and name HB1  ))   ( (resid  27 and name HN   ))     3.65  1.85  0.55
 assign ((resid  25 and name HA   ))   ( (resid  28 and name HN   ))     4.11  2.31  0.62
 assign ((resid  27 and name HB*  ))   ( (resid  28 and name HN   ))     3.39  1.59  0.51
 assign ((resid  28 and name HB2  ))   ( (resid  29 and name HN   ))     3.57  1.77  0.54
 assign ((resid  25 and name HG2  ))   ( (resid  29 and name HN   ))     4.90  3.10  0.74
 assign ((resid  28 and name HG2  ))   ( (resid  29 and name HN   ))     5.01  3.21  0.75
 assign ((resid  29 and name HN   ))   ( (resid  30 and name HN   ))     3.22  1.42  0.48
 assign ((resid  29 and name HG2  ))   ( (resid  30 and name HN   ))     4.79  2.99  0.72
 assign ((resid  29 and name HG1  ))   ( (resid  30 and name HN   ))     4.79  2.99  0.72
 assign ((resid  30 and name HA   ))   ( (resid  31 and name HN   ))     3.55  1.75  0.53
 assign ((resid  30 and name HB2  ))   ( (resid  31 and name HN   ))     4.48  2.68  0.67
 assign ((resid  30 and name HB1  ))   ( (resid  31 and name HN   ))     4.48  2.68  0.67
 assign ((resid  30 and name HD*  ))   ( (resid  31 and name HN   ))     4.89  3.09  0.73
 assign ((resid  31 and name HN   ))   ( (resid  32 and name HN   ))     3.41  1.61  0.51
 assign ((resid  31 and name HA   ))   ( (resid  32 and name HN   ))     3.25  1.45  0.49
 assign ((resid  32 and name HA1  ))   ( (resid  33 and name HN   ))     3.54  1.74  0.53
 assign ((resid  33 and name HA   ))   ( (resid  34 and name HN   ))     2.75  0.95  0.41
 assign ((resid  34 and name HA   ))   ( (resid  35 and name HN   ))     2.90  1.10  0.44
 assign ((resid  34 and name HB   ))   ( (resid  35 and name HN   ))     4.33  2.53  0.65
 assign ((resid  34 and name HG2* ))   ( (resid  35 and name HN   ))     3.38  1.58  0.51
 assign ((resid  35 and name HA   ))   ( (resid  36 and name HN   ))     2.96  1.16  0.44
 assign ((resid  35 and name HB   ))   ( (resid  36 and name HN   ))     3.58  1.78  0.54
 assign ((resid  35 and name HG2* ))   ( (resid  36 and name HN   ))     3.44  1.64  0.52
 assign ((resid  36 and name HN   ))   ( (resid  37 and name HN   ))     4.73  2.93  0.71
 assign ((resid  36 and name HA   ))   ( (resid  37 and name HN   ))     3.09  1.29  0.46
 assign ((resid  36 and name HB1  ))   ( (resid  37 and name HN   ))     4.33  2.53  0.65
 assign ((resid  36 and name HB2  ))   ( (resid  37 and name HN   ))     3.70  1.90  0.56
 assign ((resid  40 and name HN   ))   ( (resid  41 and name HN   ))     5.58  3.78  0.84
 assign ((resid  42 and name HN   ))   ( (resid  43 and name HN   ))     4.94  3.14  0.74
 assign ((resid  42 and name HA   ))   ( (resid  43 and name HN   ))     2.91  1.11  0.44
 assign ((resid  42 and name HB2  ))   ( (resid  43 and name HN   ))     4.20  2.40  0.63
 assign ((resid  42 and name HB1  ))   ( (resid  43 and name HN   ))     4.20  2.40  0.63
 assign ((resid  43 and name HN   ))   ( (resid  44 and name HN   ))     4.37  2.57  0.66
 assign ((resid  43 and name HB1  ))   ( (resid  44 and name HN   ))     4.56  2.76  0.68
 assign ((resid  43 and name HG   ))   ( (resid  44 and name HN   ))     4.66  2.86  0.70
 assign ((resid  46 and name HN   ))   ( (resid  47 and name HG11 ))     5.10  3.30  0.77
 assign ((resid  38 and name HD2* ))   ( (resid  44 and name HN   ))     4.37  2.57  0.66
 assign ((resid  44 and name HA   ))   ( (resid  45 and name HN   ))     3.09  1.29  0.46
 assign ((resid  44 and name HB2  ))   ( (resid  45 and name HN   ))     4.42  2.62  0.66
 assign ((resid  44 and name HB1  ))   ( (resid  45 and name HN   ))     4.47  2.67  0.67
 assign ((resid  44 and name HG2  ))   ( (resid  45 and name HN   ))     4.13  2.33  0.62
 assign ((resid  44 and name HG1  ))   ( (resid  45 and name HN   ))     4.13  2.33  0.62
 assign ((resid  45 and name HA   ))   ( (resid  46 and name HN   ))     3.17  1.37  0.48
 assign ((resid  45 and name HG2* ))   ( (resid  46 and name HN   ))     3.29  1.49  0.49
 assign ((resid  44 and name HN   ))   ( (resid  45 and name HG11 ))     4.59  2.79  0.69
 assign ((resid  46 and name HA   ))   ( (resid  47 and name HN   ))     3.29  1.49  0.49
 assign ((resid  46 and name HB1  ))   ( (resid  47 and name HN   ))     4.35  2.55  0.65
 assign ((resid  46 and name HB2  ))   ( (resid  47 and name HN   ))     4.47  2.67  0.67
 assign ((resid  46 and name HG*  ))   ( (resid  47 and name HN   ))     4.75  2.95  0.71
 assign ((resid  47 and name HA   ))   ( (resid  48 and name HN   ))     3.21  1.41  0.48
 assign ((resid  47 and name HB   ))   ( (resid  48 and name HN   ))     4.44  2.64  0.67
 assign ((resid  47 and name HG11 ))   ( (resid  48 and name HN   ))     4.87  3.07  0.73
 assign ((resid  47 and name HG12 ))   ( (resid  48 and name HN   ))     4.78  2.98  0.72
 assign ((resid  47 and name HG2* ))   ( (resid  48 and name HN   ))     3.53  1.73  0.53
 assign ((resid  48 and name HA   ))   ( (resid  49 and name HN   ))     3.49  1.69  0.52
 assign ((resid  48 and name HB   ))   ( (resid  49 and name HN   ))     3.59  1.79  0.54
 assign ((resid  51 and name HD2  ))   ( (resid  54 and name HN   ))     4.69  2.89  0.70
 assign ((resid  53 and name HG1  ))   ( (resid  54 and name HN   ))     4.64  2.84  0.70
 assign ((resid  54 and name HN   ))   ( (resid  55 and name HN   ))     3.40  1.60  0.51
 assign ((resid  54 and name HG2* ))   ( (resid  55 and name HN   ))     4.18  2.38  0.63
 assign ((resid  54 and name HG1* ))   ( (resid  55 and name HN   ))     4.35  2.55  0.65
 assign ((resid  55 and name HB2  ))   ( (resid  56 and name HN   ))     3.94  2.14  0.59
 assign ((resid  55 and name HG2  ))   ( (resid  56 and name HN   ))     5.34  3.54  0.80
 assign ((resid  55 and name HG1  ))   ( (resid  56 and name HN   ))     4.77  2.97  0.72
 assign ((resid  56 and name HN   ))   ( (resid  57 and name HN   ))     3.30  1.50  0.50
 assign ((resid  56 and name HB2  ))   ( (resid  57 and name HN   ))     3.28  1.48  0.49
 assign ((resid  56 and name HB1  ))   ( (resid  57 and name HN   ))     4.06  2.26  0.61
 assign ((resid  56 and name HG1  ))   ( (resid  57 and name HN   ))     4.52  2.72  0.68
 assign ((resid  56 and name HG2  ))   ( (resid  57 and name HN   ))     4.79  2.99  0.72
 assign ((resid  56 and name HD*  ))   ( (resid  57 and name HN   ))     5.70  3.90  0.86
 assign ((resid  57 and name HN   ))   ( (resid  60 and name HD*  ))     5.94  4.14  0.89
 assign ((resid  57 and name HN   ))   ( (resid  58 and name HN   ))     3.19  1.39  0.48
 assign ((resid  57 and name HB2  ))   ( (resid  58 and name HN   ))     3.36  1.56  0.50
 assign ((resid  58 and name HB2  ))   ( (resid  59 and name HN   ))     3.77  1.97  0.57
 assign ((resid  58 and name HB1  ))   ( (resid  59 and name HN   ))     4.24  2.44  0.64
 assign ((resid   4 and name HE*  ))   ( (resid  59 and name HN   ))     3.50  1.70  0.53
 assign ((resid  59 and name HN   ))   ( (resid  77 and name HD1* ))     4.04  2.24  0.61
 assign ((resid  58 and name HD2* ))   ( (resid  59 and name HN   ))     4.25  2.45  0.64
 assign ((resid  59 and name HB*  ))   ( (resid  60 and name HN   ))     3.38  1.58  0.51
 assign ((resid  60 and name HN   ))   ( (resid  61 and name HN   ))     3.17  1.37  0.48
 assign ((resid  60 and name HB1  ))   ( (resid  61 and name HN   ))     3.50  1.70  0.53
 assign ((resid  60 and name HB2  ))   ( (resid  61 and name HN   ))     3.01  1.21  0.45
 assign ((resid  60 and name HG2  ))   ( (resid  61 and name HN   ))     5.21  3.41  0.78
 assign ((resid  61 and name HN   ))   ( (resid  62 and name HB*  ))     4.38  2.58  0.66
 assign ((resid  60 and name HD*  ))   ( (resid  61 and name HN   ))     4.44  2.64  0.67
 assign ((resid  61 and name HN   ))   ( (resid  62 and name HN   ))     3.09  1.29  0.46
 assign ((resid  61 and name HB2  ))   ( (resid  62 and name HN   ))     3.66  1.86  0.55
 assign ((resid  61 and name HG*  ))   ( (resid  62 and name HN   ))     4.00  2.20  0.60
 assign ((resid  62 and name HB*  ))   ( (resid  63 and name HN   ))     3.09  1.29  0.46
 assign ((resid  63 and name HB1  ))   ( (resid  64 and name HN   ))     3.39  1.59  0.51
 assign ((resid  63 and name HB2  ))   ( (resid  64 and name HN   ))     3.31  1.51  0.50
 assign ((resid  64 and name HG2  ))   ( (resid  65 and name HN   ))     4.33  2.53  0.65
 assign ((resid  64 and name HG1  ))   ( (resid  65 and name HN   ))     4.34  2.54  0.65
 assign ((resid  65 and name HN   ))   ( (resid  66 and name HN   ))     3.11  1.31  0.47
 assign ((resid  65 and name HB1  ))   ( (resid  66 and name HN   ))     3.62  1.82  0.54
 assign ((resid  65 and name HB2  ))   ( (resid  66 and name HN   ))     3.41  1.61  0.51
 assign ((resid  65 and name HG   ))   ( (resid  66 and name HN   ))     4.64  2.84  0.70
 assign ((resid  66 and name HB*  ))   ( (resid  67 and name HN   ))     2.96  1.16  0.44
 assign ((resid  67 and name HA   ))   ( (resid  68 and name HN   ))     3.55  1.75  0.53
 assign ((resid  67 and name HG2  ))   ( (resid  68 and name HN   ))     3.99  2.19  0.60
 assign ((resid  67 and name HD*  ))   ( (resid  68 and name HN   ))     4.19  2.39  0.63
 assign ((resid  68 and name HB1  ))   ( (resid  69 and name HN   ))     3.13  1.33  0.47
 assign ((resid  68 and name HG1  ))   ( (resid  69 and name HN   ))     3.51  1.71  0.53
 assign ((resid  69 and name HN   ))   ( (resid  70 and name HN   ))     2.76  0.96  0.41
 assign ((resid  69 and name HA   ))   ( (resid  70 and name HN   ))     3.39  1.59  0.51
 assign ((resid  69 and name HB2  ))   ( (resid  70 and name HN   ))     4.12  2.32  0.62
 assign ((resid  69 and name HB1  ))   ( (resid  70 and name HN   ))     4.41  2.61  0.66
 assign ((resid  69 and name HD*  ))   ( (resid  70 and name HN   ))     4.67  2.87  0.70
 assign ((resid  70 and name HA   ))   ( (resid  71 and name HN   ))     2.89  1.09  0.43
 assign ((resid  70 and name HB1  ))   ( (resid  71 and name HN   ))     4.25  2.45  0.64
 assign ((resid  71 and name HN   ))   ( (resid  72 and name HN   ))     4.51  2.71  0.68
 assign ((resid  71 and name HA   ))   ( (resid  72 and name HN   ))     3.02  1.22  0.45
 assign ((resid  71 and name HB   ))   ( (resid  72 and name HN   ))     3.02  1.22  0.45
 assign ((resid  71 and name HG2* ))   ( (resid  72 and name HN   ))     3.70  1.90  0.56
 assign ((resid  71 and name HG11 ))   ( (resid  72 and name HN   ))     4.26  2.46  0.64
 assign ((resid  71 and name HD1* ))   ( (resid  72 and name HN   ))     4.34  2.54  0.65
 assign ((resid  72 and name HN   ))   ( (resid  73 and name HN   ))     4.72  2.92  0.71
 assign ((resid  72 and name HA   ))   ( (resid  73 and name HN   ))     2.64  0.84  0.40
 assign ((resid  73 and name HN   ))   ( (resid  74 and name HN   ))     4.40  2.60  0.66
 assign ((resid  73 and name HA   ))   ( (resid  74 and name HN   ))     2.74  0.94  0.41
 assign ((resid  73 and name HG1* ))   ( (resid  74 and name HN   ))     4.02  2.22  0.60
 assign ((resid  73 and name HG2* ))   ( (resid  74 and name HN   ))     2.93  1.13  0.44
 assign ((resid  74 and name HN   ))   ( (resid  75 and name HN   ))     4.38  2.58  0.66
 assign ((resid  74 and name HA   ))   ( (resid  75 and name HN   ))     2.84  1.04  0.43
 assign ((resid  75 and name HN   ))   ( (resid  76 and name HN   ))     4.60  2.80  0.69
 assign ((resid  75 and name HA   ))   ( (resid  76 and name HN   ))     3.13  1.33  0.47
 assign ((resid  75 and name HD*  ))   ( (resid  76 and name HN   ))     4.15  2.35  0.62
 assign ((resid  76 and name HB   ))   ( (resid  77 and name HN   ))     4.33  2.53  0.65
 assign ((resid  76 and name HG2* ))   ( (resid  77 and name HN   ))     3.84  2.04  0.58
 assign ((resid  77 and name HN   ))   ( (resid  78 and name HN   ))     4.49  2.69  0.67
 assign ((resid  77 and name HA   ))   ( (resid  78 and name HN   ))     3.17  1.37  0.48
 assign ((resid  77 and name HB   ))   ( (resid  78 and name HN   ))     3.75  1.95  0.56
 assign ((resid  77 and name HG11 ))   ( (resid  78 and name HN   ))     4.87  3.07  0.73
 assign ((resid  77 and name HG2* ))   ( (resid  78 and name HN   ))     3.54  1.74  0.53
 assign ((resid  81 and name HA   ))   ( (resid  82 and name HN   ))     3.55  1.75  0.53
 assign ((resid  81 and name HB2  ))   ( (resid  82 and name HN   ))     4.26  2.46  0.64
 assign ((resid  81 and name HG   ))   ( (resid  82 and name HN   ))     5.05  3.25  0.76
 assign ((resid  81 and name HD1* ))   ( (resid  82 and name HN   ))     5.40  3.60  0.81
 assign ((resid  81 and name HD2* ))   ( (resid  82 and name HN   ))     4.91  3.11  0.74
 assign ((resid  41 and name HN   ))   ( (resid  41 and name HD21 ))     5.12  3.32  0.77
 assign ((resid  41 and name HA   ))   ( (resid  41 and name HD21 ))     3.92  2.12  0.59
 assign ((resid  41 and name HB1  ))   ( (resid  41 and name HD21 ))     3.46  1.66  0.52
 assign ((resid  41 and name HN   ))   ( (resid  41 and name HD22 ))     5.46  3.66  0.82
 assign ((resid  41 and name HA   ))   ( (resid  41 and name HD22 ))     4.16  2.36  0.62
 assign ((resid  41 and name HB1  ))   ( (resid  41 and name HD22 ))     3.62  1.82  0.54
 assign ((resid  70 and name HB1  ))   ( (resid  70 and name HD21 ))     3.20  1.40  0.48
 assign ((resid  70 and name HA   ))   ( (resid  70 and name HD22 ))     4.85  3.05  0.73
 assign ((resid  70 and name HB1  ))   ( (resid  70 and name HD22 ))     3.89  2.09  0.58
 assign ((resid  26 and name HA   ))   ( (resid  26 and name HE21 ))     4.71  2.91  0.71
 assign ((resid  26 and name HG2  ))   ( (resid  26 and name HE21 ))     3.47  1.67  0.52
 assign ((resid  26 and name HA   ))   ( (resid  26 and name HE22 ))     4.56  2.76  0.68
 assign ((resid  26 and name HB1  ))   ( (resid  26 and name HE22 ))     4.91  3.11  0.74
 assign ((resid  26 and name HE22 ))   ( (resid  61 and name HB1  ))     5.39  3.59  0.81
 assign ((resid  26 and name HG2  ))   ( (resid  26 and name HE22 ))     3.53  1.73  0.53
 assign ((resid  53 and name HG1  ))   ( (resid  53 and name HE22 ))     3.65  1.85  0.55
 assign ((resid   3 and name HN   ))   ( (resid   3 and name HG*  ))     4.32  2.52  0.65
 assign ((resid   4 and name HN   ))   ( (resid   4 and name HB2  ))     3.99  2.19  0.60
 assign ((resid   4 and name HN   ))   ( (resid   4 and name HB1  ))     4.16  2.36  0.62
 assign ((resid   4 and name HN   ))   ( (resid   4 and name HG*  ))     4.60  2.80  0.69
 assign ((resid   6 and name HN   ))   ( (resid   6 and name HB   ))     3.87  2.07  0.58
 assign ((resid   6 and name HN   ))   ( (resid   6 and name HG2* ))     4.50  2.70  0.68
 assign ((resid   6 and name HN   ))   ( (resid   6 and name HG11 ))     4.04  2.24  0.61
 assign ((resid   6 and name HN   ))   ( (resid   6 and name HG12 ))     4.42  2.62  0.66
 assign ((resid   7 and name HN   ))   ( (resid   7 and name HB2  ))     3.75  1.95  0.56
 assign ((resid   7 and name HN   ))   ( (resid   7 and name HB1  ))     3.75  1.95  0.56
 assign ((resid   7 and name HN   ))   ( (resid   7 and name HG2  ))     4.92  3.12  0.74
 assign ((resid   7 and name HN   ))   ( (resid   7 and name HG1  ))     4.92  3.12  0.74
 assign ((resid   8 and name HN   ))   ( (resid   8 and name HB*  ))     3.87  2.07  0.58
 assign ((resid   8 and name HN   ))   ( (resid   8 and name HD*  ))     4.23  2.43  0.63
 assign ((resid   9 and name HN   ))   ( (resid   9 and name HB2  ))     3.70  1.90  0.56
 assign ((resid   9 and name HN   ))   ( (resid   9 and name HB1  ))     3.70  1.90  0.56
 assign ((resid   9 and name HN   ))   ( (resid   9 and name HG*  ))     4.11  2.31  0.62
 assign ((resid  11 and name HN   ))   ( (resid  11 and name HB1  ))     2.83  1.03  0.42
 assign ((resid  11 and name HN   ))   ( (resid  11 and name HB2  ))     3.03  1.23  0.45
 assign ((resid  12 and name HN   ))   ( (resid  12 and name HB2  ))     3.05  1.25  0.46
 assign ((resid  12 and name HN   ))   ( (resid  12 and name HB1  ))     3.05  1.25  0.46
 assign ((resid  13 and name HN   ))   ( (resid  13 and name HB2  ))     3.08  1.28  0.46
 assign ((resid  13 and name HN   ))   ( (resid  13 and name HB1  ))     2.96  1.16  0.44
 assign ((resid  13 and name HN   ))   ( (resid  13 and name HG   ))     4.67  2.87  0.70
 assign ((resid  13 and name HN   ))   ( (resid  13 and name HD2* ))     4.49  2.69  0.67
 assign ((resid  14 and name HN   ))   ( (resid  14 and name HB2  ))     2.85  1.05  0.43
 assign ((resid  14 and name HN   ))   ( (resid  14 and name HG2  ))     3.90  2.10  0.59
 assign ((resid  14 and name HN   ))   ( (resid  14 and name HG1  ))     3.90  2.10  0.59
 assign ((resid  15 and name HN   ))   ( (resid  15 and name HB*  ))     2.58  0.78  0.39
 assign ((resid  16 and name HN   ))   ( (resid  16 and name HB2  ))     3.55  1.75  0.53
 assign ((resid  16 and name HN   ))   ( (resid  16 and name HB1  ))     3.80  2.00  0.57
 assign ((resid  16 and name HN   ))   ( (resid  16 and name HD1* ))     3.80  2.00  0.57
 assign ((resid  16 and name HN   ))   ( (resid  16 and name HD2* ))     3.74  1.94  0.56
 assign ((resid  17 and name HN   ))   ( (resid  17 and name HB1  ))     4.03  2.23  0.60
 assign ((resid  17 and name HN   ))   ( (resid  17 and name HB2  ))     3.49  1.69  0.52
 assign ((resid  17 and name HN   ))   ( (resid  17 and name HG2  ))     3.65  1.85  0.55
 assign ((resid  17 and name HN   ))   ( (resid  17 and name HG1  ))     3.65  1.85  0.55
 assign ((resid  19 and name HN   ))   ( (resid  19 and name HB*  ))     2.78  0.98  0.42
 assign ((resid  20 and name HN   ))   ( (resid  20 and name HB1  ))     3.10  1.30  0.47
 assign ((resid  20 and name HN   ))   ( (resid  20 and name HB2  ))     3.18  1.38  0.48
 assign ((resid  20 and name HN   ))   ( (resid  20 and name HD1* ))     4.40  2.60  0.66
 assign ((resid  20 and name HN   ))   ( (resid  20 and name HD2* ))     4.40  2.60  0.66
 assign ((resid  23 and name HN   ))   ( (resid  23 and name HB1  ))     3.62  1.82  0.54
 assign ((resid  23 and name HN   ))   ( (resid  23 and name HB2  ))     3.22  1.42  0.48
 assign ((resid  23 and name HN   ))   ( (resid  23 and name HG1  ))     3.74  1.94  0.56
 assign ((resid  23 and name HN   ))   ( (resid  23 and name HG2  ))     3.37  1.57  0.51
 assign ((resid  22 and name HB1  ))   ( (resid  23 and name HN   ))     3.59  1.79  0.54
 assign ((resid  24 and name HN   ))   ( (resid  24 and name HB   ))     3.04  1.24  0.46
 assign ((resid  24 and name HN   ))   ( (resid  24 and name HG11 ))     3.30  1.50  0.50
 assign ((resid  24 and name HN   ))   ( (resid  24 and name HD1* ))     3.71  1.91  0.56
 assign ((resid  25 and name HN   ))   ( (resid  25 and name HB2  ))     2.91  1.11  0.44
 assign ((resid  25 and name HN   ))   ( (resid  25 and name HB1  ))     3.20  1.40  0.48
 assign ((resid  25 and name HN   ))   ( (resid  28 and name HG1  ))     4.17  2.37  0.63
 assign ((resid  25 and name HN   ))   ( (resid  25 and name HD2  ))     4.97  3.17  0.75
 assign ((resid  25 and name HN   ))   ( (resid  25 and name HD1  ))     4.94  3.14  0.74
 assign ((resid  27 and name HN   ))   ( (resid  27 and name HB*  ))     2.76  0.96  0.41
 assign ((resid  28 and name HN   ))   ( (resid  28 and name HB2  ))     2.95  1.15  0.44
 assign ((resid  28 and name HN   ))   ( (resid  28 and name HG2  ))     3.35  1.55  0.50
 assign ((resid  29 and name HN   ))   ( (resid  29 and name HB*  ))     3.07  1.27  0.46
 assign ((resid  29 and name HN   ))   ( (resid  29 and name HG1  ))     4.18  2.38  0.63
 assign ((resid  29 and name HN   ))   ( (resid  29 and name HD2  ))     4.81  3.01  0.72
 assign ((resid  29 and name HN   ))   ( (resid  29 and name HD1  ))     4.81  3.01  0.72
 assign ((resid  30 and name HN   ))   ( (resid  30 and name HB2  ))     3.87  2.07  0.58
 assign ((resid  30 and name HN   ))   ( (resid  30 and name HB1  ))     3.87  2.07  0.58
 assign ((resid  30 and name HN   ))   ( (resid  30 and name HD*  ))     3.35  1.55  0.50
 assign ((resid  31 and name HN   ))   ( (resid  31 and name HA   ))     2.80  1.00  0.42
 assign ((resid  34 and name HN   ))   ( (resid  34 and name HB   ))     3.34  1.54  0.50
 assign ((resid  34 and name HN   ))   ( (resid  34 and name HG1* ))     3.47  1.67  0.52
 assign ((resid  34 and name HN   ))   ( (resid  34 and name HG2* ))     4.05  2.25  0.61
 assign ((resid  36 and name HN   ))   ( (resid  36 and name HD*  ))     3.61  1.81  0.54
 assign ((resid  36 and name HN   ))   ( (resid  36 and name HE*  ))     4.60  2.80  0.69
 assign ((resid  37 and name HN   ))   ( (resid  37 and name HB   ))     3.72  1.92  0.56
 assign ((resid  41 and name HN   ))   ( (resid  41 and name HB2  ))     3.67  1.87  0.55
 assign ((resid  43 and name HN   ))   ( (resid  43 and name HB1  ))     3.86  2.06  0.58
 assign ((resid  43 and name HN   ))   ( (resid  43 and name HB2  ))     3.70  1.90  0.56
 assign ((resid  43 and name HN   ))   ( (resid  43 and name HG   ))     4.27  2.47  0.64
 assign ((resid  43 and name HN   ))   ( (resid  43 and name HD1* ))     4.52  2.72  0.68
 assign ((resid  16 and name HD1* ))   ( (resid  43 and name HN   ))     3.70  1.90  0.56
 assign ((resid  43 and name HA   ))   ( (resid  44 and name HN   ))     3.51  1.71  0.53
 assign ((resid  45 and name HN   ))   ( (resid  45 and name HB   ))     3.42  1.62  0.51
 assign ((resid  45 and name HN   ))   ( (resid  45 and name HG2* ))     3.98  2.18  0.60
 assign ((resid  43 and name HD1* ))   ( (resid  45 and name HN   ))     4.65  2.85  0.70
 assign ((resid  45 and name HN   ))   ( (resid  45 and name HG12 ))     4.91  3.11  0.74
 assign ((resid  45 and name HN   ))   ( (resid  45 and name HG11 ))     3.65  1.85  0.55
 assign ((resid  45 and name HN   ))   ( (resid  45 and name HD1* ))     3.67  1.87  0.55
 assign ((resid  46 and name HN   ))   ( (resid  46 and name HB1  ))     3.85  2.05  0.58
 assign ((resid  46 and name HN   ))   ( (resid  46 and name HB2  ))     3.66  1.86  0.55
 assign ((resid  46 and name HN   ))   ( (resid  46 and name HG*  ))     3.94  2.14  0.59
 assign ((resid  47 and name HN   ))   ( (resid  47 and name HB   ))     3.61  1.81  0.54
 assign ((resid  47 and name HN   ))   ( (resid  47 and name HG11 ))     3.98  2.18  0.60
 assign ((resid  47 and name HN   ))   ( (resid  47 and name HG12 ))     4.35  2.55  0.65
 assign ((resid  47 and name HN   ))   ( (resid  47 and name HG2* ))     4.32  2.52  0.65
 assign ((resid  50 and name HN   ))   ( (resid  50 and name HG1* ))     4.10  2.30  0.62
 assign ((resid  50 and name HN   ))   ( (resid  50 and name HG2* ))     3.46  1.66  0.52
 assign ((resid  54 and name HN   ))   ( (resid  54 and name HB   ))     3.45  1.65  0.52
 assign ((resid  54 and name HN   ))   ( (resid  54 and name HG1* ))     3.99  2.19  0.60
 assign ((resid  55 and name HN   ))   ( (resid  55 and name HB2  ))     3.78  1.98  0.57
 assign ((resid  54 and name HB   ))   ( (resid  55 and name HN   ))     3.41  1.61  0.51
 assign ((resid  55 and name HN   ))   ( (resid  55 and name HG2  ))     4.28  2.48  0.64
 assign ((resid  55 and name HN   ))   ( (resid  55 and name HG1  ))     3.71  1.91  0.56
 assign ((resid  56 and name HN   ))   ( (resid  56 and name HB2  ))     3.18  1.38  0.48
 assign ((resid  55 and name HB1  ))   ( (resid  56 and name HN   ))     3.24  1.44  0.49
 assign ((resid  56 and name HN   ))   ( (resid  56 and name HG1  ))     3.59  1.79  0.54
 assign ((resid  56 and name HN   ))   ( (resid  56 and name HD*  ))     4.03  2.23  0.60
 assign ((resid  57 and name HN   ))   ( (resid  57 and name HB2  ))     2.93  1.13  0.44
 assign ((resid  58 and name HN   ))   ( (resid  58 and name HB2  ))     3.33  1.53  0.50
 assign ((resid  58 and name HN   ))   ( (resid  58 and name HB1  ))     3.71  1.91  0.56
 assign ((resid   4 and name HE*  ))   ( (resid  58 and name HN   ))     4.35  2.55  0.65
 assign ((resid  58 and name HN   ))   ( (resid  58 and name HD1* ))     3.77  1.97  0.57
 assign ((resid  58 and name HN   ))   ( (resid  58 and name HD2* ))     3.54  1.74  0.53
 assign ((resid  59 and name HN   ))   ( (resid  59 and name HB*  ))     3.08  1.28  0.46
 assign ((resid  60 and name HN   ))   ( (resid  60 and name HB2  ))     2.99  1.19  0.45
 assign ((resid  60 and name HN   ))   ( (resid  60 and name HG1  ))     3.82  2.02  0.57
 assign ((resid  60 and name HN   ))   ( (resid  60 and name HD*  ))     4.03  2.23  0.60
 assign ((resid  61 and name HN   ))   ( (resid  61 and name HB1  ))     3.61  1.81  0.54
 assign ((resid  61 and name HN   ))   ( (resid  61 and name HB2  ))     3.05  1.25  0.46
 assign ((resid  61 and name HN   ))   ( (resid  61 and name HG*  ))     3.23  1.43  0.48
 assign ((resid  62 and name HN   ))   ( (resid  62 and name HB*  ))     2.88  1.08  0.43
 assign ((resid  63 and name HN   ))   ( (resid  63 and name HB1  ))     3.66  1.86  0.55
 assign ((resid  63 and name HN   ))   ( (resid  63 and name HB2  ))     3.07  1.27  0.46
 assign ((resid  63 and name HN   ))   ( (resid  63 and name HG1  ))     3.15  1.35  0.47
 assign ((resid  64 and name HN   ))   ( (resid  64 and name HB1  ))     2.90  1.10  0.44
 assign ((resid  64 and name HN   ))   ( (resid  64 and name HB2  ))     3.59  1.79  0.54
 assign ((resid  64 and name HN   ))   ( (resid  64 and name HG2  ))     3.58  1.78  0.54
 assign ((resid  64 and name HN   ))   ( (resid  64 and name HG1  ))     3.93  2.13  0.59
 assign ((resid  65 and name HN   ))   ( (resid  65 and name HB1  ))     3.60  1.80  0.54
 assign ((resid  65 and name HN   ))   ( (resid  65 and name HB2  ))     3.30  1.50  0.50
 assign ((resid  65 and name HN   ))   ( (resid  65 and name HG   ))     2.99  1.19  0.45
 assign ((resid  65 and name HN   ))   ( (resid  65 and name HD2* ))     3.57  1.77  0.54
 assign ((resid  65 and name HN   ))   ( (resid  65 and name HD1* ))     4.00  2.20  0.60
 assign ((resid  67 and name HN   ))   ( (resid  67 and name HA   ))     2.94  1.14  0.44
 assign ((resid  67 and name HN   ))   ( (resid  67 and name HB*  ))     2.45  0.65  0.37
 assign ((resid  67 and name HN   ))   ( (resid  67 and name HG2  ))     3.35  1.55  0.50
 assign ((resid  67 and name HN   ))   ( (resid  67 and name HG1  ))     4.08  2.28  0.61
 assign ((resid  67 and name HN   ))   ( (resid  67 and name HD*  ))     3.53  1.73  0.53
 assign ((resid  68 and name HN   ))   ( (resid  68 and name HB2  ))     2.82  1.02  0.42
 assign ((resid  68 and name HN   ))   ( (resid  68 and name HB1  ))     2.80  1.00  0.42
 assign ((resid  69 and name HN   ))   ( (resid  69 and name HB2  ))     3.17  1.37  0.48
 assign ((resid  69 and name HN   ))   ( (resid  69 and name HB1  ))     3.76  1.96  0.56
 assign ((resid  69 and name HN   ))   ( (resid  69 and name HD*  ))     3.65  1.85  0.55
 assign ((resid  70 and name HN   ))   ( (resid  70 and name HA   ))     2.51  0.71  0.38
 assign ((resid  70 and name HN   ))   ( (resid  70 and name HB2  ))     3.19  1.39  0.48
 assign ((resid  71 and name HN   ))   ( (resid  71 and name HB   ))     3.97  2.17  0.60
 assign ((resid  71 and name HN   ))   ( (resid  71 and name HG2* ))     3.29  1.49  0.49
 assign ((resid  71 and name HN   ))   ( (resid  71 and name HG11 ))     3.31  1.51  0.50
 assign ((resid  71 and name HN   ))   ( (resid  71 and name HG12 ))     3.10  1.30  0.47
 assign ((resid  71 and name HN   ))   ( (resid  71 and name HD1* ))     3.82  2.02  0.57
 assign ((resid  72 and name HN   ))   ( (resid  72 and name HG2* ))     3.39  1.59  0.51
 assign ((resid  73 and name HN   ))   ( (resid  73 and name HB   ))     3.63  1.83  0.54
 assign ((resid  73 and name HN   ))   ( (resid  73 and name HG1* ))     2.96  1.16  0.44
 assign ((resid  73 and name HN   ))   ( (resid  73 and name HG2* ))     4.00  2.20  0.60
 assign ((resid  74 and name HN   ))   ( (resid  74 and name HG2* ))     3.49  1.69  0.52
 assign ((resid  75 and name HN   ))   ( (resid  75 and name HB1  ))     4.14  2.34  0.62
 assign ((resid  75 and name HN   ))   ( (resid  75 and name HD*  ))     3.68  1.88  0.55
 assign ((resid  75 and name HN   ))   ( (resid  75 and name HE*  ))     4.41  2.61  0.66
 assign ((resid  76 and name HN   ))   ( (resid  76 and name HG2* ))     3.97  2.17  0.60
 assign ((resid  76 and name HA   ))   ( (resid  77 and name HN   ))     3.21  1.41  0.48
 assign ((resid  77 and name HN   ))   ( (resid  77 and name HB   ))     3.88  2.08  0.58
 assign ((resid  77 and name HN   ))   ( (resid  77 and name HG11 ))     3.86  2.06  0.58
 assign ((resid  78 and name HN   ))   ( (resid  78 and name HB2  ))     3.92  2.12  0.59
 assign ((resid  78 and name HN   ))   ( (resid  78 and name HB1  ))     3.92  2.12  0.59
 assign ((resid  78 and name HN   ))   ( (resid  78 and name HG*  ))     3.62  1.82  0.54
 assign ((resid  82 and name HN   ))   ( (resid  82 and name HB1  ))     3.73  1.93  0.56
 assign ((resid  82 and name HN   ))   ( (resid  82 and name HG2  ))     3.95  2.15  0.59
 assign ((resid  82 and name HN   ))   ( (resid  82 and name HG1  ))     3.95  2.15  0.59
 assign ((resid   4 and name HN   ))   ( (resid   5 and name HN   ))     4.60  2.80  0.69
 assign ((resid   6 and name HN   ))   ( (resid   7 and name HN   ))     5.21  3.41  0.78
 assign ((resid   6 and name HN   ))   ( (resid  47 and name HN   ))     5.71  3.91  0.86
 assign ((resid   7 and name HN   ))   ( (resid   8 and name HN   ))     5.07  3.27  0.76
 assign ((resid   9 and name HN   ))   ( (resid  10 and name HN   ))     4.73  2.93  0.71
 assign ((resid  11 and name HN   ))   ( (resid  12 and name HN   ))     2.83  1.03  0.42
 assign ((resid  12 and name HN   ))   ( (resid  13 and name HN   ))     4.19  2.39  0.63
 assign ((resid  14 and name HN   ))   ( (resid  15 and name HN   ))     2.93  1.13  0.44
 assign ((resid  16 and name HN   ))   ( (resid  17 and name HN   ))     3.61  1.81  0.54
 assign ((resid  17 and name HN   ))   ( (resid  18 and name HN   ))     3.97  2.17  0.60
 assign ((resid  18 and name HN   ))   ( (resid  19 and name HN   ))     3.31  1.51  0.50
 assign ((resid  25 and name HN   ))   ( (resid  26 and name HN   ))     3.13  1.33  0.47
 assign ((resid  27 and name HN   ))   ( (resid  28 and name HN   ))     3.39  1.59  0.51
 assign ((resid  28 and name HN   ))   ( (resid  29 and name HN   ))     3.48  1.68  0.52
 assign ((resid  30 and name HN   ))   ( (resid  31 and name HN   ))     3.18  1.38  0.48
 assign ((resid  32 and name HN   ))   ( (resid  33 and name HN   ))     4.24  2.44  0.64
 assign ((resid  33 and name HN   ))   ( (resid  34 and name HN   ))     4.90  3.10  0.74
 assign ((resid  35 and name HN   ))   ( (resid  36 and name HN   ))     4.81  3.01  0.72
 assign ((resid  41 and name HN   ))   ( (resid  42 and name HN   ))     3.76  1.96  0.56
 assign ((resid  44 and name HN   ))   ( (resid  45 and name HN   ))     4.81  3.01  0.72
 assign ((resid  45 and name HN   ))   ( (resid  46 and name HN   ))     5.15  3.35  0.77
 assign ((resid  46 and name HN   ))   ( (resid  47 and name HN   ))     4.34  2.54  0.65
 assign ((resid  48 and name HN   ))   ( (resid  49 and name HN   ))     5.01  3.21  0.75
 assign ((resid  49 and name HN   ))   ( (resid  50 and name HN   ))     3.76  1.96  0.56
 assign ((resid  55 and name HN   ))   ( (resid  56 and name HN   ))     3.75  1.95  0.56
 assign ((resid  58 and name HN   ))   ( (resid  59 and name HN   ))     3.38  1.58  0.51
 assign ((resid  59 and name HN   ))   ( (resid  60 and name HN   ))     3.25  1.45  0.49
 assign ((resid  62 and name HN   ))   ( (resid  63 and name HN   ))     3.16  1.36  0.47
 assign ((resid  63 and name HN   ))   ( (resid  64 and name HN   ))     3.14  1.34  0.47
 assign ((resid  64 and name HN   ))   ( (resid  65 and name HN   ))     3.05  1.25  0.46
 assign ((resid  66 and name HN   ))   ( (resid  67 and name HN   ))     3.17  1.37  0.48
 assign ((resid  67 and name HN   ))   ( (resid  68 and name HN   ))     2.63  0.83  0.39
 assign ((resid  68 and name HN   ))   ( (resid  69 and name HN   ))     2.94  1.14  0.44
 assign ((resid  70 and name HN   ))   ( (resid  71 and name HN   ))     3.02  1.22  0.45
 assign ((resid  76 and name HN   ))   ( (resid  77 and name HN   ))     4.61  2.81  0.69
 assign ((resid  13 and name HA   ))   ( (resid  15 and name HN   ))     4.58  2.78  0.69
 assign ((resid  13 and name HN   ))   ( (resid  15 and name HN   ))     4.72  2.92  0.71
 assign ((resid  13 and name HA   ))   ( (resid  16 and name HN   ))     3.94  2.14  0.59
 assign ((resid  16 and name HN   ))   ( (resid  18 and name HN   ))     5.47  3.67  0.82
 assign ((resid  15 and name HN   ))   ( (resid  17 and name HN   ))     4.35  2.55  0.65
 assign ((resid  13 and name HA   ))   ( (resid  17 and name HN   ))     4.78  2.98  0.72
 assign ((resid  17 and name HN   ))   ( (resid  19 and name HN   ))     4.76  2.96  0.71
 assign ((resid  17 and name HA   ))   ( (resid  19 and name HN   ))     5.10  3.30  0.77
 assign ((resid  15 and name HA   ))   ( (resid  19 and name HN   ))     4.25  2.45  0.64
 assign ((resid  17 and name HA   ))   ( (resid  20 and name HN   ))     3.99  2.19  0.60
 assign ((resid  16 and name HA   ))   ( (resid  20 and name HN   ))     3.93  2.13  0.59
 assign ((resid  20 and name HA   ))   ( (resid  23 and name HN   ))     3.84  2.04  0.58
 assign ((resid  19 and name HA   ))   ( (resid  23 and name HN   ))     4.38  2.58  0.66
 assign ((resid  23 and name HN   ))   ( (resid  25 and name HN   ))     4.83  3.03  0.72
 assign ((resid  20 and name HA   ))   ( (resid  24 and name HN   ))     4.47  2.67  0.67
 assign ((resid  24 and name HN   ))   ( (resid  26 and name HN   ))     4.49  2.69  0.67
 assign ((resid  23 and name HA   ))   ( (resid  25 and name HN   ))     5.03  3.23  0.75
 assign ((resid  21 and name HA   ))   ( (resid  25 and name HN   ))     4.66  2.86  0.70
 assign ((resid  26 and name HN   ))   ( (resid  28 and name HN   ))     3.97  2.17  0.60
 assign ((resid  27 and name HN   ))   ( (resid  29 and name HN   ))     4.74  2.94  0.71
 assign ((resid  27 and name HA   ))   ( (resid  29 and name HN   ))     5.17  3.37  0.78
 assign ((resid  28 and name HA   ))   ( (resid  30 and name HN   ))     4.03  2.23  0.60
 assign ((resid  28 and name HN   ))   ( (resid  30 and name HN   ))     4.23  2.43  0.63
 assign ((resid  27 and name HA   ))   ( (resid  30 and name HN   ))     3.82  2.02  0.57
 assign ((resid  52 and name HA   ))   ( (resid  54 and name HN   ))     4.73  2.93  0.71
 assign ((resid  51 and name HD2  ))   ( (resid  55 and name HN   ))     5.19  3.39  0.78
 assign ((resid  55 and name HN   ))   ( (resid  57 and name HN   ))     5.08  3.28  0.76
 assign ((resid  54 and name HA   ))   ( (resid  56 and name HN   ))     5.01  3.21  0.75
 assign ((resid  54 and name HN   ))   ( (resid  56 and name HN   ))     4.71  2.91  0.71
 assign ((resid  55 and name HA   ))   ( (resid  57 and name HN   ))     4.55  2.75  0.68
 assign ((resid  54 and name HA   ))   ( (resid  57 and name HN   ))     3.81  2.01  0.57
 assign ((resid  57 and name HN   ))   ( (resid  59 and name HN   ))     4.24  2.44  0.64
 assign ((resid  56 and name HA   ))   ( (resid  58 and name HN   ))     4.86  3.06  0.73
 assign ((resid  56 and name HN   ))   ( (resid  58 and name HN   ))     4.45  2.65  0.67
 assign ((resid  55 and name HA   ))   ( (resid  58 and name HN   ))     4.13  2.33  0.62
 assign ((resid  54 and name HA   ))   ( (resid  58 and name HN   ))     4.85  3.05  0.73
 assign ((resid  58 and name HN   ))   ( (resid  60 and name HN   ))     4.46  2.66  0.67
 assign ((resid  56 and name HA   ))   ( (resid  59 and name HN   ))     3.85  2.05  0.58
 assign ((resid  55 and name HA   ))   ( (resid  59 and name HN   ))     4.86  3.06  0.73
 assign ((resid  57 and name HA   ))   ( (resid  60 and name HN   ))     3.81  2.01  0.57
 assign ((resid  60 and name HN   ))   ( (resid  62 and name HN   ))     4.39  2.59  0.66
 assign ((resid  59 and name HA   ))   ( (resid  61 and name HN   ))     4.98  3.18  0.75
 assign ((resid  58 and name HA   ))   ( (resid  61 and name HN   ))     3.92  2.12  0.59
 assign ((resid  57 and name HA   ))   ( (resid  61 and name HN   ))     4.47  2.67  0.67
 assign ((resid  59 and name HA   ))   ( (resid  62 and name HN   ))     4.26  2.46  0.64
 assign ((resid  60 and name HA   ))   ( (resid  63 and name HN   ))     3.56  1.76  0.53
 assign ((resid  63 and name HN   ))   ( (resid  65 and name HN   ))     4.44  2.64  0.67
 assign ((resid  62 and name HA   ))   ( (resid  64 and name HN   ))     4.61  2.81  0.69
 assign ((resid  62 and name HN   ))   ( (resid  64 and name HN   ))     4.35  2.55  0.65
 assign ((resid  61 and name HA   ))   ( (resid  64 and name HN   ))     3.72  1.92  0.56
 assign ((resid  60 and name HA   ))   ( (resid  64 and name HN   ))     4.33  2.53  0.65
 assign ((resid  64 and name HN   ))   ( (resid  66 and name HN   ))     4.27  2.47  0.64
 assign ((resid  62 and name HA   ))   ( (resid  65 and name HN   ))     3.83  2.03  0.57
 assign ((resid  61 and name HA   ))   ( (resid  65 and name HN   ))     4.35  2.55  0.65
 assign ((resid  64 and name HE   ))   ( (resid  65 and name HN   ))     4.99  3.19  0.75
 assign ((resid  62 and name HA   ))   ( (resid  66 and name HN   ))     3.98  2.18  0.60
 assign ((resid  65 and name HA   ))   ( (resid  67 and name HN   ))     4.41  2.61  0.66
 assign ((resid  65 and name HN   ))   ( (resid  67 and name HN   ))     4.28  2.48  0.64
 assign ((resid  67 and name HN   ))   ( (resid  69 and name HN   ))     4.33  2.53  0.65
 assign ((resid  66 and name HA   ))   ( (resid  68 and name HN   ))     4.54  2.74  0.68
 assign ((resid  65 and name HA   ))   ( (resid  68 and name HN   ))     3.46  1.66  0.52
 assign ((resid  64 and name HA   ))   ( (resid  68 and name HN   ))     4.61  2.81  0.69
 assign ((resid  67 and name HA   ))   ( (resid  69 and name HN   ))     4.70  2.90  0.70
 assign ((resid  66 and name HA   ))   ( (resid  69 and name HN   ))     4.24  2.44  0.64
 assign ((resid  65 and name HA   ))   ( (resid  69 and name HN   ))     4.16  2.36  0.62
 assign ((resid   4 and name HN   ))   ( (resid  48 and name HG2* ))     4.76  2.96  0.71
 assign ((resid   4 and name HN   ))   ( (resid  47 and name HG2* ))     5.12  3.32  0.77
 assign ((resid   4 and name HN   ))   ( (resid  50 and name HG2* ))     4.60  2.80  0.69
 assign ((resid   6 and name HN   ))   ( (resid  45 and name HG2* ))     4.71  2.91  0.71
 assign ((resid   6 and name HN   ))   ( (resid  45 and name HB   ))     4.44  2.64  0.67
 assign ((resid   6 and name HN   ))   ( (resid  44 and name HA   ))     5.29  3.49  0.79
 assign ((resid   7 and name HN   ))   ( (resid  75 and name HB1  ))     4.47  2.67  0.67
 assign ((resid   7 and name HN   ))   ( (resid  73 and name HG2* ))     4.09  2.29  0.61
 assign ((resid   8 and name HN   ))   ( (resid  43 and name HD2* ))     4.78  2.98  0.72
 assign ((resid   6 and name HG2* ))   ( (resid   8 and name HN   ))     5.22  3.42  0.78
 assign ((resid   8 and name HN   ))   ( (resid  43 and name HB2  ))     4.79  2.99  0.72
 assign ((resid   8 and name HN   ))   ( (resid  44 and name HA   ))     4.56  2.76  0.68
 assign ((resid   9 and name HN   ))   ( (resid  71 and name HB   ))     4.18  2.38  0.63
 assign ((resid   9 and name HN   ))   ( (resid  72 and name HG2* ))     4.71  2.91  0.71
 assign ((resid   9 and name HN   ))   ( (resid  71 and name HG2* ))     5.37  3.57  0.81
 assign ((resid   9 and name HN   ))   ( (resid  16 and name HD2* ))     3.97  2.17  0.60
 assign ((resid   9 and name HN   ))   ( (resid  71 and name HD1* ))     4.63  2.83  0.69
 assign ((resid   9 and name HN   ))   ( (resid  73 and name HG2* ))     5.11  3.31  0.77
 assign ((resid  10 and name HN   ))   ( (resid  16 and name HD1* ))     4.36  2.56  0.65
 assign ((resid  10 and name HN   ))   ( (resid  41 and name HB2  ))     4.54  2.74  0.68
 assign ((resid  10 and name HN   ))   ( (resid  41 and name HA   ))     5.58  3.78  0.84
 assign ((resid  11 and name HN   ))   ( (resid  71 and name HG2* ))     3.63  1.83  0.54
 assign ((resid  12 and name HN   ))   ( (resid  16 and name HG   ))     5.18  3.38  0.78
 assign ((resid  12 and name HN   ))   ( (resid  15 and name HB*  ))     3.95  2.15  0.59
 assign ((resid  12 and name HN   ))   ( (resid  71 and name HG2* ))     3.90  2.10  0.59
 assign ((resid  12 and name HN   ))   ( (resid  16 and name HD2* ))     4.77  2.97  0.72
 assign ((resid  10 and name HA2  ))   ( (resid  12 and name HN   ))     4.51  2.71  0.68
 assign ((resid  10 and name HA1  ))   ( (resid  12 and name HN   ))     3.74  1.94  0.56
 assign ((resid  12 and name HN   ))   ( (resid  13 and name HA   ))     5.04  3.24  0.76
 assign ((resid  13 and name HN   ))   ( (resid  14 and name HB2  ))     5.06  3.26  0.76
 assign ((resid  12 and name HA   ))   ( (resid  15 and name HN   ))     4.90  3.10  0.74
 assign ((resid  12 and name HB2  ))   ( (resid  15 and name HN   ))     4.51  2.71  0.68
 assign ((resid  12 and name HB1  ))   ( (resid  15 and name HN   ))     4.51  2.71  0.68
 assign ((resid  15 and name HN   ))   ( (resid  18 and name HB2  ))     5.19  3.39  0.78
 assign ((resid  15 and name HN   ))   ( (resid  18 and name HD2  ))     5.03  3.23  0.75
 assign ((resid  15 and name HN   ))   ( (resid  16 and name HG   ))     4.34  2.54  0.65
 assign ((resid  15 and name HN   ))   ( (resid  71 and name HG2* ))     4.18  2.38  0.63
 assign ((resid  19 and name HN   ))   ( (resid  69 and name HD*  ))     4.70  2.90  0.70
 assign ((resid  19 and name HN   ))   ( (resid  69 and name HZ   ))     5.00  3.20  0.75
 assign ((resid  19 and name HN   ))   ( (resid  20 and name HB1  ))     4.92  3.12  0.74
 assign ((resid  20 and name HN   ))   ( (resid  43 and name HD2* ))     3.28  1.48  0.49
 assign ((resid  23 and name HN   ))   ( (resid  65 and name HD1* ))     3.56  1.76  0.53
 assign ((resid  19 and name HB*  ))   ( (resid  23 and name HN   ))     4.54  2.74  0.68
 assign ((resid  22 and name HN   ))   ( (resid  23 and name HN   ))     3.12  1.32  0.47
 assign ((resid   8 and name HE*  ))   ( (resid  23 and name HN   ))     5.22  3.42  0.78
 assign ((resid  27 and name HN   ))   ( (resid  30 and name HD*  ))     5.18  3.38  0.78
 assign ((resid  27 and name HN   ))   ( (resid  30 and name HE*  ))     5.60  3.80  0.84
 assign ((resid  24 and name HG2* ))   ( (resid  28 and name HN   ))     4.05  2.25  0.61
 assign ((resid  30 and name HN   ))   ( (resid  54 and name HG2* ))     5.68  3.88  0.85
 assign ((resid  30 and name HN   ))   ( (resid  54 and name HG1* ))     5.33  3.53  0.80
 assign ((resid  30 and name HN   ))   ( (resid  32 and name HN   ))     4.13  2.33  0.62
 assign ((resid  32 and name HN   ))   ( (resid  50 and name HG1* ))     4.18  2.38  0.63
 assign ((resid  33 and name HN   ))   ( (resid  47 and name HG2* ))     4.01  2.21  0.60
 assign ((resid  33 and name HN   ))   ( (resid  47 and name HA   ))     4.91  3.11  0.74
 assign ((resid  37 and name HN   ))   ( (resid  44 and name HB1  ))     4.54  2.74  0.68
 assign ((resid  37 and name HN   ))   ( (resid  43 and name HD1* ))     3.89  2.09  0.58
 assign ((resid  11 and name HN   ))   ( (resid  41 and name HD21 ))     4.87  3.07  0.73
 assign ((resid  11 and name HN   ))   ( (resid  41 and name HD22 ))     6.00  4.20  0.90
 assign ((resid  13 and name HB1  ))   ( (resid  41 and name HD21 ))     5.20  3.40  0.78
 assign ((resid  13 and name HB1  ))   ( (resid  41 and name HD22 ))     5.23  3.43  0.78
 assign ((resid  16 and name HD1* ))   ( (resid  41 and name HD22 ))     4.97  3.17  0.75
 assign ((resid  16 and name HD1* ))   ( (resid  41 and name HD21 ))     4.61  2.81  0.69
 assign ((resid   9 and name HA   ))   ( (resid  43 and name HN   ))     4.07  2.27  0.61
 assign ((resid   8 and name HN   ))   ( (resid  43 and name HN   ))     4.06  2.26  0.61
 assign ((resid  16 and name HD2* ))   ( (resid  43 and name HN   ))     4.13  2.33  0.62
 assign ((resid  37 and name HN   ))   ( (resid  44 and name HN   ))     3.86  2.06  0.58
 assign ((resid  36 and name HB1  ))   ( (resid  46 and name HN   ))     5.54  3.74  0.83
 assign ((resid  36 and name HB2  ))   ( (resid  44 and name HN   ))     6.00  4.20  0.90
 assign ((resid  35 and name HG2* ))   ( (resid  46 and name HN   ))     4.62  2.82  0.69
 assign ((resid  56 and name HN   ))   ( (resid  77 and name HG2* ))     4.77  2.97  0.72
 assign ((resid  59 and name HN   ))   ( (resid  62 and name HB*  ))     5.07  3.27  0.76
 assign ((resid  58 and name HD1* ))   ( (resid  61 and name HN   ))     5.12  3.32  0.77
 assign ((resid  59 and name HB*  ))   ( (resid  61 and name HN   ))     5.45  3.65  0.82
 assign ((resid  60 and name HB1  ))   ( (resid  62 and name HN   ))     5.83  4.03  0.87
 assign ((resid  60 and name HB2  ))   ( (resid  62 and name HN   ))     6.00  4.20  0.90
 assign ((resid  59 and name HB*  ))   ( (resid  62 and name HN   ))     4.91  3.11  0.74
 assign ((resid  63 and name HN   ))   ( (resid  73 and name HG1* ))     3.88  2.08  0.58
 assign ((resid  63 and name HN   ))   ( (resid  66 and name HB*  ))     4.67  2.87  0.70
 assign ((resid  63 and name HN   ))   ( (resid  64 and name HB1  ))     5.28  3.48  0.79
 assign ((resid  68 and name HA   ))   ( (resid  70 and name HN   ))     4.31  2.51  0.65
 assign ((resid  67 and name HA   ))   ( (resid  70 and name HN   ))     3.45  1.65  0.52
 assign ((resid  67 and name HB*  ))   ( (resid  70 and name HN   ))     4.92  3.12  0.74
 assign ((resid  68 and name HB2  ))   ( (resid  70 and name HN   ))     5.47  3.67  0.82
 assign ((resid  66 and name HB*  ))   ( (resid  70 and name HN   ))     5.12  3.32  0.77
 assign ((resid  68 and name HB1  ))   ( (resid  70 and name HN   ))     4.62  2.82  0.69
 assign ((resid  70 and name HN   ))   ( (resid  71 and name HG11 ))     5.21  3.41  0.78
 assign ((resid  70 and name HN   ))   ( (resid  71 and name HG12 ))     4.21  2.41  0.63
 assign ((resid  70 and name HN   ))   ( (resid  71 and name HG2* ))     4.52  2.72  0.68
 assign ((resid  70 and name HN   ))   ( (resid  71 and name HD1* ))     5.21  3.41  0.78
 assign ((resid  69 and name HB2  ))   ( (resid  71 and name HN   ))     4.32  2.52  0.65
 assign ((resid  69 and name HB1  ))   ( (resid  71 and name HN   ))     4.68  2.88  0.70
 assign ((resid  66 and name HA   ))   ( (resid  71 and name HN   ))     3.34  1.54  0.50
 assign ((resid  69 and name HA   ))   ( (resid  71 and name HN   ))     5.45  3.65  0.82
 assign ((resid  71 and name HN   ))   ( (resid  72 and name HA   ))     5.94  4.14  0.89
 assign ((resid  69 and name HD*  ))   ( (resid  71 and name HN   ))     4.79  2.99  0.72
 assign ((resid   8 and name HD*  ))   ( (resid  72 and name HN   ))     4.65  2.85  0.70
 assign ((resid   9 and name HA   ))   ( (resid  72 and name HN   ))     5.08  3.28  0.76
 assign ((resid   8 and name HA   ))   ( (resid  72 and name HN   ))     4.99  3.19  0.75
 assign ((resid  10 and name HA1  ))   ( (resid  72 and name HN   ))     4.39  2.59  0.66
 assign ((resid   8 and name HB*  ))   ( (resid  72 and name HN   ))     5.62  3.82  0.84
 assign ((resid  66 and name HB*  ))   ( (resid  72 and name HN   ))     4.67  2.87  0.70
 assign ((resid  73 and name HN   ))   ( (resid  74 and name HG2* ))     5.14  3.34  0.77
 assign ((resid  66 and name HB*  ))   ( (resid  73 and name HN   ))     3.60  1.80  0.54
 assign ((resid  63 and name HA   ))   ( (resid  73 and name HN   ))     6.00  4.20  0.90
 assign ((resid   8 and name HA   ))   ( (resid  73 and name HN   ))     5.12  3.32  0.77
 assign ((resid   8 and name HE*  ))   ( (resid  73 and name HN   ))     5.43  3.63  0.81
 assign ((resid   7 and name HN   ))   ( (resid  74 and name HN   ))     3.74  1.94  0.56
 assign ((resid   8 and name HD*  ))   ( (resid  74 and name HN   ))     5.41  3.61  0.81
 assign ((resid  74 and name HN   ))   ( (resid  75 and name HD*  ))     4.90  3.10  0.74
 assign ((resid   8 and name HA   ))   ( (resid  74 and name HN   ))     4.03  2.23  0.60
 assign ((resid  20 and name HD1* ))   ( (resid  24 and name HN   ))     5.83  4.03  0.87
 assign ((resid   7 and name HN   ))   ( (resid  75 and name HN   ))     5.06  3.26  0.76
 assign ((resid  75 and name HB2  ))   ( (resid  76 and name HN   ))     3.81  2.01  0.57
 assign ((resid   4 and name HE*  ))   ( (resid  76 and name HN   ))     5.40  3.60  0.81
 assign ((resid  76 and name HN   ))   ( (resid  77 and name HG12 ))     5.02  3.22  0.75
 assign ((resid  73 and name HG2* ))   ( (resid  75 and name HN   ))     4.73  2.93  0.71
 assign ((resid   6 and name HB   ))   ( (resid  45 and name HN   ))     4.02  2.22  0.60
 assign ((resid  52 and name HN   ))   ( (resid  53 and name HN   ))     3.95  2.15  0.59
 assign ((resid   1 and name HN   ))   ( (resid   1 and name HB*  ))     4.06  2.26  0.61
 assign ((resid   7 and name HB2  ))   ( (resid   7 and name HE   ))     4.63  2.83  0.69
 assign ((resid   7 and name HB1  ))   ( (resid   7 and name HE   ))     4.63  2.83  0.69
 assign ((resid   9 and name HN   ))   ( (resid  43 and name HN   ))     5.12  3.32  0.77
 assign ((resid   9 and name HN   ))   ( (resid  42 and name HA   ))     5.21  3.41  0.78
 assign ((resid   9 and name HN   ))   ( (resid  72 and name HA   ))     4.70  2.90  0.70
 assign ((resid   9 and name HA   ))   ( (resid   9 and name HE   ))     5.07  3.27  0.76
 assign ((resid   9 and name HG*  ))   ( (resid   9 and name HE   ))     3.42  1.62  0.51
 assign ((resid  11 and name HN   ))   ( (resid  16 and name HD2* ))     5.34  3.54  0.80
 assign ((resid  11 and name HN   ))   ( (resid  15 and name HB*  ))     5.02  3.22  0.75
 assign ((resid  11 and name HN   ))   ( (resid  71 and name HA   ))     4.80  3.00  0.72
 assign ((resid  12 and name HA   ))   ( (resid  14 and name HN   ))     4.03  2.23  0.60
 assign ((resid  15 and name HB*  ))   ( (resid  17 and name HN   ))     4.64  2.84  0.70
 assign ((resid  20 and name HN   ))   ( (resid  21 and name HN   ))     3.39  1.59  0.51
 assign ((resid  20 and name HN   ))   ( (resid  69 and name HD*  ))     6.00  4.20  0.90
 assign ((resid  20 and name HN   ))   ( (resid  69 and name HZ   ))     6.00  4.20  0.90
 assign ((resid  17 and name HB2  ))   ( (resid  19 and name HN   ))     5.40  3.60  0.81
 assign ((resid  19 and name HN   ))   ( (resid  65 and name HD1* ))     4.46  2.66  0.67
 assign ((resid  20 and name HN   ))   ( (resid  23 and name HN   ))     4.87  3.07  0.73
 assign ((resid  18 and name HA   ))   ( (resid  21 and name HN   ))     4.01  2.21  0.60
 assign ((resid  20 and name HB1  ))   ( (resid  21 and name HN   ))     3.32  1.52  0.50
 assign ((resid  21 and name HN   ))   ( (resid  21 and name HG1  ))     4.69  2.89  0.70
 assign ((resid  21 and name HN   ))   ( (resid  43 and name HD2* ))     5.04  3.24  0.76
 assign ((resid  21 and name HN   ))   ( (resid  65 and name HD1* ))     5.45  3.65  0.82
 assign ((resid  21 and name HN   ))   ( (resid  24 and name HD1* ))     4.48  2.68  0.67
 assign ((resid  20 and name HD1* ))   ( (resid  21 and name HN   ))     4.82  3.02  0.72
 assign ((resid  20 and name HD2* ))   ( (resid  21 and name HN   ))     4.82  3.02  0.72
 assign ((resid  20 and name HN   ))   ( (resid  22 and name HN   ))     4.35  2.55  0.65
 assign ((resid  21 and name HN   ))   ( (resid  22 and name HN   ))     3.40  1.60  0.51
 assign ((resid  22 and name HN   ))   ( (resid  23 and name HA   ))     5.37  3.57  0.81
 assign ((resid  19 and name HA   ))   ( (resid  22 and name HN   ))     3.70  1.90  0.56
 assign ((resid  22 and name HN   ))   ( (resid  22 and name HG2  ))     3.53  1.73  0.53
 assign ((resid  22 and name HN   ))   ( (resid  22 and name HG1  ))     3.69  1.89  0.55
 assign ((resid  22 and name HN   ))   ( (resid  22 and name HB2  ))     3.07  1.27  0.46
 assign ((resid  22 and name HN   ))   ( (resid  22 and name HB1  ))     3.75  1.95  0.56
 assign ((resid  21 and name HB*  ))   ( (resid  22 and name HN   ))     3.06  1.26  0.46
 assign ((resid  22 and name HN   ))   ( (resid  65 and name HD1* ))     4.14  2.34  0.62
 assign ((resid  22 and name HN   ))   ( (resid  65 and name HD2* ))     4.88  3.08  0.73
 assign ((resid  19 and name HB*  ))   ( (resid  22 and name HN   ))     4.73  2.93  0.71
 assign ((resid  20 and name HB2  ))   ( (resid  23 and name HN   ))     5.88  4.08  0.88
 assign ((resid  22 and name HN   ))   ( (resid  24 and name HN   ))     4.77  2.97  0.72
 assign ((resid  25 and name HB2  ))   ( (resid  25 and name HE   ))     4.88  3.08  0.73
 assign ((resid  25 and name HB1  ))   ( (resid  25 and name HE   ))     4.51  2.71  0.68
 assign ((resid  22 and name HA   ))   ( (resid  26 and name HN   ))     4.99  3.19  0.75
 assign ((resid  26 and name HN   ))   ( (resid  26 and name HE22 ))     5.31  3.51  0.80
 assign ((resid  26 and name HN   ))   ( (resid  27 and name HB*  ))     4.78  2.98  0.72
 assign ((resid  24 and name HG2* ))   ( (resid  26 and name HN   ))     5.06  3.26  0.76
 assign ((resid  26 and name HN   ))   ( (resid  58 and name HD1* ))     5.41  3.61  0.81
 assign ((resid  26 and name HE22 ))   ( (resid  58 and name HD1* ))     6.00  4.20  0.90
 assign ((resid  27 and name HN   ))   ( (resid  58 and name HD1* ))     3.36  1.56  0.50
 assign ((resid  28 and name HN   ))   ( (resid  28 and name HE   ))     5.92  4.12  0.89
 assign ((resid  29 and name HN   ))   ( (resid  31 and name HN   ))     4.55  2.75  0.68
 assign ((resid  28 and name HB2  ))   ( (resid  30 and name HN   ))     4.83  3.03  0.72
 assign ((resid  29 and name HA   ))   ( (resid  31 and name HN   ))     4.25  2.45  0.64
 assign ((resid  31 and name HN   ))   ( (resid  32 and name HA1  ))     5.26  3.46  0.79
 assign ((resid  28 and name HB2  ))   ( (resid  31 and name HN   ))     6.00  4.20  0.90
 assign ((resid  28 and name HB1  ))   ( (resid  31 and name HN   ))     6.00  4.20  0.90
 assign ((resid  31 and name HN   ))   ( (resid  50 and name HG1* ))     5.33  3.53  0.80
 assign ((resid  27 and name HB*  ))   ( (resid  32 and name HN   ))     4.68  2.88  0.70
 assign ((resid  32 and name HN   ))   ( (resid  47 and name HG2* ))     5.50  3.70  0.83
 assign ((resid  28 and name HB1  ))   ( (resid  32 and name HN   ))     5.87  4.07  0.88
 assign ((resid  30 and name HB1  ))   ( (resid  32 and name HN   ))     5.05  3.25  0.76
 assign ((resid  30 and name HB2  ))   ( (resid  32 and name HN   ))     5.05  3.25  0.76
 assign ((resid  27 and name HA   ))   ( (resid  32 and name HN   ))     4.90  3.10  0.74
 assign ((resid  30 and name HD*  ))   ( (resid  32 and name HN   ))     5.20  3.40  0.78
 assign ((resid  34 and name HN   ))   ( (resid  35 and name HN   ))     4.65  2.85  0.70
 assign ((resid  35 and name HN   ))   ( (resid  46 and name HN   ))     3.78  1.98  0.57
 assign ((resid  35 and name HN   ))   ( (resid  45 and name HA   ))     4.95  3.15  0.74
 assign ((resid  35 and name HN   ))   ( (resid  36 and name HD*  ))     5.16  3.36  0.77
 assign ((resid  35 and name HN   ))   ( (resid  46 and name HB2  ))     4.35  2.55  0.65
 assign ((resid  35 and name HN   ))   ( (resid  47 and name HG11 ))     4.69  2.89  0.70
 assign ((resid  36 and name HN   ))   ( (resid  45 and name HA   ))     4.90  3.10  0.74
 assign ((resid  36 and name HN   ))   ( (resid  46 and name HN   ))     5.01  3.21  0.75
 assign ((resid  36 and name HN   ))   ( (resid  43 and name HD1* ))     5.98  4.18  0.90
 assign ((resid  34 and name HG1* ))   ( (resid  36 and name HN   ))     5.37  3.57  0.81
 assign ((resid  37 and name HN   ))   ( (resid  45 and name HA   ))     4.29  2.49  0.64
 assign ((resid  37 and name HN   ))   ( (resid  43 and name HA   ))     5.00  3.20  0.75
 assign ((resid   9 and name HG*  ))   ( (resid  43 and name HN   ))     5.87  4.07  0.88
 assign ((resid   7 and name HN   ))   ( (resid  45 and name HN   ))     4.88  3.08  0.73
 assign ((resid   7 and name HA   ))   ( (resid  45 and name HN   ))     4.00  2.20  0.60
 assign ((resid   5 and name HA   ))   ( (resid  45 and name HN   ))     5.12  3.32  0.77
 assign ((resid  36 and name HA   ))   ( (resid  45 and name HN   ))     4.98  3.18  0.75
 assign ((resid   6 and name HD1* ))   ( (resid  45 and name HN   ))     5.65  3.85  0.85
 assign ((resid   6 and name HG2* ))   ( (resid  45 and name HN   ))     4.83  3.03  0.72
 assign ((resid   7 and name HG1  ))   ( (resid  45 and name HN   ))     4.96  3.16  0.74
 assign ((resid   7 and name HG2  ))   ( (resid  45 and name HN   ))     4.96  3.16  0.74
 assign ((resid  46 and name HB2  ))   ( (resid  46 and name HE   ))     4.78  2.98  0.72
 assign ((resid  46 and name HB1  ))   ( (resid  46 and name HE   ))     5.08  3.28  0.76
 assign ((resid  49 and name HN   ))   ( (resid  50 and name HG2* ))     4.81  3.01  0.72
 assign ((resid  48 and name HA   ))   ( (resid  50 and name HN   ))     4.44  2.64  0.67
 assign ((resid  48 and name HG2* ))   ( (resid  50 and name HN   ))     5.17  3.37  0.78
 assign ((resid  52 and name HN   ))   ( (resid  54 and name HN   ))     5.13  3.33  0.77
 assign ((resid  51 and name HB1  ))   ( (resid  52 and name HN   ))     3.88  2.08  0.58
 assign ((resid  52 and name HN   ))   ( (resid  52 and name HG*  ))     4.08  2.28  0.61
 assign ((resid  51 and name HB2  ))   ( (resid  52 and name HN   ))     3.37  1.57  0.51
 assign ((resid  52 and name HN   ))   ( (resid  52 and name HB2  ))     3.67  1.87  0.55
 assign ((resid  52 and name HN   ))   ( (resid  52 and name HB1  ))     3.67  1.87  0.55
 assign ((resid  51 and name HG2  ))   ( (resid  52 and name HN   ))     5.14  3.34  0.77
 assign ((resid  52 and name HN   ))   ( (resid  54 and name HB   ))     5.56  3.76  0.83
 assign ((resid  53 and name HN   ))   ( (resid  56 and name HN   ))     5.39  3.59  0.81
 assign ((resid  53 and name HN   ))   ( (resid  55 and name HN   ))     4.41  2.61  0.66
 assign ((resid  53 and name HN   ))   ( (resid  54 and name HN   ))     3.47  1.67  0.52
 assign ((resid  53 and name HN   ))   ( (resid  54 and name HA   ))     5.20  3.40  0.78
 assign ((resid  53 and name HN   ))   ( (resid  53 and name HG2  ))     3.67  1.87  0.55
 assign ((resid  53 and name HN   ))   ( (resid  53 and name HG1  ))     3.63  1.83  0.54
 assign ((resid  51 and name HB2  ))   ( (resid  53 and name HE22 ))     5.68  3.88  0.85
 assign ((resid  52 and name HG*  ))   ( (resid  53 and name HN   ))     3.88  2.08  0.58
 assign ((resid  53 and name HN   ))   ( (resid  53 and name HB1  ))     2.98  1.18  0.45
 assign ((resid  53 and name HN   ))   ( (resid  53 and name HB2  ))     3.60  1.80  0.54
 assign ((resid  53 and name HN   ))   ( (resid  54 and name HG2* ))     4.60  2.80  0.69
 assign ((resid  51 and name HB2  ))   ( (resid  53 and name HE21 ))     4.73  2.93  0.71
 assign ((resid  55 and name HN   ))   ( (resid  55 and name HD2  ))     5.36  3.56  0.80
 assign ((resid  51 and name HD1  ))   ( (resid  54 and name HN   ))     5.20  3.40  0.78
 assign ((resid  57 and name HN   ))   ( (resid  58 and name HD2* ))     4.34  2.54  0.65
 assign ((resid  54 and name HG2* ))   ( (resid  57 and name HN   ))     5.15  3.35  0.77
 assign ((resid  54 and name HG1* ))   ( (resid  57 and name HN   ))     4.94  3.14  0.74
 assign ((resid  23 and name HE*  ))   ( (resid  59 and name HN   ))     5.59  3.79  0.84
 assign ((resid  57 and name HB2  ))   ( (resid  59 and name HN   ))     5.94  4.14  0.89
 assign ((resid  57 and name HB2  ))   ( (resid  60 and name HN   ))     5.47  3.67  0.82
 assign ((resid  60 and name HN   ))   ( (resid  61 and name HB2  ))     5.47  3.67  0.82
 assign ((resid  60 and name HN   ))   ( (resid  63 and name HB2  ))     5.89  4.09  0.88
 assign ((resid  60 and name HN   ))   ( (resid  61 and name HG*  ))     4.68  2.88  0.70
 assign ((resid   8 and name HZ   ))   ( (resid  62 and name HN   ))     4.95  3.15  0.74
 assign ((resid   8 and name HZ   ))   ( (resid  63 and name HN   ))     5.19  3.39  0.78
 assign ((resid  63 and name HN   ))   ( (resid  75 and name HE*  ))     5.21  3.41  0.78
 assign ((resid  63 and name HN   ))   ( (resid  66 and name HN   ))     4.79  2.99  0.72
 assign ((resid  62 and name HN   ))   ( (resid  63 and name HG1  ))     5.19  3.39  0.78
 assign ((resid  63 and name HN   ))   ( (resid  73 and name HG2* ))     4.64  2.84  0.70
 assign ((resid  59 and name HB*  ))   ( (resid  63 and name HN   ))     4.74  2.94  0.71
 assign ((resid  62 and name HB*  ))   ( (resid  64 and name HN   ))     4.83  3.03  0.72
 assign ((resid  64 and name HN   ))   ( (resid  65 and name HD1* ))     5.65  3.85  0.85
 assign ((resid  64 and name HN   ))   ( (resid  65 and name HD2* ))     5.37  3.57  0.81
 assign ((resid  64 and name HN   ))   ( (resid  73 and name HG1* ))     5.30  3.50  0.80
 assign ((resid  64 and name HN   ))   ( (resid  66 and name HB*  ))     4.95  3.15  0.74
 assign ((resid  64 and name HN   ))   ( (resid  67 and name HN   ))     6.00  4.20  0.90
 assign ((resid  64 and name HN   ))   ( (resid  64 and name HE   ))     5.34  3.54  0.80
 assign ((resid  61 and name HA   ))   ( (resid  64 and name HE   ))     4.78  2.98  0.72
 assign ((resid  64 and name HB2  ))   ( (resid  64 and name HE   ))     3.76  1.96  0.56
 assign ((resid  64 and name HB1  ))   ( (resid  64 and name HE   ))     3.88  2.08  0.58
 assign ((resid  64 and name HG2  ))   ( (resid  64 and name HE   ))     4.00  2.20  0.60
 assign ((resid  64 and name HG1  ))   ( (resid  64 and name HE   ))     4.09  2.29  0.61
 assign ((resid  64 and name HE   ))   ( (resid  65 and name HD2* ))     4.96  3.16  0.74
 assign ((resid   8 and name HZ   ))   ( (resid  65 and name HN   ))     4.60  2.80  0.69
 assign ((resid  65 and name HN   ))   ( (resid  69 and name HD*  ))     5.64  3.84  0.85
 assign ((resid   8 and name HE*  ))   ( (resid  66 and name HN   ))     3.67  1.87  0.55
 assign ((resid   8 and name HD*  ))   ( (resid  66 and name HN   ))     5.48  3.68  0.82
 assign ((resid  66 and name HN   ))   ( (resid  71 and name HG11 ))     5.16  3.36  0.77
 assign ((resid  66 and name HN   ))   ( (resid  73 and name HG2* ))     4.79  2.99  0.72
 assign ((resid  67 and name HN   ))   ( (resid  71 and name HG12 ))     5.46  3.66  0.82
 assign ((resid  67 and name HN   ))   ( (resid  73 and name HG1* ))     5.05  3.25  0.76
 assign ((resid  68 and name HN   ))   ( (resid  69 and name HD*  ))     4.49  2.69  0.67
 assign ((resid  65 and name HN   ))   ( (resid  68 and name HN   ))     4.58  2.78  0.69
 assign ((resid  69 and name HN   ))   ( (resid  71 and name HN   ))     4.11  2.31  0.62
 assign ((resid  68 and name HN   ))   ( (resid  69 and name HA   ))     5.35  3.55  0.80
 assign ((resid  65 and name HB1  ))   ( (resid  68 and name HN   ))     4.93  3.13  0.74
 assign ((resid  65 and name HD2* ))   ( (resid  68 and name HN   ))     4.77  2.97  0.72
 assign ((resid  15 and name HB*  ))   ( (resid  69 and name HN   ))     5.27  3.47  0.79
 assign ((resid  69 and name HN   ))   ( (resid  71 and name HG11 ))     5.68  3.88  0.85
 assign ((resid  69 and name HN   ))   ( (resid  71 and name HG12 ))     4.27  2.47  0.64
 assign ((resid  69 and name HN   ))   ( (resid  71 and name HG2* ))     4.80  3.00  0.72
 assign ((resid  69 and name HN   ))   ( (resid  70 and name HB2  ))     5.34  3.54  0.80
 assign ((resid  67 and name HB*  ))   ( (resid  69 and name HN   ))     5.46  3.66  0.82
 assign ((resid  69 and name HN   ))   ( (resid  71 and name HD1* ))     4.22  2.42  0.63
 assign ((resid  70 and name HN   ))   ( (resid  71 and name HA   ))     5.31  3.51  0.80
 assign ((resid  70 and name HN   ))   ( (resid  70 and name HD21 ))     5.38  3.58  0.81
 assign ((resid  67 and name HN   ))   ( (resid  70 and name HN   ))     4.59  2.79  0.69
 assign ((resid  68 and name HN   ))   ( (resid  71 and name HN   ))     5.04  3.24  0.76
 assign ((resid   9 and name HN   ))   ( (resid  72 and name HN   ))     3.53  1.73  0.53
 assign ((resid  76 and name HN   ))   ( (resid  77 and name HG2* ))     4.91  3.11  0.74
 assign ((resid   6 and name HG12 ))   ( (resid  76 and name HN   ))     5.42  3.62  0.81
 assign ((resid   6 and name HG2* ))   ( (resid  76 and name HN   ))     5.85  4.05  0.88
 assign ((resid   6 and name HA   ))   ( (resid  76 and name HN   ))     4.89  3.09  0.73
 assign ((resid  76 and name HG2* ))   ( (resid  78 and name HN   ))     4.91  3.11  0.74
 assign ((resid  78 and name HB2  ))   ( (resid  78 and name HE   ))     4.64  2.84  0.70
 assign ((resid  78 and name HB1  ))   ( (resid  78 and name HE   ))     4.64  2.84  0.70
 assign ((resid  78 and name HG*  ))   ( (resid  78 and name HE   ))     3.98  2.18  0.60
 assign ((resid  79 and name HN   ))   ( (resid  81 and name HN   ))     4.39  2.59  0.66
 assign ((resid  80 and name HN   ))   ( (resid  81 and name HN   ))     3.90  2.10  0.59
 assign ((resid  79 and name HN   ))   ( (resid  80 and name HN   ))     3.85  2.05  0.58
 assign ((resid  78 and name HA   ))   ( (resid  79 and name HN   ))     2.84  1.04  0.43
 assign ((resid  80 and name HN   ))   ( (resid  80 and name HB*  ))     3.15  1.35  0.47
 assign ((resid  78 and name HD*  ))   ( (resid  79 and name HN   ))     4.76  2.96  0.71
 assign ((resid  78 and name HB2  ))   ( (resid  79 and name HN   ))     3.81  2.01  0.57
 assign ((resid  78 and name HB1  ))   ( (resid  79 and name HN   ))     3.81  2.01  0.57
 assign ((resid  79 and name HN   ))   ( (resid  81 and name HG   ))     3.67  1.87  0.55
 assign ((resid  79 and name HN   ))   ( (resid  81 and name HD1* ))     4.66  2.86  0.70
 assign ((resid  80 and name HN   ))   ( (resid  81 and name HG   ))     4.55  2.75  0.68
 assign ((resid  80 and name HN   ))   ( (resid  81 and name HD1* ))     4.89  3.09  0.73
 assign ((resid  81 and name HN   ))   ( (resid  82 and name HN   ))     3.43  1.63  0.51
 assign ((resid  81 and name HN   ))   ( (resid  82 and name HA   ))     5.40  3.60  0.81
 assign ((resid  79 and name HA2  ))   ( (resid  81 and name HN   ))     4.64  2.84  0.70
 assign ((resid  80 and name HB*  ))   ( (resid  81 and name HN   ))     4.10  2.30  0.62
 assign ((resid  81 and name HN   ))   ( (resid  81 and name HG   ))     2.66  0.86  0.40
 assign ((resid  81 and name HN   ))   ( (resid  81 and name HB2  ))     3.76  1.96  0.56
 assign ((resid  80 and name HB*  ))   ( (resid  82 and name HN   ))     5.13  3.33  0.77
 assign ((resid  80 and name HA   ))   ( (resid  82 and name HN   ))     4.69  2.89  0.70
 assign ((resid  82 and name HA   ))   ( (resid  83 and name HN   ))     3.00  1.20  0.45
 assign ((resid  83 and name HN   ))   ( (resid  83 and name HB1  ))     4.00  2.20  0.60
 assign ((resid  83 and name HN   ))   ( (resid  83 and name HB2  ))     4.00  2.20  0.60
 assign ((resid   4 and name HN   ))   ( (resid  47 and name HB   ))     5.11  3.31  0.77
 assign ((resid   4 and name HN   ))   ( (resid  55 and name HG1  ))     5.59  3.79  0.84
 assign ((resid  30 and name HN   ))   ( (resid  47 and name HG2* ))     6.00  4.20  0.90
 assign ((resid  30 and name HN   ))   ( (resid  58 and name HD1* ))     6.00  4.20  0.90
 assign ((resid  30 and name HN   ))   ( (resid  58 and name HD2* ))     6.00  4.20  0.90
 assign ((resid  11 and name HA   ))   ( (resid  41 and name HD21 ))     3.54  1.74  0.53
 assign ((resid  11 and name HA   ))   ( (resid  41 and name HD22 ))     3.62  1.82  0.54
 assign ((resid  51 and name HA   ))   ( (resid  52 and name HN   ))     3.12  1.32  0.47
 assign ((resid  69 and name HN   ))   ( (resid  70 and name HA   ))     4.60  2.80  0.69
 assign ((resid   3 and name HA   ))   ( (resid   3 and name HG*  ))     3.71  1.91  0.56
 assign ((resid   4 and name HA   ))   ( (resid   4 and name HG*  ))     4.09  2.29  0.61
 assign ((resid   4 and name HB1  ))   ( (resid   4 and name HE*  ))     4.51  2.71  0.68
 assign ((resid   4 and name HA   ))   ( (resid   4 and name HE*  ))     4.88  3.08  0.73
 assign ((resid   4 and name HB2  ))   ( (resid   4 and name HE*  ))     4.16  2.36  0.62
 assign ((resid   4 and name HE*  ))   ( (resid  55 and name HB1  ))     4.92  3.12  0.74
 assign ((resid   4 and name HG*  ))   ( (resid   4 and name HE*  ))     3.44  1.64  0.52
 assign ((resid   5 and name HN   ))   ( (resid   5 and name HB2  ))     3.81  2.01  0.57
 assign ((resid   5 and name HN   ))   ( (resid   5 and name HB1  ))     3.81  2.01  0.57
 assign ((resid   6 and name HA   ))   ( (resid   6 and name HG11 ))     3.78  1.98  0.57
 assign ((resid   6 and name HA   ))   ( (resid   6 and name HG12 ))     3.69  1.89  0.55
 assign ((resid   6 and name HA   ))   ( (resid   6 and name HG2* ))     3.39  1.59  0.51
 assign ((resid   6 and name HG2* ))   ( (resid   6 and name HG11 ))     3.58  1.78  0.54
 assign ((resid   6 and name HG2* ))   ( (resid   6 and name HG12 ))     2.90  1.10  0.44
 assign ((resid   4 and name HE*  ))   ( (resid   6 and name HG11 ))     3.70  1.90  0.56
 assign ((resid   6 and name HN   ))   ( (resid   6 and name HD1* ))     4.09  2.29  0.61
 assign ((resid   6 and name HA   ))   ( (resid   6 and name HD1* ))     3.98  2.18  0.60
 assign ((resid   6 and name HB   ))   ( (resid   6 and name HD1* ))     2.84  1.04  0.43
 assign ((resid   6 and name HG2* ))   ( (resid   6 and name HD1* ))     2.77  0.97  0.42
 assign ((resid   7 and name HA   ))   ( (resid   7 and name HG2  ))     4.00  2.20  0.60
 assign ((resid   7 and name HG2  ))   ( (resid  43 and name HN   ))     5.68  3.88  0.85
 assign ((resid   7 and name HG1  ))   ( (resid  43 and name HN   ))     5.68  3.88  0.85
 assign ((resid   7 and name HA   ))   ( (resid   7 and name HG1  ))     4.00  2.20  0.60
 assign ((resid   7 and name HA   ))   ( (resid   7 and name HD2  ))     4.69  2.89  0.70
 assign ((resid   7 and name HB2  ))   ( (resid   7 and name HD2  ))     3.73  1.93  0.56
 assign ((resid   7 and name HB1  ))   ( (resid   7 and name HD2  ))     3.73  1.93  0.56
 assign ((resid   7 and name HA   ))   ( (resid   7 and name HD1  ))     4.69  2.89  0.70
 assign ((resid   7 and name HB2  ))   ( (resid   7 and name HD1  ))     3.73  1.93  0.56
 assign ((resid   7 and name HB1  ))   ( (resid   7 and name HD1  ))     3.73  1.93  0.56
 assign ((resid   9 and name HA   ))   ( (resid   9 and name HG*  ))     3.31  1.51  0.50
 assign ((resid   9 and name HB2  ))   ( (resid   9 and name HG*  ))     2.63  0.83  0.39
 assign ((resid   9 and name HB1  ))   ( (resid   9 and name HG*  ))     2.63  0.83  0.39
 assign ((resid   9 and name HN   ))   ( (resid   9 and name HD*  ))     4.78  2.98  0.72
 assign ((resid   9 and name HA   ))   ( (resid   9 and name HD*  ))     4.13  2.33  0.62
 assign ((resid   9 and name HB2  ))   ( (resid   9 and name HD*  ))     3.03  1.23  0.45
 assign ((resid   9 and name HB1  ))   ( (resid   9 and name HD*  ))     3.03  1.23  0.45
 assign ((resid   9 and name HG*  ))   ( (resid   9 and name HD*  ))     2.59  0.79  0.39
 assign ((resid  13 and name HA   ))   ( (resid  13 and name HG   ))     4.10  2.30  0.62
 assign ((resid  13 and name HA   ))   ( (resid  13 and name HD2* ))     4.31  2.51  0.65
 assign ((resid  13 and name HB2  ))   ( (resid  13 and name HD2* ))     3.66  1.86  0.55
 assign ((resid  13 and name HB1  ))   ( (resid  13 and name HD2* ))     3.62  1.82  0.54
 assign ((resid  13 and name HN   ))   ( (resid  13 and name HD1* ))     4.49  2.69  0.67
 assign ((resid  13 and name HA   ))   ( (resid  13 and name HD1* ))     4.31  2.51  0.65
 assign ((resid  13 and name HB2  ))   ( (resid  13 and name HD1* ))     3.66  1.86  0.55
 assign ((resid  13 and name HB1  ))   ( (resid  13 and name HD1* ))     3.62  1.82  0.54
 assign ((resid  14 and name HN   ))   ( (resid  14 and name HB1  ))     3.64  1.84  0.55
 assign ((resid  14 and name HA   ))   ( (resid  14 and name HG2  ))     3.84  2.04  0.58
 assign ((resid  14 and name HA   ))   ( (resid  14 and name HG1  ))     3.84  2.04  0.58
 assign ((resid  16 and name HA   ))   ( (resid  16 and name HG   ))     3.81  2.01  0.57
 assign ((resid  16 and name HA   ))   ( (resid  43 and name HD2* ))     3.47  1.67  0.52
 assign ((resid  16 and name HB2  ))   ( (resid  16 and name HD1* ))     3.35  1.55  0.50
 assign ((resid  16 and name HB1  ))   ( (resid  16 and name HD1* ))     3.40  1.60  0.51
 assign ((resid  16 and name HN   ))   ( (resid  16 and name HG   ))     3.17  1.37  0.48
 assign ((resid  16 and name HA   ))   ( (resid  16 and name HD1* ))     4.07  2.27  0.61
 assign ((resid  16 and name HA   ))   ( (resid  16 and name HD2* ))     3.03  1.23  0.45
 assign ((resid  16 and name HB2  ))   ( (resid  16 and name HD2* ))     3.68  1.88  0.55
 assign ((resid  16 and name HB1  ))   ( (resid  16 and name HD2* ))     3.50  1.70  0.53
 assign ((resid  17 and name HA   ))   ( (resid  17 and name HG2  ))     4.09  2.29  0.61
 assign ((resid  17 and name HA   ))   ( (resid  17 and name HG1  ))     4.09  2.29  0.61
 assign ((resid  18 and name HA   ))   ( (resid  18 and name HG1  ))     3.35  1.55  0.50
 assign ((resid  18 and name HN   ))   ( (resid  18 and name HB1  ))     4.06  2.26  0.61
 assign ((resid  18 and name HB1  ))   ( (resid  18 and name HE2  ))     5.57  3.77  0.84
 assign ((resid  18 and name HB1  ))   ( (resid  18 and name HE1  ))     5.57  3.77  0.84
 assign ((resid  18 and name HN   ))   ( (resid  18 and name HB2  ))     3.83  2.03  0.57
 assign ((resid  18 and name HB2  ))   ( (resid  18 and name HE2  ))     5.11  3.31  0.77
 assign ((resid  18 and name HB2  ))   ( (resid  18 and name HE1  ))     5.11  3.31  0.77
 assign ((resid  18 and name HN   ))   ( (resid  18 and name HG1  ))     3.90  2.10  0.59
 assign ((resid  18 and name HG1  ))   ( (resid  18 and name HE1  ))     4.18  2.38  0.63
 assign ((resid  18 and name HN   ))   ( (resid  18 and name HG2  ))     4.43  2.63  0.66
 assign ((resid  18 and name HA   ))   ( (resid  18 and name HG2  ))     3.61  1.81  0.54
 assign ((resid  18 and name HB1  ))   ( (resid  18 and name HG2  ))     2.85  1.05  0.43
 assign ((resid  18 and name HN   ))   ( (resid  18 and name HD1  ))     4.17  2.37  0.63
 assign ((resid  18 and name HA   ))   ( (resid  18 and name HD1  ))     4.37  2.57  0.66
 assign ((resid  18 and name HB2  ))   ( (resid  18 and name HD1  ))     2.90  1.10  0.44
 assign ((resid  18 and name HN   ))   ( (resid  18 and name HD2  ))     4.49  2.69  0.67
 assign ((resid  18 and name HA   ))   ( (resid  18 and name HD2  ))     4.09  2.29  0.61
 assign ((resid  18 and name HB2  ))   ( (resid  18 and name HD2  ))     3.26  1.46  0.49
 assign ((resid  18 and name HN   ))   ( (resid  18 and name HE2  ))     5.40  3.60  0.81
 assign ((resid  18 and name HA   ))   ( (resid  18 and name HE2  ))     5.72  3.92  0.86
 assign ((resid  18 and name HG2  ))   ( (resid  18 and name HE2  ))     3.73  1.93  0.56
 assign ((resid  18 and name HG1  ))   ( (resid  18 and name HE2  ))     4.18  2.38  0.63
 assign ((resid  18 and name HN   ))   ( (resid  18 and name HE1  ))     5.40  3.60  0.81
 assign ((resid  18 and name HA   ))   ( (resid  18 and name HE1  ))     5.72  3.92  0.86
 assign ((resid  18 and name HG2  ))   ( (resid  18 and name HE1  ))     3.73  1.93  0.56
 assign ((resid  20 and name HA   ))   ( (resid  20 and name HD1* ))     4.39  2.59  0.66
 assign ((resid  20 and name HA   ))   ( (resid  20 and name HD2* ))     4.39  2.59  0.66
 assign ((resid  20 and name HB2  ))   ( (resid  20 and name HD1* ))     4.13  2.33  0.62
 assign ((resid  20 and name HB2  ))   ( (resid  20 and name HD2* ))     4.13  2.33  0.62
 assign ((resid  20 and name HN   ))   ( (resid  20 and name HG   ))     4.67  2.87  0.70
 assign ((resid  20 and name HA   ))   ( (resid  20 and name HG   ))     4.10  2.30  0.62
 assign ((resid  20 and name HG   ))   ( (resid  21 and name HA   ))     4.62  2.82  0.69
 assign ((resid  21 and name HA   ))   ( (resid  21 and name HB*  ))     2.97  1.17  0.45
 assign ((resid  21 and name HA   ))   ( (resid  21 and name HG2  ))     3.76  1.96  0.56
 assign ((resid  21 and name HA   ))   ( (resid  21 and name HG1  ))     3.76  1.96  0.56
 assign ((resid  21 and name HA   ))   ( (resid  21 and name HD*  ))     4.31  2.51  0.65
 assign ((resid  21 and name HA   ))   ( (resid  21 and name HE*  ))     4.89  3.09  0.73
 assign ((resid  21 and name HB*  ))   ( (resid  21 and name HD*  ))     2.84  1.04  0.43
 assign ((resid  21 and name HG2  ))   ( (resid  21 and name HD*  ))     2.75  0.95  0.41
 assign ((resid  21 and name HG1  ))   ( (resid  21 and name HD*  ))     2.75  0.95  0.41
 assign ((resid  21 and name HB*  ))   ( (resid  21 and name HE*  ))     3.47  1.67  0.52
 assign ((resid  21 and name HG2  ))   ( (resid  21 and name HE*  ))     3.43  1.63  0.51
 assign ((resid  21 and name HG1  ))   ( (resid  21 and name HE*  ))     3.43  1.63  0.51
 assign ((resid  21 and name HD*  ))   ( (resid  21 and name HE*  ))     2.52  0.72  0.38
 assign ((resid  22 and name HA   ))   ( (resid  22 and name HG2  ))     3.82  2.02  0.57
 assign ((resid  22 and name HA   ))   ( (resid  22 and name HG1  ))     3.85  2.05  0.58
 assign ((resid  22 and name HB1  ))   ( (resid  22 and name HG1  ))     3.00  1.20  0.45
 assign ((resid  23 and name HA   ))   ( (resid  23 and name HG1  ))     4.17  2.37  0.63
 assign ((resid  23 and name HA   ))   ( (resid  23 and name HG2  ))     4.20  2.40  0.63
 assign ((resid  23 and name HE*  ))   ( (resid  62 and name HN   ))     3.31  1.51  0.50
 assign ((resid  23 and name HB1  ))   ( (resid  23 and name HE*  ))     2.92  1.12  0.44
 assign ((resid  23 and name HB2  ))   ( (resid  23 and name HE*  ))     3.69  1.89  0.55
 assign ((resid  23 and name HG1  ))   ( (resid  23 and name HE*  ))     3.45  1.65  0.52
 assign ((resid  23 and name HG2  ))   ( (resid  23 and name HE*  ))     3.39  1.59  0.51
 assign ((resid  24 and name HA   ))   ( (resid  24 and name HG2* ))     2.98  1.18  0.45
 assign ((resid  24 and name HA   ))   ( (resid  24 and name HG11 ))     3.53  1.73  0.53
 assign ((resid  24 and name HA   ))   ( (resid  24 and name HG12 ))     3.32  1.52  0.50
 assign ((resid  24 and name HB   ))   ( (resid  24 and name HD1* ))     3.40  1.60  0.51
 assign ((resid  24 and name HN   ))   ( (resid  24 and name HG2* ))     3.84  2.04  0.58
 assign ((resid  24 and name HG2* ))   ( (resid  24 and name HD1* ))     2.83  1.03  0.42
 assign ((resid  24 and name HA   ))   ( (resid  24 and name HD1* ))     3.98  2.18  0.60
 assign ((resid  25 and name HA   ))   ( (resid  25 and name HG1  ))     3.62  1.82  0.54
 assign ((resid  25 and name HA   ))   ( (resid  25 and name HG2  ))     3.55  1.75  0.53
 assign ((resid  25 and name HA   ))   ( (resid  25 and name HD2  ))     4.61  2.81  0.69
 assign ((resid  25 and name HB1  ))   ( (resid  26 and name HE21 ))     3.93  2.13  0.59
 assign ((resid  25 and name HN   ))   ( (resid  25 and name HG1  ))     4.10  2.30  0.62
 assign ((resid  25 and name HN   ))   ( (resid  25 and name HG2  ))     5.02  3.22  0.75
 assign ((resid  25 and name HG2  ))   ( (resid  26 and name HE21 ))     5.43  3.63  0.81
 assign ((resid  25 and name HB2  ))   ( (resid  25 and name HD2  ))     3.44  1.64  0.52
 assign ((resid  25 and name HB1  ))   ( (resid  25 and name HD2  ))     3.40  1.60  0.51
 assign ((resid  25 and name HD1  ))   ( (resid  26 and name HE21 ))     4.68  2.88  0.70
 assign ((resid  25 and name HA   ))   ( (resid  25 and name HD1  ))     4.67  2.87  0.70
 assign ((resid  25 and name HB2  ))   ( (resid  25 and name HD1  ))     3.55  1.75  0.53
 assign ((resid  25 and name HB1  ))   ( (resid  25 and name HD1  ))     3.44  1.64  0.52
 assign ((resid  25 and name HG2  ))   ( (resid  25 and name HD1  ))     2.93  1.13  0.44
 assign ((resid  26 and name HN   ))   ( (resid  26 and name HB2  ))     3.75  1.95  0.56
 assign ((resid  26 and name HB2  ))   ( (resid  26 and name HE21 ))     4.60  2.80  0.69
 assign ((resid  26 and name HN   ))   ( (resid  26 and name HB1  ))     3.64  1.84  0.55
 assign ((resid  26 and name HB1  ))   ( (resid  26 and name HE21 ))     4.81  3.01  0.72
 assign ((resid  26 and name HE21 ))   ( (resid  61 and name HB1  ))     5.21  3.41  0.78
 assign ((resid  26 and name HN   ))   ( (resid  26 and name HG1  ))     3.62  1.82  0.54
 assign ((resid  26 and name HA   ))   ( (resid  26 and name HG1  ))     3.87  2.07  0.58
 assign ((resid  23 and name HE*  ))   ( (resid  26 and name HG1  ))     3.51  1.71  0.53
 assign ((resid  26 and name HN   ))   ( (resid  26 and name HG2  ))     3.42  1.62  0.51
 assign ((resid  26 and name HA   ))   ( (resid  26 and name HG2  ))     3.64  1.84  0.55
 assign ((resid  28 and name HA   ))   ( (resid  28 and name HB1  ))     2.75  0.95  0.41
 assign ((resid  28 and name HA   ))   ( (resid  28 and name HG2  ))     3.17  1.37  0.48
 assign ((resid  28 and name HB1  ))   ( (resid  28 and name HG2  ))     2.68  0.88  0.40
 assign ((resid  28 and name HN   ))   ( (resid  28 and name HG1  ))     3.73  1.93  0.56
 assign ((resid  28 and name HA   ))   ( (resid  28 and name HG1  ))     3.49  1.69  0.52
 assign ((resid  28 and name HB2  ))   ( (resid  28 and name HG1  ))     2.40  0.60  0.36
 assign ((resid  28 and name HN   ))   ( (resid  28 and name HD2  ))     5.86  4.06  0.88
 assign ((resid  28 and name HN   ))   ( (resid  28 and name HD1  ))     5.86  4.06  0.88
 assign ((resid  29 and name HA   ))   ( (resid  29 and name HB*  ))     2.75  0.95  0.41
 assign ((resid  26 and name HA   ))   ( (resid  29 and name HG1  ))     3.44  1.64  0.52
 assign ((resid  26 and name HA   ))   ( (resid  29 and name HD2  ))     4.11  2.31  0.62
 assign ((resid  26 and name HA   ))   ( (resid  29 and name HD1  ))     4.11  2.31  0.62
 assign ((resid  29 and name HN   ))   ( (resid  29 and name HG2  ))     4.18  2.38  0.63
 assign ((resid  26 and name HA   ))   ( (resid  29 and name HG2  ))     3.44  1.64  0.52
 assign ((resid  29 and name HB*  ))   ( (resid  29 and name HD2  ))     3.55  1.75  0.53
 assign ((resid  29 and name HB*  ))   ( (resid  29 and name HD1  ))     3.55  1.75  0.53
 assign ((resid  26 and name HE21 ))   ( (resid  29 and name HE*  ))     5.72  3.92  0.86
 assign ((resid  29 and name HN   ))   ( (resid  29 and name HE*  ))     5.98  4.18  0.90
 assign ((resid  26 and name HA   ))   ( (resid  29 and name HE*  ))     4.63  2.83  0.69
 assign ((resid  29 and name HA   ))   ( (resid  29 and name HE*  ))     5.20  3.40  0.78
 assign ((resid  29 and name HB*  ))   ( (resid  29 and name HE*  ))     4.15  2.35  0.62
 assign ((resid  29 and name HG2  ))   ( (resid  29 and name HE*  ))     3.75  1.95  0.56
 assign ((resid  29 and name HG1  ))   ( (resid  29 and name HE*  ))     3.75  1.95  0.56
 assign ((resid  30 and name HD*  ))   ( (resid  30 and name HZ   ))     3.83  2.03  0.57
 assign ((resid  31 and name HN   ))   ( (resid  31 and name HB*  ))     3.01  1.21  0.45
 assign ((resid  33 and name HN   ))   ( (resid  33 and name HB   ))     3.27  1.47  0.49
 assign ((resid  33 and name HN   ))   ( (resid  33 and name HG2* ))     3.90  2.10  0.59
 assign ((resid  33 and name HA   ))   ( (resid  33 and name HG2* ))     2.83  1.03  0.42
 assign ((resid  34 and name HA   ))   ( (resid  34 and name HG1* ))     3.64  1.84  0.55
 assign ((resid  34 and name HA   ))   ( (resid  34 and name HG2* ))     3.73  1.93  0.56
 assign ((resid  35 and name HN   ))   ( (resid  35 and name HB   ))     4.00  2.20  0.60
 assign ((resid  33 and name HG2* ))   ( (resid  35 and name HN   ))     4.26  2.46  0.64
 assign ((resid  35 and name HN   ))   ( (resid  35 and name HG2* ))     4.57  2.77  0.69
 assign ((resid  35 and name HA   ))   ( (resid  35 and name HG2* ))     2.86  1.06  0.43
 assign ((resid  76 and name HA   ))   ( (resid  76 and name HG2* ))     3.19  1.39  0.48
 assign ((resid  37 and name HN   ))   ( (resid  37 and name HG2* ))     4.07  2.27  0.61
 assign ((resid  37 and name HA   ))   ( (resid  37 and name HG2* ))     3.26  1.46  0.49
 assign ((resid  34 and name HA   ))   ( (resid  47 and name HG11 ))     3.95  2.15  0.59
 assign ((resid  38 and name HA   ))   ( (resid  38 and name HD1* ))     4.04  2.24  0.61
 assign ((resid  38 and name HB1  ))   ( (resid  38 and name HD1* ))     3.72  1.92  0.56
 assign ((resid  38 and name HB2  ))   ( (resid  38 and name HD1* ))     3.32  1.52  0.50
 assign ((resid  38 and name HA   ))   ( (resid  38 and name HD2* ))     3.46  1.66  0.52
 assign ((resid  38 and name HB1  ))   ( (resid  38 and name HD2* ))     3.94  2.14  0.59
 assign ((resid  38 and name HB2  ))   ( (resid  38 and name HD2* ))     3.18  1.38  0.48
 assign ((resid  41 and name HN   ))   ( (resid  41 and name HB1  ))     3.92  2.12  0.59
 assign ((resid  42 and name HN   ))   ( (resid  42 and name HB2  ))     3.81  2.01  0.57
 assign ((resid  42 and name HN   ))   ( (resid  42 and name HB1  ))     3.81  2.01  0.57
 assign ((resid  38 and name HD2* ))   ( (resid  43 and name HB2  ))     4.05  2.25  0.61
 assign ((resid  43 and name HG   ))   ( (resid  44 and name HA   ))     4.89  3.09  0.73
 assign ((resid  43 and name HA   ))   ( (resid  43 and name HD1* ))     3.30  1.50  0.50
 assign ((resid  43 and name HB1  ))   ( (resid  43 and name HD1* ))     3.29  1.49  0.49
 assign ((resid  43 and name HB2  ))   ( (resid  43 and name HD1* ))     3.49  1.69  0.52
 assign ((resid  38 and name HD2* ))   ( (resid  43 and name HD1* ))     2.73  0.93  0.41
 assign ((resid  43 and name HN   ))   ( (resid  43 and name HD2* ))     4.66  2.86  0.70
 assign ((resid  43 and name HA   ))   ( (resid  43 and name HD2* ))     4.50  2.70  0.68
 assign ((resid  43 and name HB1  ))   ( (resid  43 and name HD2* ))     3.47  1.67  0.52
 assign ((resid  43 and name HB2  ))   ( (resid  43 and name HD2* ))     3.69  1.89  0.55
 assign ((resid  44 and name HN   ))   ( (resid  44 and name HB2  ))     4.16  2.36  0.62
 assign ((resid  44 and name HN   ))   ( (resid  44 and name HB1  ))     4.18  2.38  0.63
 assign ((resid  44 and name HN   ))   ( (resid  44 and name HG2  ))     5.00  3.20  0.75
 assign ((resid  44 and name HA   ))   ( (resid  44 and name HG2  ))     4.07  2.27  0.61
 assign ((resid  44 and name HN   ))   ( (resid  44 and name HG1  ))     5.00  3.20  0.75
 assign ((resid  44 and name HA   ))   ( (resid  44 and name HG1  ))     4.07  2.27  0.61
 assign ((resid  45 and name HA   ))   ( (resid  45 and name HG11 ))     4.11  2.31  0.62
 assign ((resid  45 and name HA   ))   ( (resid  45 and name HD1* ))     4.09  2.29  0.61
 assign ((resid  45 and name HB   ))   ( (resid  45 and name HD1* ))     3.10  1.30  0.47
 assign ((resid  45 and name HA   ))   ( (resid  45 and name HG2* ))     3.68  1.88  0.55
 assign ((resid  45 and name HG2* ))   ( (resid  45 and name HG12 ))     2.90  1.10  0.44
 assign ((resid  34 and name HG2* ))   ( (resid  45 and name HG2* ))     2.77  0.97  0.42
 assign ((resid  45 and name HG2* ))   ( (resid  45 and name HG11 ))     3.33  1.53  0.50
 assign ((resid  45 and name HG2* ))   ( (resid  45 and name HD1* ))     2.55  0.75  0.38
 assign ((resid  46 and name HA   ))   ( (resid  46 and name HG*  ))     4.14  2.34  0.62
 assign ((resid  46 and name HN   ))   ( (resid  46 and name HD2  ))     5.27  3.47  0.79
 assign ((resid  46 and name HB1  ))   ( (resid  46 and name HD2  ))     3.89  2.09  0.58
 assign ((resid  46 and name HB2  ))   ( (resid  46 and name HD2  ))     3.94  2.14  0.59
 assign ((resid  46 and name HN   ))   ( (resid  46 and name HD1  ))     5.27  3.47  0.79
 assign ((resid  46 and name HB1  ))   ( (resid  46 and name HD1  ))     3.89  2.09  0.58
 assign ((resid  46 and name HB2  ))   ( (resid  46 and name HD1  ))     3.94  2.14  0.59
 assign ((resid  47 and name HA   ))   ( (resid  47 and name HG12 ))     3.52  1.72  0.53
 assign ((resid  47 and name HA   ))   ( (resid  47 and name HG2* ))     3.13  1.33  0.47
 assign ((resid  47 and name HG2* ))   ( (resid  47 and name HG11 ))     3.87  2.07  0.58
 assign ((resid  47 and name HG2* ))   ( (resid  58 and name HG   ))     4.18  2.38  0.63
 assign ((resid  47 and name HG2* ))   ( (resid  47 and name HG12 ))     3.02  1.22  0.45
 assign ((resid  47 and name HA   ))   ( (resid  47 and name HG11 ))     3.88  2.08  0.58
 assign ((resid  47 and name HB   ))   ( (resid  47 and name HG11 ))     2.72  0.92  0.41
 assign ((resid  47 and name HA   ))   ( (resid  47 and name HD1* ))     3.89  2.09  0.58
 assign ((resid  47 and name HB   ))   ( (resid  47 and name HD1* ))     3.00  1.20  0.45
 assign ((resid  33 and name HG2* ))   ( (resid  48 and name HN   ))     3.58  1.78  0.54
 assign ((resid  48 and name HA   ))   ( (resid  48 and name HG2* ))     3.34  1.54  0.50
 assign ((resid  50 and name HA   ))   ( (resid  50 and name HG1* ))     3.47  1.67  0.52
 assign ((resid  50 and name HA   ))   ( (resid  50 and name HG2* ))     3.73  1.93  0.56
 assign ((resid  51 and name HD2  ))   ( (resid  53 and name HG1  ))     5.67  3.87  0.85
 assign ((resid  50 and name HB   ))   ( (resid  51 and name HD2  ))     3.94  2.14  0.59
 assign ((resid  50 and name HB   ))   ( (resid  51 and name HD1  ))     4.51  2.71  0.68
 assign ((resid  52 and name HA   ))   ( (resid  52 and name HG*  ))     3.28  1.48  0.49
 assign ((resid  52 and name HB2  ))   ( (resid  52 and name HG*  ))     2.81  1.01  0.42
 assign ((resid  52 and name HB1  ))   ( (resid  52 and name HG*  ))     2.81  1.01  0.42
 assign ((resid  53 and name HA   ))   ( (resid  53 and name HB1  ))     2.96  1.16  0.44
 assign ((resid  53 and name HA   ))   ( (resid  53 and name HG1  ))     3.63  1.83  0.54
 assign ((resid  53 and name HA   ))   ( (resid  53 and name HE21 ))     5.09  3.29  0.76
 assign ((resid  53 and name HB1  ))   ( (resid  53 and name HE21 ))     4.42  2.62  0.66
 assign ((resid  53 and name HB2  ))   ( (resid  53 and name HE22 ))     4.53  2.73  0.68
 assign ((resid  53 and name HB2  ))   ( (resid  53 and name HE21 ))     4.43  2.63  0.66
 assign ((resid  53 and name HA   ))   ( (resid  53 and name HG2  ))     3.94  2.14  0.59
 assign ((resid  54 and name HA   ))   ( (resid  54 and name HG1* ))     3.56  1.76  0.53
 assign ((resid  54 and name HN   ))   ( (resid  54 and name HG2* ))     3.28  1.48  0.49
 assign ((resid  54 and name HA   ))   ( (resid  54 and name HG2* ))     3.25  1.45  0.49
 assign ((resid  55 and name HA   ))   ( (resid  55 and name HG2  ))     3.81  2.01  0.57
 assign ((resid  55 and name HA   ))   ( (resid  55 and name HG1  ))     3.53  1.73  0.53
 assign ((resid   4 and name HB1  ))   ( (resid  55 and name HG2  ))     4.03  2.23  0.60
 assign ((resid  55 and name HN   ))   ( (resid  55 and name HD1  ))     5.36  3.56  0.80
 assign ((resid  52 and name HA   ))   ( (resid  55 and name HD1  ))     4.88  3.08  0.73
 assign ((resid  55 and name HA   ))   ( (resid  55 and name HD1  ))     5.46  3.66  0.82
 assign ((resid   4 and name HE*  ))   ( (resid  56 and name HA   ))     4.36  2.56  0.65
 assign ((resid  56 and name HN   ))   ( (resid  56 and name HB1  ))     3.77  1.97  0.57
 assign ((resid  56 and name HA   ))   ( (resid  56 and name HG1  ))     3.76  1.96  0.56
 assign ((resid  56 and name HN   ))   ( (resid  56 and name HG2  ))     3.97  2.17  0.60
 assign ((resid  56 and name HA   ))   ( (resid  56 and name HG2  ))     3.41  1.61  0.51
 assign ((resid  56 and name HA   ))   ( (resid  56 and name HD*  ))     4.22  2.42  0.63
 assign ((resid  56 and name HA   ))   ( (resid  60 and name HD*  ))     4.69  2.89  0.70
 assign ((resid  56 and name HB2  ))   ( (resid  56 and name HD*  ))     3.03  1.23  0.45
 assign ((resid  56 and name HB1  ))   ( (resid  56 and name HD*  ))     3.14  1.34  0.47
 assign ((resid  56 and name HG1  ))   ( (resid  56 and name HD*  ))     2.57  0.77  0.39
 assign ((resid  56 and name HG2  ))   ( (resid  56 and name HD*  ))     2.84  1.04  0.43
 assign ((resid  56 and name HN   ))   ( (resid  56 and name HE*  ))     4.78  2.98  0.72
 assign ((resid  56 and name HA   ))   ( (resid  56 and name HE*  ))     4.78  2.98  0.72
 assign ((resid  56 and name HA   ))   ( (resid  60 and name HE*  ))     5.27  3.47  0.79
 assign ((resid  56 and name HB2  ))   ( (resid  56 and name HE*  ))     4.72  2.92  0.71
 assign ((resid  56 and name HB2  ))   ( (resid  60 and name HE*  ))     5.01  3.21  0.75
 assign ((resid  56 and name HB1  ))   ( (resid  56 and name HE*  ))     4.10  2.30  0.62
 assign ((resid  56 and name HB1  ))   ( (resid  60 and name HE*  ))     4.32  2.52  0.65
 assign ((resid  56 and name HG1  ))   ( (resid  56 and name HE*  ))     3.30  1.50  0.50
 assign ((resid  56 and name HG2  ))   ( (resid  56 and name HE*  ))     3.26  1.46  0.49
 assign ((resid  57 and name HN   ))   ( (resid  57 and name HB1  ))     3.72  1.92  0.56
 assign ((resid  57 and name HB1  ))   ( (resid  57 and name HG*  ))     2.84  1.04  0.43
 assign ((resid  57 and name HN   ))   ( (resid  57 and name HG*  ))     2.97  1.17  0.45
 assign ((resid  57 and name HA   ))   ( (resid  57 and name HG*  ))     3.21  1.41  0.48
 assign ((resid  57 and name HB2  ))   ( (resid  57 and name HG*  ))     2.57  0.77  0.39
 assign ((resid  13 and name HA   ))   ( (resid  16 and name HG   ))     3.52  1.72  0.53
 assign ((resid  58 and name HA   ))   ( (resid  58 and name HD2* ))     3.25  1.45  0.49
 assign ((resid   4 and name HE*  ))   ( (resid  58 and name HB2  ))     3.70  1.90  0.56
 assign ((resid  47 and name HD1* ))   ( (resid  58 and name HB1  ))     3.90  2.10  0.59
 assign ((resid  58 and name HN   ))   ( (resid  58 and name HG   ))     4.01  2.21  0.60
 assign ((resid  47 and name HD1* ))   ( (resid  58 and name HG   ))     2.95  1.15  0.44
 assign ((resid  58 and name HA   ))   ( (resid  58 and name HD1* ))     2.78  0.98  0.42
 assign ((resid  58 and name HB2  ))   ( (resid  58 and name HD1* ))     3.34  1.54  0.50
 assign ((resid  58 and name HB1  ))   ( (resid  58 and name HD1* ))     3.34  1.54  0.50
 assign ((resid  47 and name HD1* ))   ( (resid  58 and name HD1* ))     2.53  0.73  0.38
 assign ((resid  58 and name HB2  ))   ( (resid  58 and name HD2* ))     3.30  1.50  0.50
 assign ((resid  58 and name HB1  ))   ( (resid  58 and name HD2* ))     3.48  1.68  0.52
 assign ((resid  60 and name HA   ))   ( (resid  60 and name HB1  ))     3.00  1.20  0.45
 assign ((resid  60 and name HA   ))   ( (resid  60 and name HG1  ))     3.30  1.50  0.50
 assign ((resid  60 and name HA   ))   ( (resid  60 and name HD*  ))     3.16  1.36  0.47
 assign ((resid  60 and name HN   ))   ( (resid  60 and name HB1  ))     3.54  1.74  0.53
 assign ((resid  60 and name HB2  ))   ( (resid  60 and name HG2  ))     2.91  1.11  0.44
 assign ((resid  60 and name HB2  ))   ( (resid  60 and name HD*  ))     3.15  1.35  0.47
 assign ((resid  60 and name HN   ))   ( (resid  60 and name HG2  ))     4.31  2.51  0.65
 assign ((resid  60 and name HA   ))   ( (resid  60 and name HG2  ))     3.64  1.84  0.55
 assign ((resid  60 and name HG2  ))   ( (resid  60 and name HD*  ))     2.60  0.80  0.39
 assign ((resid  60 and name HG1  ))   ( (resid  60 and name HD*  ))     2.89  1.09  0.43
 assign ((resid  60 and name HB1  ))   ( (resid  60 and name HD*  ))     3.41  1.61  0.51
 assign ((resid  60 and name HN   ))   ( (resid  60 and name HE*  ))     4.91  3.11  0.74
 assign ((resid  60 and name HA   ))   ( (resid  60 and name HE*  ))     4.86  3.06  0.73
 assign ((resid  60 and name HB1  ))   ( (resid  60 and name HE*  ))     4.38  2.58  0.66
 assign ((resid  60 and name HB2  ))   ( (resid  60 and name HE*  ))     3.92  2.12  0.59
 assign ((resid  60 and name HG2  ))   ( (resid  60 and name HE*  ))     3.08  1.28  0.46
 assign ((resid  60 and name HG1  ))   ( (resid  60 and name HE*  ))     3.46  1.66  0.52
 assign ((resid  56 and name HD*  ))   ( (resid  56 and name HE*  ))     2.71  0.91  0.41
 assign ((resid  60 and name HD*  ))   ( (resid  60 and name HE*  ))     2.89  1.09  0.43
 assign ((resid  23 and name HE*  ))   ( (resid  61 and name HB2  ))     3.28  1.48  0.49
 assign ((resid  61 and name HA   ))   ( (resid  61 and name HG*  ))     3.59  1.79  0.54
 assign ((resid  51 and name HB2  ))   ( (resid  53 and name HG1  ))     3.19  1.39  0.48
 assign ((resid  63 and name HA   ))   ( (resid  63 and name HG1  ))     3.47  1.67  0.52
 assign ((resid  63 and name HN   ))   ( (resid  63 and name HG2  ))     3.53  1.73  0.53
 assign ((resid  63 and name HA   ))   ( (resid  63 and name HG2  ))     3.29  1.49  0.49
 assign ((resid  64 and name HA   ))   ( (resid  67 and name HD*  ))     3.39  1.59  0.51
 assign ((resid  64 and name HA   ))   ( (resid  64 and name HG1  ))     3.77  1.97  0.57
 assign ((resid  64 and name HA   ))   ( (resid  64 and name HD1  ))     5.66  3.86  0.85
 assign ((resid  64 and name HB1  ))   ( (resid  64 and name HG2  ))     2.78  0.98  0.42
 assign ((resid  64 and name HB1  ))   ( (resid  64 and name HD1  ))     3.84  2.04  0.58
 assign ((resid  64 and name HB2  ))   ( (resid  64 and name HD1  ))     3.85  2.05  0.58
 assign ((resid  64 and name HA   ))   ( (resid  64 and name HG2  ))     3.93  2.13  0.59
 assign ((resid  64 and name HG1  ))   ( (resid  65 and name HG   ))     3.23  1.43  0.48
 assign ((resid  64 and name HN   ))   ( (resid  64 and name HD2  ))     4.74  2.94  0.71
 assign ((resid  64 and name HA   ))   ( (resid  64 and name HD2  ))     4.94  3.14  0.74
 assign ((resid  64 and name HB1  ))   ( (resid  64 and name HD2  ))     3.19  1.39  0.48
 assign ((resid  64 and name HB2  ))   ( (resid  64 and name HD2  ))     3.66  1.86  0.55
 assign ((resid  64 and name HN   ))   ( (resid  64 and name HD1  ))     4.56  2.76  0.68
 assign ((resid  64 and name HD1  ))   ( (resid  65 and name HG   ))     4.45  2.65  0.67
 assign ((resid  61 and name HB1  ))   ( (resid  64 and name HD1  ))     3.73  1.93  0.56
 assign ((resid  64 and name HG2  ))   ( (resid  64 and name HD1  ))     2.89  1.09  0.43
 assign ((resid  78 and name HB1  ))   ( (resid  78 and name HD*  ))     3.39  1.59  0.51
 assign ((resid  65 and name HA   ))   ( (resid  65 and name HG   ))     3.92  2.12  0.59
 assign ((resid  65 and name HA   ))   ( (resid  65 and name HD2* ))     2.93  1.13  0.44
 assign ((resid  65 and name HB1  ))   ( (resid  65 and name HD2* ))     3.25  1.45  0.49
 assign ((resid  65 and name HB2  ))   ( (resid  65 and name HD2* ))     3.42  1.62  0.51
 assign ((resid  65 and name HA   ))   ( (resid  65 and name HD1* ))     3.99  2.19  0.60
 assign ((resid  65 and name HB1  ))   ( (resid  65 and name HD1* ))     3.44  1.64  0.52
 assign ((resid  65 and name HB2  ))   ( (resid  65 and name HD1* ))     3.33  1.53  0.50
 assign ((resid  66 and name HN   ))   ( (resid  66 and name HB*  ))     2.73  0.93  0.41
 assign ((resid  67 and name HA   ))   ( (resid  67 and name HB*  ))     2.60  0.80  0.39
 assign ((resid  67 and name HA   ))   ( (resid  67 and name HG1  ))     3.78  1.98  0.57
 assign ((resid  67 and name HB*  ))   ( (resid  67 and name HG2  ))     2.85  1.05  0.43
 assign ((resid  67 and name HB*  ))   ( (resid  67 and name HG1  ))     2.93  1.13  0.44
 assign ((resid  67 and name HB*  ))   ( (resid  67 and name HD*  ))     2.92  1.12  0.44
 assign ((resid  67 and name HA   ))   ( (resid  67 and name HG2  ))     3.70  1.90  0.56
 assign ((resid  67 and name HG1  ))   ( (resid  67 and name HD*  ))     2.81  1.01  0.42
 assign ((resid  67 and name HG2  ))   ( (resid  67 and name HD*  ))     2.40  0.60  0.36
 assign ((resid  67 and name HD*  ))   ( (resid  67 and name HE*  ))     2.79  0.99  0.42
 assign ((resid  67 and name HN   ))   ( (resid  67 and name HE*  ))     4.99  3.19  0.75
 assign ((resid  67 and name HA   ))   ( (resid  67 and name HE*  ))     4.65  2.85  0.70
 assign ((resid  67 and name HB*  ))   ( (resid  67 and name HE*  ))     3.89  2.09  0.58
 assign ((resid  67 and name HG2  ))   ( (resid  67 and name HE*  ))     3.36  1.56  0.50
 assign ((resid  67 and name HG1  ))   ( (resid  67 and name HE*  ))     3.38  1.58  0.51
 assign ((resid  68 and name HA   ))   ( (resid  68 and name HG2  ))     3.94  2.14  0.59
 assign ((resid  68 and name HA   ))   ( (resid  68 and name HG1  ))     3.21  1.41  0.48
 assign ((resid  68 and name HN   ))   ( (resid  68 and name HG2  ))     4.57  2.77  0.69
 assign ((resid  68 and name HB1  ))   ( (resid  68 and name HG2  ))     2.40  0.60  0.36
 assign ((resid  68 and name HN   ))   ( (resid  68 and name HG1  ))     4.43  2.63  0.66
 assign ((resid  68 and name HB1  ))   ( (resid  68 and name HG1  ))     2.70  0.90  0.41
 assign ((resid  69 and name HA   ))   ( (resid  69 and name HD*  ))     3.19  1.39  0.48
 assign ((resid  70 and name HA   ))   ( (resid  70 and name HD21 ))     4.27  2.47  0.64
 assign ((resid  70 and name HA   ))   ( (resid  70 and name HB2  ))     2.85  1.05  0.43
 assign ((resid  70 and name HN   ))   ( (resid  70 and name HB1  ))     3.85  2.05  0.58
 assign ((resid  70 and name HA   ))   ( (resid  70 and name HB1  ))     3.02  1.22  0.45
 assign ((resid  71 and name HA   ))   ( (resid  71 and name HG2* ))     2.91  1.11  0.44
 assign ((resid  71 and name HA   ))   ( (resid  71 and name HG11 ))     4.21  2.41  0.63
 assign ((resid  71 and name HA   ))   ( (resid  71 and name HG12 ))     3.98  2.18  0.60
 assign ((resid  71 and name HA   ))   ( (resid  71 and name HD1* ))     4.19  2.39  0.63
 assign ((resid  15 and name HB*  ))   ( (resid  71 and name HG2* ))     3.03  1.23  0.45
 assign ((resid  71 and name HG2* ))   ( (resid  71 and name HG12 ))     3.52  1.72  0.53
 assign ((resid  71 and name HG2* ))   ( (resid  71 and name HG11 ))     4.00  2.20  0.60
 assign ((resid  71 and name HB   ))   ( (resid  71 and name HD1* ))     3.50  1.70  0.53
 assign ((resid  71 and name HG2* ))   ( (resid  71 and name HD1* ))     2.83  1.03  0.42
 assign ((resid  15 and name HB*  ))   ( (resid  71 and name HD1* ))     3.16  1.36  0.47
 assign ((resid  72 and name HN   ))   ( (resid  72 and name HB   ))     3.52  1.72  0.53
 assign ((resid  72 and name HA   ))   ( (resid  72 and name HG2* ))     2.85  1.05  0.43
 assign ((resid  73 and name HA   ))   ( (resid  73 and name HG1* ))     3.76  1.96  0.56
 assign ((resid  73 and name HA   ))   ( (resid  73 and name HG2* ))     3.17  1.37  0.48
 assign ((resid  74 and name HA   ))   ( (resid  74 and name HG2* ))     3.24  1.44  0.49
 assign ((resid  74 and name HN   ))   ( (resid  74 and name HB   ))     3.93  2.13  0.59
 assign ((resid  76 and name HN   ))   ( (resid  76 and name HB   ))     3.74  1.94  0.56
 assign ((resid  77 and name HA   ))   ( (resid  78 and name HG*  ))     4.95  3.15  0.74
 assign ((resid  77 and name HN   ))   ( (resid  77 and name HG2* ))     3.83  2.03  0.57
 assign ((resid  77 and name HA   ))   ( (resid  77 and name HG2* ))     3.15  1.35  0.47
 assign ((resid  77 and name HG2* ))   ( (resid  77 and name HG12 ))     3.20  1.40  0.48
 assign ((resid  77 and name HG2* ))   ( (resid  77 and name HG11 ))     3.29  1.49  0.49
 assign ((resid  77 and name HN   ))   ( (resid  77 and name HG12 ))     3.89  2.09  0.58
 assign ((resid  76 and name HA   ))   ( (resid  77 and name HG12 ))     4.13  2.33  0.62
 assign ((resid  77 and name HA   ))   ( (resid  77 and name HG11 ))     3.84  2.04  0.58
 assign ((resid  77 and name HN   ))   ( (resid  77 and name HD1* ))     4.37  2.57  0.66
 assign ((resid  77 and name HA   ))   ( (resid  77 and name HD1* ))     4.19  2.39  0.63
 assign ((resid  77 and name HB   ))   ( (resid  77 and name HD1* ))     3.08  1.28  0.46
 assign ((resid  78 and name HB2  ))   ( (resid  78 and name HG*  ))     2.92  1.12  0.44
 assign ((resid  78 and name HA   ))   ( (resid  78 and name HG*  ))     3.48  1.68  0.52
 assign ((resid  78 and name HB1  ))   ( (resid  78 and name HG*  ))     2.92  1.12  0.44
 assign ((resid  78 and name HN   ))   ( (resid  78 and name HD*  ))     4.66  2.86  0.70
 assign ((resid  78 and name HA   ))   ( (resid  78 and name HD*  ))     5.16  3.36  0.77
 assign ((resid  78 and name HB2  ))   ( (resid  78 and name HD*  ))     3.39  1.59  0.51
 assign ((resid  78 and name HG*  ))   ( (resid  78 and name HD*  ))     2.62  0.82  0.39
 assign ((resid  81 and name HA   ))   ( (resid  81 and name HD1* ))     4.16  2.36  0.62
 assign ((resid  81 and name HA   ))   ( (resid  81 and name HD2* ))     2.94  1.14  0.44
 assign ((resid  81 and name HA   ))   ( (resid  81 and name HG   ))     4.01  2.21  0.60
 assign ((resid  81 and name HB2  ))   ( (resid  81 and name HD1* ))     3.10  1.30  0.47
 assign ((resid  81 and name HB1  ))   ( (resid  81 and name HD1* ))     3.10  1.30  0.47
 assign ((resid  81 and name HB2  ))   ( (resid  81 and name HD2* ))     3.34  1.54  0.50
 assign ((resid  81 and name HB1  ))   ( (resid  81 and name HD2* ))     3.34  1.54  0.50
 assign ((resid  82 and name HA   ))   ( (resid  82 and name HG2  ))     4.20  2.40  0.63
 assign ((resid  82 and name HA   ))   ( (resid  82 and name HG1  ))     4.20  2.40  0.63
 assign ((resid  82 and name HN   ))   ( (resid  82 and name HB2  ))     3.73  1.93  0.56
 assign ((resid  83 and name HA   ))   ( (resid  83 and name HD2  ))     5.11  3.31  0.77
 assign ((resid   4 and name HA   ))   ( (resid   5 and name HN   ))     3.42  1.62  0.51
 assign ((resid   4 and name HG*  ))   ( (resid   5 and name HN   ))     4.23  2.43  0.63
 assign ((resid   4 and name HE*  ))   ( (resid   5 and name HN   ))     5.06  3.26  0.76
 assign ((resid   5 and name HA   ))   ( (resid   6 and name HN   ))     3.27  1.47  0.49
 assign ((resid   5 and name HB1  ))   ( (resid   6 and name HN   ))     4.61  2.81  0.69
 assign ((resid   6 and name HG11 ))   ( (resid   7 and name HN   ))     5.60  3.80  0.84
 assign ((resid   6 and name HG11 ))   ( (resid  47 and name HN   ))     6.00  4.20  0.90
 assign ((resid   6 and name HG12 ))   ( (resid   7 and name HN   ))     4.88  3.08  0.73
 assign ((resid   6 and name HD1* ))   ( (resid  47 and name HN   ))     4.96  3.16  0.74
 assign ((resid   7 and name HB1  ))   ( (resid   8 and name HN   ))     4.58  2.78  0.69
 assign ((resid   7 and name HG2  ))   ( (resid   8 and name HN   ))     4.83  3.03  0.72
 assign ((resid   7 and name HG1  ))   ( (resid   8 and name HN   ))     4.83  3.03  0.72
 assign ((resid   9 and name HA   ))   ( (resid  10 and name HN   ))     3.10  1.30  0.47
 assign ((resid   9 and name HB2  ))   ( (resid  10 and name HN   ))     4.29  2.49  0.64
 assign ((resid   9 and name HB1  ))   ( (resid  10 and name HN   ))     4.29  2.49  0.64
 assign ((resid   9 and name HG*  ))   ( (resid  10 and name HN   ))     3.85  2.05  0.58
 assign ((resid   9 and name HD*  ))   ( (resid  10 and name HN   ))     4.60  2.80  0.69
 assign ((resid  11 and name HB2  ))   ( (resid  12 and name HN   ))     4.11  2.31  0.62
 assign ((resid  14 and name HG2  ))   ( (resid  15 and name HN   ))     5.07  3.27  0.76
 assign ((resid  14 and name HG1  ))   ( (resid  15 and name HN   ))     5.07  3.27  0.76
 assign ((resid  15 and name HB*  ))   ( (resid  16 and name HN   ))     3.14  1.34  0.47
 assign ((resid  16 and name HD1* ))   ( (resid  17 and name HN   ))     4.71  2.91  0.71
 assign ((resid  17 and name HB2  ))   ( (resid  18 and name HN   ))     4.32  2.52  0.65
 assign ((resid  17 and name HG2  ))   ( (resid  18 and name HN   ))     5.10  3.30  0.77
 assign ((resid  17 and name HG1  ))   ( (resid  18 and name HN   ))     5.10  3.30  0.77
 assign ((resid  18 and name HG1  ))   ( (resid  19 and name HN   ))     5.04  3.24  0.76
 assign ((resid  18 and name HG2  ))   ( (resid  19 and name HN   ))     4.99  3.19  0.75
 assign ((resid  18 and name HD1  ))   ( (resid  19 and name HN   ))     4.72  2.92  0.71
 assign ((resid  18 and name HD2  ))   ( (resid  19 and name HN   ))     5.17  3.37  0.78
 assign ((resid  22 and name HG1  ))   ( (resid  23 and name HN   ))     4.71  2.91  0.71
 assign ((resid  23 and name HG2  ))   ( (resid  24 and name HN   ))     4.70  2.90  0.70
 assign ((resid  25 and name HG1  ))   ( (resid  26 and name HN   ))     5.12  3.32  0.77
 assign ((resid  25 and name HG2  ))   ( (resid  26 and name HN   ))     4.77  2.97  0.72
 assign ((resid  25 and name HD1  ))   ( (resid  26 and name HN   ))     5.29  3.49  0.79
 assign ((resid  26 and name HG1  ))   ( (resid  27 and name HN   ))     4.62  2.82  0.69
 assign ((resid  28 and name HG1  ))   ( (resid  29 and name HN   ))     4.45  2.65  0.67
 assign ((resid  29 and name HB*  ))   ( (resid  30 and name HN   ))     3.74  1.94  0.56
 assign ((resid  31 and name HB*  ))   ( (resid  32 and name HN   ))     3.84  2.04  0.58
 assign ((resid  32 and name HA2  ))   ( (resid  33 and name HN   ))     3.29  1.49  0.49
 assign ((resid  33 and name HB   ))   ( (resid  34 and name HN   ))     4.18  2.38  0.63
 assign ((resid  34 and name HG1* ))   ( (resid  35 and name HN   ))     3.86  2.06  0.58
 assign ((resid  41 and name HB1  ))   ( (resid  42 and name HN   ))     5.00  3.20  0.75
 assign ((resid  41 and name HB2  ))   ( (resid  42 and name HN   ))     5.16  3.36  0.77
 assign ((resid  43 and name HD1* ))   ( (resid  44 and name HN   ))     3.54  1.74  0.53
 assign ((resid  43 and name HD2* ))   ( (resid  44 and name HN   ))     5.14  3.34  0.77
 assign ((resid  45 and name HB   ))   ( (resid  46 and name HN   ))     4.71  2.91  0.71
 assign ((resid  45 and name HG12 ))   ( (resid  46 and name HN   ))     5.07  3.27  0.76
 assign ((resid  45 and name HG11 ))   ( (resid  46 and name HN   ))     5.67  3.87  0.85
 assign ((resid  45 and name HD1* ))   ( (resid  46 and name HN   ))     5.32  3.52  0.80
 assign ((resid  47 and name HN   ))   ( (resid  47 and name HD1* ))     4.38  2.58  0.66
 assign ((resid  48 and name HG2* ))   ( (resid  49 and name HN   ))     4.03  2.23  0.60
 assign ((resid  53 and name HG2  ))   ( (resid  54 and name HN   ))     4.84  3.04  0.73
 assign ((resid  57 and name HN   ))   ( (resid  60 and name HE*  ))     5.36  3.56  0.80
 assign ((resid  57 and name HB1  ))   ( (resid  58 and name HN   ))     3.93  2.13  0.59
 assign ((resid  57 and name HG*  ))   ( (resid  58 and name HN   ))     4.04  2.24  0.61
 assign ((resid  58 and name HG   ))   ( (resid  59 and name HN   ))     5.30  3.50  0.80
 assign ((resid  58 and name HD1* ))   ( (resid  59 and name HN   ))     5.29  3.49  0.79
 assign ((resid  65 and name HD2* ))   ( (resid  69 and name HN   ))     5.86  4.06  0.88
 assign ((resid  67 and name HG2  ))   ( (resid  69 and name HN   ))     4.85  3.05  0.73
 assign ((resid  60 and name HG1  ))   ( (resid  61 and name HN   ))     5.12  3.32  0.77
 assign ((resid  59 and name HN   ))   ( (resid  60 and name HD*  ))     4.65  2.85  0.70
 assign ((resid  59 and name HN   ))   ( (resid  60 and name HE*  ))     6.00  4.20  0.90
 assign ((resid  60 and name HE*  ))   ( (resid  61 and name HN   ))     6.00  4.20  0.90
 assign ((resid  61 and name HB1  ))   ( (resid  62 and name HN   ))     3.97  2.17  0.60
 assign ((resid  63 and name HG1  ))   ( (resid  64 and name HN   ))     4.68  2.88  0.70
 assign ((resid  63 and name HG2  ))   ( (resid  64 and name HN   ))     5.01  3.21  0.75
 assign ((resid  64 and name HB1  ))   ( (resid  65 and name HN   ))     4.08  2.28  0.61
 assign ((resid  64 and name HB2  ))   ( (resid  65 and name HN   ))     3.82  2.02  0.57
 assign ((resid  64 and name HD2  ))   ( (resid  65 and name HN   ))     5.29  3.49  0.79
 assign ((resid  64 and name HD1  ))   ( (resid  65 and name HN   ))     5.13  3.33  0.77
 assign ((resid  65 and name HD2* ))   ( (resid  66 and name HN   ))     5.04  3.24  0.76
 assign ((resid  65 and name HD1* ))   ( (resid  66 and name HN   ))     4.53  2.73  0.68
 assign ((resid  67 and name HB*  ))   ( (resid  68 and name HN   ))     3.71  1.91  0.56
 assign ((resid  67 and name HG1  ))   ( (resid  68 and name HN   ))     4.49  2.69  0.67
 assign ((resid  67 and name HE*  ))   ( (resid  68 and name HN   ))     5.47  3.67  0.82
 assign ((resid  68 and name HB2  ))   ( (resid  69 and name HN   ))     4.07  2.27  0.61
 assign ((resid  68 and name HG2  ))   ( (resid  69 and name HN   ))     4.25  2.45  0.64
 assign ((resid  70 and name HB2  ))   ( (resid  71 and name HN   ))     4.61  2.81  0.69
 assign ((resid  71 and name HG12 ))   ( (resid  72 and name HN   ))     4.97  3.17  0.75
 assign ((resid  72 and name HB   ))   ( (resid  73 and name HN   ))     3.18  1.38  0.48
 assign ((resid  72 and name HG2* ))   ( (resid  73 and name HN   ))     3.39  1.59  0.51
 assign ((resid  73 and name HB   ))   ( (resid  74 and name HN   ))     4.22  2.42  0.63
 assign ((resid  74 and name HB   ))   ( (resid  75 and name HN   ))     3.94  2.14  0.59
 assign ((resid  74 and name HG2* ))   ( (resid  75 and name HN   ))     4.01  2.21  0.60
 assign ((resid  75 and name HB1  ))   ( (resid  76 and name HN   ))     3.92  2.12  0.59
 assign ((resid  33 and name HG2* ))   ( (resid  34 and name HN   ))     3.02  1.22  0.45
 assign ((resid  77 and name HD1* ))   ( (resid  78 and name HN   ))     4.98  3.18  0.75
 assign ((resid  81 and name HB1  ))   ( (resid  82 and name HN   ))     4.26  2.46  0.64
 assign ((resid  58 and name HA   ))   ( (resid  60 and name HN   ))     5.22  3.42  0.78
 assign ((resid  30 and name HE*  ))   ( (resid  58 and name HA   ))     4.47  2.67  0.67
 assign ((resid  13 and name HA   ))   ( (resid  16 and name HB2  ))     3.71  1.91  0.56
 assign ((resid  13 and name HA   ))   ( (resid  16 and name HB1  ))     4.86  3.06  0.73
 assign ((resid  14 and name HA   ))   ( (resid  16 and name HN   ))     4.91  3.11  0.74
 assign ((resid  14 and name HA   ))   ( (resid  17 and name HN   ))     4.12  2.32  0.62
 assign ((resid  14 and name HA   ))   ( (resid  17 and name HB1  ))     4.68  2.88  0.70
 assign ((resid  14 and name HA   ))   ( (resid  17 and name HB2  ))     3.35  1.55  0.50
 assign ((resid  14 and name HA   ))   ( (resid  18 and name HN   ))     4.58  2.78  0.69
 assign ((resid  15 and name HA   ))   ( (resid  18 and name HN   ))     4.35  2.55  0.65
 assign ((resid  15 and name HA   ))   ( (resid  18 and name HB1  ))     4.46  2.66  0.67
 assign ((resid  15 and name HA   ))   ( (resid  18 and name HB2  ))     3.58  1.78  0.54
 assign ((resid  16 and name HA   ))   ( (resid  19 and name HN   ))     4.13  2.33  0.62
 assign ((resid  16 and name HA   ))   ( (resid  19 and name HB*  ))     3.25  1.45  0.49
 assign ((resid  17 and name HA   ))   ( (resid  20 and name HB1  ))     3.89  2.09  0.58
 assign ((resid  17 and name HA   ))   ( (resid  20 and name HB2  ))     4.28  2.48  0.64
 assign ((resid  18 and name HA   ))   ( (resid  21 and name HB*  ))     3.33  1.53  0.50
 assign ((resid  19 and name HA   ))   ( (resid  22 and name HB2  ))     4.12  2.32  0.62
 assign ((resid  19 and name HA   ))   ( (resid  22 and name HB1  ))     4.55  2.75  0.68
 assign ((resid  20 and name HA   ))   ( (resid  23 and name HB1  ))     4.74  2.94  0.71
 assign ((resid  20 and name HA   ))   ( (resid  23 and name HB2  ))     4.28  2.48  0.64
 assign ((resid  21 and name HA   ))   ( (resid  23 and name HN   ))     4.99  3.19  0.75
 assign ((resid  21 and name HA   ))   ( (resid  24 and name HN   ))     4.14  2.34  0.62
 assign ((resid  21 and name HA   ))   ( (resid  24 and name HB   ))     3.42  1.62  0.51
 assign ((resid  22 and name HA   ))   ( (resid  24 and name HN   ))     4.70  2.90  0.70
 assign ((resid  22 and name HA   ))   ( (resid  25 and name HN   ))     3.84  2.04  0.58
 assign ((resid  22 and name HA   ))   ( (resid  25 and name HB2  ))     3.37  1.57  0.51
 assign ((resid  22 and name HA   ))   ( (resid  25 and name HB1  ))     3.84  2.04  0.58
 assign ((resid  23 and name HA   ))   ( (resid  26 and name HE21 ))     5.71  3.91  0.86
 assign ((resid  23 and name HA   ))   ( (resid  26 and name HN   ))     4.00  2.20  0.60
 assign ((resid  23 and name HA   ))   ( (resid  26 and name HB2  ))     3.75  1.95  0.56
 assign ((resid  23 and name HA   ))   ( (resid  23 and name HE*  ))     3.19  1.39  0.48
 assign ((resid  23 and name HA   ))   ( (resid  26 and name HB1  ))     5.09  3.29  0.76
 assign ((resid  23 and name HA   ))   ( (resid  61 and name HB1  ))     5.33  3.53  0.80
 assign ((resid  23 and name HA   ))   ( (resid  27 and name HN   ))     4.67  2.87  0.70
 assign ((resid  24 and name HA   ))   ( (resid  27 and name HN   ))     3.55  1.75  0.53
 assign ((resid  24 and name HA   ))   ( (resid  27 and name HB*  ))     3.32  1.52  0.50
 assign ((resid  25 and name HA   ))   ( (resid  27 and name HN   ))     5.19  3.39  0.78
 assign ((resid  25 and name HA   ))   ( (resid  28 and name HB2  ))     3.46  1.66  0.52
 assign ((resid  25 and name HA   ))   ( (resid  29 and name HN   ))     4.20  2.40  0.63
 assign ((resid  26 and name HA   ))   ( (resid  28 and name HN   ))     4.04  2.24  0.61
 assign ((resid  27 and name HA   ))   ( (resid  30 and name HB2  ))     5.20  3.40  0.78
 assign ((resid  27 and name HA   ))   ( (resid  30 and name HB1  ))     5.20  3.40  0.78
 assign ((resid  52 and name HA   ))   ( (resid  55 and name HB2  ))     3.46  1.66  0.52
 assign ((resid  53 and name HA   ))   ( (resid  55 and name HN   ))     5.04  3.24  0.76
 assign ((resid  53 and name HA   ))   ( (resid  56 and name HN   ))     4.12  2.32  0.62
 assign ((resid  53 and name HA   ))   ( (resid  56 and name HB2  ))     4.07  2.27  0.61
 assign ((resid  54 and name HA   ))   ( (resid  57 and name HB2  ))     3.72  1.92  0.56
 assign ((resid  54 and name HA   ))   ( (resid  57 and name HB1  ))     4.75  2.95  0.71
 assign ((resid  55 and name HA   ))   ( (resid  58 and name HB2  ))     3.51  1.71  0.53
 assign ((resid  55 and name HA   ))   ( (resid  58 and name HB1  ))     4.39  2.59  0.66
 assign ((resid  56 and name HA   ))   ( (resid  59 and name HB*  ))     3.40  1.60  0.51
 assign ((resid  56 and name HA   ))   ( (resid  60 and name HN   ))     5.09  3.29  0.76
 assign ((resid  57 and name HA   ))   ( (resid  60 and name HB1  ))     4.40  2.60  0.66
 assign ((resid  57 and name HA   ))   ( (resid  60 and name HB2  ))     3.27  1.47  0.49
 assign ((resid  57 and name HA   ))   ( (resid  59 and name HN   ))     4.68  2.88  0.70
 assign ((resid  23 and name HE*  ))   ( (resid  58 and name HA   ))     3.29  1.49  0.49
 assign ((resid  58 and name HA   ))   ( (resid  61 and name HB2  ))     3.66  1.86  0.55
 assign ((resid  58 and name HA   ))   ( (resid  62 and name HN   ))     4.42  2.62  0.66
 assign ((resid  59 and name HA   ))   ( (resid  62 and name HB*  ))     3.39  1.59  0.51
 assign ((resid  59 and name HA   ))   ( (resid  63 and name HN   ))     4.34  2.54  0.65
 assign ((resid  60 and name HA   ))   ( (resid  62 and name HN   ))     4.92  3.12  0.74
 assign ((resid  60 and name HA   ))   ( (resid  63 and name HB1  ))     4.29  2.49  0.64
 assign ((resid  60 and name HA   ))   ( (resid  63 and name HB2  ))     3.48  1.68  0.52
 assign ((resid  61 and name HA   ))   ( (resid  63 and name HN   ))     4.43  2.63  0.66
 assign ((resid  61 and name HA   ))   ( (resid  65 and name HG   ))     4.72  2.92  0.71
 assign ((resid  61 and name HA   ))   ( (resid  64 and name HB1  ))     4.18  2.38  0.63
 assign ((resid  62 and name HA   ))   ( (resid  65 and name HB1  ))     4.30  2.50  0.65
 assign ((resid  62 and name HA   ))   ( (resid  65 and name HB2  ))     3.91  2.11  0.59
 assign ((resid  63 and name HA   ))   ( (resid  65 and name HN   ))     4.32  2.52  0.65
 assign ((resid  63 and name HA   ))   ( (resid  66 and name HN   ))     3.64  1.84  0.55
 assign ((resid  57 and name HA   ))   ( (resid  60 and name HD*  ))     3.38  1.58  0.51
 assign ((resid  63 and name HA   ))   ( (resid  66 and name HB*  ))     2.98  1.18  0.45
 assign ((resid  63 and name HA   ))   ( (resid  67 and name HN   ))     4.51  2.71  0.68
 assign ((resid  64 and name HA   ))   ( (resid  67 and name HN   ))     3.91  2.11  0.59
 assign ((resid  64 and name HA   ))   ( (resid  64 and name HB1  ))     2.95  1.15  0.44
 assign ((resid  64 and name HA   ))   ( (resid  67 and name HB*  ))     3.86  2.06  0.58
 assign ((resid  64 and name HA   ))   ( (resid  66 and name HN   ))     4.96  3.16  0.74
 assign ((resid  64 and name HE   ))   ( (resid  65 and name HA   ))     5.72  3.92  0.86
 assign ((resid  65 and name HA   ))   ( (resid  68 and name HB2  ))     3.51  1.71  0.53
 assign ((resid  65 and name HA   ))   ( (resid  68 and name HB1  ))     3.46  1.66  0.52
 assign ((resid  66 and name HA   ))   ( (resid  69 and name HB2  ))     4.92  3.12  0.74
 assign ((resid  66 and name HA   ))   ( (resid  69 and name HB1  ))     5.76  3.96  0.86
 assign ((resid   4 and name HA   ))   ( (resid  77 and name HD1* ))     5.72  3.92  0.86
 assign ((resid   4 and name HB2  ))   ( (resid  77 and name HD1* ))     4.50  2.70  0.68
 assign ((resid   4 and name HB2  ))   ( (resid   6 and name HD1* ))     6.00  4.20  0.90
 assign ((resid   4 and name HB2  ))   ( (resid  50 and name HG2* ))     5.52  3.72  0.83
 assign ((resid   4 and name HG*  ))   ( (resid  77 and name HD1* ))     3.83  2.03  0.57
 assign ((resid   4 and name HG*  ))   ( (resid   6 and name HG12 ))     4.04  2.24  0.61
 assign ((resid   4 and name HE*  ))   ( (resid  58 and name HB1  ))     4.01  2.21  0.60
 assign ((resid   4 and name HE*  ))   ( (resid  77 and name HD1* ))     3.05  1.25  0.46
 assign ((resid   4 and name HE*  ))   ( (resid   6 and name HG12 ))     3.12  1.32  0.47
 assign ((resid   4 and name HE*  ))   ( (resid   6 and name HG2* ))     4.15  2.35  0.62
 assign ((resid   4 and name HE*  ))   ( (resid  73 and name HG2* ))     5.22  3.42  0.78
 assign ((resid   4 and name HB2  ))   ( (resid  55 and name HD2  ))     6.00  4.20  0.90
 assign ((resid   4 and name HB2  ))   ( (resid  55 and name HD1  ))     6.00  4.20  0.90
 assign ((resid   4 and name HE*  ))   ( (resid  75 and name HB1  ))     4.20  2.40  0.63
 assign ((resid   4 and name HE*  ))   ( (resid  75 and name HB2  ))     4.42  2.62  0.66
 assign ((resid   4 and name HE*  ))   ( (resid  59 and name HA   ))     3.69  1.89  0.55
 assign ((resid   4 and name HE*  ))   ( (resid  55 and name HA   ))     4.28  2.48  0.64
 assign ((resid   4 and name HE*  ))   ( (resid  58 and name HA   ))     5.28  3.48  0.79
 assign ((resid   4 and name HE*  ))   ( (resid   6 and name HA   ))     5.51  3.71  0.83
 assign ((resid   4 and name HG*  ))   ( (resid  76 and name HA   ))     5.48  3.68  0.82
 assign ((resid   4 and name HE*  ))   ( (resid  57 and name HN   ))     5.69  3.89  0.85
 assign ((resid   4 and name HE*  ))   ( (resid  60 and name HN   ))     4.90  3.10  0.74
 assign ((resid   5 and name HA   ))   ( (resid  47 and name HN   ))     4.29  2.49  0.64
 assign ((resid   6 and name HA   ))   ( (resid  75 and name HB1  ))     3.93  2.13  0.59
 assign ((resid   4 and name HB1  ))   ( (resid   5 and name HA   ))     5.45  3.65  0.82
 assign ((resid   5 and name HA   ))   ( (resid  45 and name HB   ))     5.77  3.97  0.87
 assign ((resid   5 and name HA   ))   ( (resid  46 and name HB1  ))     5.05  3.25  0.76
 assign ((resid   5 and name HA   ))   ( (resid  46 and name HG*  ))     4.64  2.84  0.70
 assign ((resid   5 and name HA   ))   ( (resid   6 and name HD1* ))     4.51  2.71  0.68
 assign ((resid   6 and name HG11 ))   ( (resid  75 and name HB1  ))     4.20  2.40  0.63
 assign ((resid   6 and name HG2* ))   ( (resid  45 and name HB   ))     3.91  2.11  0.59
 assign ((resid   4 and name HG*  ))   ( (resid   6 and name HG2* ))     5.39  3.59  0.81
 assign ((resid   6 and name HG2* ))   ( (resid  75 and name HB1  ))     3.93  2.13  0.59
 assign ((resid   6 and name HG2* ))   ( (resid   8 and name HB*  ))     4.98  3.18  0.75
 assign ((resid   6 and name HA   ))   ( (resid  75 and name HB2  ))     4.19  2.39  0.63
 assign ((resid   6 and name HG2* ))   ( (resid  73 and name HG2* ))     2.89  1.09  0.43
 assign ((resid   6 and name HG12 ))   ( (resid  73 and name HG2* ))     5.39  3.59  0.81
 assign ((resid   6 and name HD1* ))   ( (resid  73 and name HG2* ))     4.79  2.99  0.72
 assign ((resid   6 and name HD1* ))   ( (resid  62 and name HB*  ))     3.24  1.44  0.49
 assign ((resid   6 and name HD1* ))   ( (resid  45 and name HB   ))     3.50  1.70  0.53
 assign ((resid   4 and name HG*  ))   ( (resid   6 and name HD1* ))     3.86  2.06  0.58
 assign ((resid   6 and name HD1* ))   ( (resid  23 and name HG1  ))     4.74  2.94  0.71
 assign ((resid   6 and name HD1* ))   ( (resid  75 and name HB1  ))     4.34  2.54  0.65
 assign ((resid   6 and name HD1* ))   ( (resid  75 and name HB2  ))     4.94  3.14  0.74
 assign ((resid   6 and name HG12 ))   ( (resid  58 and name HB2  ))     4.70  2.90  0.70
 assign ((resid   6 and name HG12 ))   ( (resid  23 and name HE*  ))     4.65  2.85  0.70
 assign ((resid   4 and name HG*  ))   ( (resid   6 and name HG11 ))     4.07  2.27  0.61
 assign ((resid   6 and name HG11 ))   ( (resid  75 and name HB2  ))     4.87  3.07  0.73
 assign ((resid   6 and name HG2* ))   ( (resid  62 and name HA   ))     5.29  3.49  0.79
 assign ((resid   6 and name HG2* ))   ( (resid   7 and name HA   ))     4.54  2.74  0.68
 assign ((resid   5 and name HA   ))   ( (resid   6 and name HB   ))     5.06  3.26  0.76
 assign ((resid   5 and name HA   ))   ( (resid   6 and name HG11 ))     4.71  2.91  0.71
 assign ((resid   6 and name HG2* ))   ( (resid   8 and name HE*  ))     3.46  1.66  0.52
 assign ((resid   6 and name HG12 ))   ( (resid  75 and name HD*  ))     4.93  3.13  0.74
 assign ((resid   6 and name HD1* ))   ( (resid  75 and name HA   ))     5.91  4.11  0.89
 assign ((resid   6 and name HD1* ))   ( (resid  75 and name HD*  ))     5.02  3.22  0.75
 assign ((resid   6 and name HD1* ))   ( (resid   8 and name HE*  ))     4.51  2.71  0.68
 assign ((resid   6 and name HG2* ))   ( (resid  63 and name HN   ))     5.22  3.42  0.78
 assign ((resid   6 and name HG2* ))   ( (resid  74 and name HN   ))     4.30  2.50  0.65
 assign ((resid   6 and name HD1* ))   ( (resid  59 and name HN   ))     4.84  3.04  0.73
 assign ((resid   5 and name HN   ))   ( (resid   6 and name HD1* ))     5.68  3.88  0.85
 assign ((resid   6 and name HD1* ))   ( (resid  62 and name HN   ))     4.67  2.87  0.70
 assign ((resid   7 and name HB2  ))   ( (resid  74 and name HN   ))     4.75  2.95  0.71
 assign ((resid   7 and name HB1  ))   ( (resid  74 and name HN   ))     4.75  2.95  0.71
 assign ((resid   7 and name HA   ))   ( (resid  44 and name HA   ))     3.81  2.01  0.57
 assign ((resid   7 and name HA   ))   ( (resid   8 and name HA   ))     4.78  2.98  0.72
 assign ((resid   8 and name HA   ))   ( (resid   9 and name HA   ))     5.11  3.31  0.77
 assign ((resid   7 and name HB2  ))   ( (resid  44 and name HA   ))     5.61  3.81  0.84
 assign ((resid   7 and name HB1  ))   ( (resid  44 and name HA   ))     5.61  3.81  0.84
 assign ((resid   7 and name HG1  ))   ( (resid  44 and name HA   ))     4.73  2.93  0.71
 assign ((resid   7 and name HD2  ))   ( (resid  44 and name HA   ))     5.25  3.45  0.79
 assign ((resid   7 and name HD1  ))   ( (resid  44 and name HA   ))     5.25  3.45  0.79
 assign ((resid   7 and name HA   ))   ( (resid   8 and name HB*  ))     4.71  2.91  0.71
 assign ((resid   8 and name HB*  ))   ( (resid   9 and name HA   ))     5.13  3.33  0.77
 assign ((resid   7 and name HB1  ))   ( (resid  74 and name HG2* ))     4.09  2.29  0.61
 assign ((resid   7 and name HA   ))   ( (resid  44 and name HB2  ))     4.98  3.18  0.75
 assign ((resid   8 and name HA   ))   ( (resid  73 and name HB   ))     4.15  2.35  0.62
 assign ((resid   8 and name HA   ))   ( (resid  43 and name HG   ))     5.94  4.14  0.89
 assign ((resid   8 and name HA   ))   ( (resid  66 and name HB*  ))     6.00  4.20  0.90
 assign ((resid   8 and name HA   ))   ( (resid  43 and name HD2* ))     4.93  3.13  0.74
 assign ((resid   8 and name HA   ))   ( (resid  73 and name HG1* ))     5.24  3.44  0.79
 assign ((resid   6 and name HG2* ))   ( (resid   8 and name HA   ))     4.79  2.99  0.72
 assign ((resid   8 and name HB*  ))   ( (resid  43 and name HB2  ))     4.01  2.21  0.60
 assign ((resid   8 and name HB*  ))   ( (resid  43 and name HG   ))     4.35  2.55  0.65
 assign ((resid   8 and name HB*  ))   ( (resid  43 and name HB1  ))     4.04  2.24  0.61
 assign ((resid   8 and name HB*  ))   ( (resid  73 and name HG2* ))     5.22  3.42  0.78
 assign ((resid   6 and name HG2* ))   ( (resid   8 and name HD*  ))     4.48  2.68  0.67
 assign ((resid   8 and name HE*  ))   ( (resid  65 and name HD1* ))     4.97  3.17  0.75
 assign ((resid   8 and name HA   ))   ( (resid  73 and name HA   ))     3.50  1.70  0.53
 assign ((resid   9 and name HA   ))   ( (resid  42 and name HA   ))     3.64  1.84  0.55
 assign ((resid   9 and name HB1  ))   ( (resid  42 and name HA   ))     5.48  3.68  0.82
 assign ((resid   9 and name HD*  ))   ( (resid  42 and name HA   ))     4.91  3.11  0.74
 assign ((resid   9 and name HA   ))   ( (resid  42 and name HB1  ))     5.00  3.20  0.75
 assign ((resid   9 and name HA   ))   ( (resid  10 and name HA2  ))     5.05  3.25  0.76
 assign ((resid   9 and name HA   ))   ( (resid  16 and name HD1* ))     4.00  2.20  0.60
 assign ((resid   9 and name HB2  ))   ( (resid  72 and name HG2* ))     5.07  3.27  0.76
 assign ((resid   9 and name HB1  ))   ( (resid  72 and name HG2* ))     5.07  3.27  0.76
 assign ((resid  10 and name HA1  ))   ( (resid  71 and name HA   ))     4.44  2.64  0.67
 assign ((resid  10 and name HA1  ))   ( (resid  71 and name HB   ))     4.42  2.62  0.66
 assign ((resid  10 and name HA2  ))   ( (resid  71 and name HB   ))     4.49  2.69  0.67
 assign ((resid  10 and name HA1  ))   ( (resid  16 and name HG   ))     6.00  4.20  0.90
 assign ((resid   9 and name HG*  ))   ( (resid  10 and name HA1  ))     5.79  3.99  0.87
 assign ((resid  10 and name HA1  ))   ( (resid  15 and name HB*  ))     5.12  3.32  0.77
 assign ((resid  10 and name HA1  ))   ( (resid  71 and name HG2* ))     3.25  1.45  0.49
 assign ((resid  10 and name HA1  ))   ( (resid  16 and name HD2* ))     4.04  2.24  0.61
 assign ((resid  10 and name HA1  ))   ( (resid  71 and name HD1* ))     4.84  3.04  0.73
 assign ((resid  10 and name HA2  ))   ( (resid  71 and name HG2* ))     3.83  2.03  0.57
 assign ((resid  10 and name HA2  ))   ( (resid  16 and name HD2* ))     4.82  3.02  0.72
 assign ((resid  10 and name HA2  ))   ( (resid  11 and name HB1  ))     5.17  3.37  0.78
 assign ((resid  10 and name HA1  ))   ( (resid  11 and name HB1  ))     5.28  3.48  0.79
 assign ((resid  10 and name HA2  ))   ( (resid  72 and name HN   ))     4.70  2.90  0.70
 assign ((resid  11 and name HB1  ))   ( (resid  41 and name HD22 ))     5.93  4.13  0.89
 assign ((resid  13 and name HA   ))   ( (resid  16 and name HD2* ))     4.50  2.70  0.68
 assign ((resid  13 and name HA   ))   ( (resid  41 and name HA   ))     4.56  2.76  0.68
 assign ((resid  15 and name HA   ))   ( (resid  69 and name HD*  ))     4.68  2.88  0.70
 assign ((resid  15 and name HB*  ))   ( (resid  18 and name HN   ))     5.06  3.26  0.76
 assign ((resid  14 and name HN   ))   ( (resid  15 and name HB*  ))     4.34  2.54  0.65
 assign ((resid  15 and name HB*  ))   ( (resid  19 and name HN   ))     4.70  2.90  0.70
 assign ((resid  15 and name HB*  ))   ( (resid  71 and name HN   ))     5.12  3.32  0.77
 assign ((resid  13 and name HN   ))   ( (resid  15 and name HB*  ))     5.29  3.49  0.79
 assign ((resid  15 and name HB*  ))   ( (resid  71 and name HA   ))     5.10  3.30  0.77
 assign ((resid  12 and name HA   ))   ( (resid  15 and name HB*  ))     4.90  3.10  0.74
 assign ((resid  14 and name HA   ))   ( (resid  15 and name HB*  ))     5.13  3.33  0.77
 assign ((resid  15 and name HB*  ))   ( (resid  69 and name HA   ))     4.11  2.31  0.62
 assign ((resid  15 and name HA   ))   ( (resid  18 and name HA   ))     5.57  3.77  0.84
 assign ((resid  14 and name HA   ))   ( (resid  15 and name HA   ))     5.03  3.23  0.75
 assign ((resid  12 and name HB1  ))   ( (resid  15 and name HB*  ))     4.03  2.23  0.60
 assign ((resid  12 and name HB2  ))   ( (resid  15 and name HB*  ))     4.03  2.23  0.60
 assign ((resid  15 and name HA   ))   ( (resid  71 and name HG2* ))     4.96  3.16  0.74
 assign ((resid  15 and name HA   ))   ( (resid  19 and name HB*  ))     5.31  3.51  0.80
 assign ((resid  15 and name HA   ))   ( (resid  71 and name HD1* ))     5.00  3.20  0.75
 assign ((resid  14 and name HB1  ))   ( (resid  15 and name HB*  ))     4.77  2.97  0.72
 assign ((resid  15 and name HB*  ))   ( (resid  71 and name HG12 ))     3.72  1.92  0.56
 assign ((resid  15 and name HB*  ))   ( (resid  16 and name HG   ))     3.99  2.19  0.60
 assign ((resid  14 and name HB2  ))   ( (resid  15 and name HA   ))     4.83  3.03  0.72
 assign ((resid  15 and name HB*  ))   ( (resid  16 and name HA   ))     4.67  2.87  0.70
 assign ((resid  16 and name HA   ))   ( (resid  43 and name HB1  ))     5.06  3.26  0.76
 assign ((resid  16 and name HA   ))   ( (resid  43 and name HB2  ))     5.10  3.30  0.77
 assign ((resid   8 and name HB*  ))   ( (resid  16 and name HA   ))     4.95  3.15  0.74
 assign ((resid  16 and name HA   ))   ( (resid  71 and name HG2* ))     4.44  2.64  0.67
 assign ((resid  13 and name HG   ))   ( (resid  16 and name HB2  ))     5.47  3.67  0.82
 assign ((resid  16 and name HB2  ))   ( (resid  43 and name HB1  ))     5.94  4.14  0.89
 assign ((resid  16 and name HB1  ))   ( (resid  43 and name HB1  ))     4.56  2.76  0.68
 assign ((resid  16 and name HD1* ))   ( (resid  43 and name HB1  ))     3.89  2.09  0.58
 assign ((resid  15 and name HB*  ))   ( (resid  16 and name HD2* ))     3.94  2.14  0.59
 assign ((resid  16 and name HD2* ))   ( (resid  43 and name HB1  ))     4.12  2.32  0.62
 assign ((resid  16 and name HD2* ))   ( (resid  43 and name HB2  ))     3.79  1.99  0.57
 assign ((resid  16 and name HD2* ))   ( (resid  71 and name HB   ))     4.33  2.53  0.65
 assign ((resid   8 and name HB*  ))   ( (resid  16 and name HD2* ))     3.24  1.44  0.49
 assign ((resid  16 and name HD1* ))   ( (resid  43 and name HB2  ))     4.61  2.81  0.69
 assign ((resid   8 and name HB*  ))   ( (resid  16 and name HD1* ))     4.73  2.93  0.71
 assign ((resid  13 and name HA   ))   ( (resid  16 and name HD1* ))     3.51  1.71  0.53
 assign ((resid  16 and name HD1* ))   ( (resid  41 and name HA   ))     3.39  1.59  0.51
 assign ((resid  16 and name HD2* ))   ( (resid  41 and name HA   ))     4.76  2.96  0.71
 assign ((resid  16 and name HD2* ))   ( (resid  42 and name HA   ))     4.00  2.20  0.60
 assign ((resid   9 and name HA   ))   ( (resid  16 and name HD2* ))     3.74  1.94  0.56
 assign ((resid   8 and name HA   ))   ( (resid  16 and name HD2* ))     4.33  2.53  0.65
 assign ((resid  16 and name HD2* ))   ( (resid  20 and name HN   ))     5.72  3.92  0.86
 assign ((resid  10 and name HN   ))   ( (resid  16 and name HD2* ))     4.10  2.30  0.62
 assign ((resid  16 and name HD2* ))   ( (resid  72 and name HN   ))     5.04  3.24  0.76
 assign ((resid  16 and name HD1* ))   ( (resid  41 and name HN   ))     4.78  2.98  0.72
 assign ((resid   7 and name HA   ))   ( (resid  44 and name HG1  ))     5.44  3.64  0.82
 assign ((resid  17 and name HA   ))   ( (resid  43 and name HD2* ))     4.91  3.11  0.74
 assign ((resid  17 and name HG1  ))   ( (resid  38 and name HD1* ))     3.96  2.16  0.59
 assign ((resid  53 and name HB1  ))   ( (resid  54 and name HG2* ))     6.00  4.20  0.90
 assign ((resid  15 and name HA   ))   ( (resid  18 and name HG1  ))     5.43  3.63  0.81
 assign ((resid  15 and name HA   ))   ( (resid  18 and name HG2  ))     4.63  2.83  0.69
 assign ((resid  15 and name HA   ))   ( (resid  18 and name HD1  ))     4.23  2.43  0.63
 assign ((resid  15 and name HA   ))   ( (resid  18 and name HD2  ))     4.30  2.50  0.65
 assign ((resid  18 and name HB2  ))   ( (resid  69 and name HD*  ))     4.48  2.68  0.67
 assign ((resid  18 and name HG1  ))   ( (resid  69 and name HZ   ))     5.30  3.50  0.80
 assign ((resid  18 and name HG2  ))   ( (resid  69 and name HD*  ))     4.69  2.89  0.70
 assign ((resid  18 and name HG2  ))   ( (resid  69 and name HZ   ))     5.09  3.29  0.76
 assign ((resid  18 and name HA   ))   ( (resid  69 and name HZ   ))     5.06  3.26  0.76
 assign ((resid  19 and name HA   ))   ( (resid  69 and name HZ   ))     3.88  2.08  0.58
 assign ((resid  19 and name HB*  ))   ( (resid  69 and name HD*  ))     3.32  1.52  0.50
 assign ((resid  20 and name HA   ))   ( (resid  22 and name HN   ))     5.42  3.62  0.81
 assign ((resid  20 and name HG   ))   ( (resid  21 and name HN   ))     4.52  2.72  0.68
 assign ((resid  19 and name HB*  ))   ( (resid  21 and name HN   ))     4.91  3.11  0.74
 assign ((resid  18 and name HB1  ))   ( (resid  19 and name HA   ))     5.09  3.29  0.76
 assign ((resid  19 and name HA   ))   ( (resid  65 and name HB1  ))     4.58  2.78  0.69
 assign ((resid  19 and name HA   ))   ( (resid  65 and name HD1* ))     3.32  1.52  0.50
 assign ((resid  19 and name HB*  ))   ( (resid  71 and name HD1* ))     2.90  1.10  0.44
 assign ((resid  19 and name HA   ))   ( (resid  71 and name HD1* ))     4.84  3.04  0.73
 assign ((resid  19 and name HB*  ))   ( (resid  43 and name HD2* ))     3.56  1.76  0.53
 assign ((resid  19 and name HB*  ))   ( (resid  65 and name HD1* ))     3.19  1.39  0.48
 assign ((resid  19 and name HB*  ))   ( (resid  65 and name HB1  ))     3.53  1.73  0.53
 assign ((resid  19 and name HB*  ))   ( (resid  20 and name HB2  ))     4.55  2.75  0.68
 assign ((resid  15 and name HB*  ))   ( (resid  19 and name HB*  ))     3.99  2.19  0.60
 assign ((resid  19 and name HB*  ))   ( (resid  66 and name HB*  ))     5.28  3.48  0.79
 assign ((resid  19 and name HB*  ))   ( (resid  20 and name HB1  ))     4.86  3.06  0.73
 assign ((resid  19 and name HB*  ))   ( (resid  65 and name HB2  ))     4.25  2.45  0.64
 assign ((resid  19 and name HB*  ))   ( (resid  23 and name HG1  ))     5.07  3.27  0.76
 assign ((resid  19 and name HB*  ))   ( (resid  69 and name HB2  ))     5.41  3.61  0.81
 assign ((resid   8 and name HB*  ))   ( (resid  19 and name HB*  ))     4.79  2.99  0.72
 assign ((resid  19 and name HB*  ))   ( (resid  20 and name HA   ))     4.61  2.81  0.69
 assign ((resid  20 and name HA   ))   ( (resid  43 and name HD2* ))     3.83  2.03  0.57
 assign ((resid  20 and name HA   ))   ( (resid  23 and name HG2  ))     5.91  4.11  0.89
 assign ((resid  20 and name HB1  ))   ( (resid  24 and name HD1* ))     5.86  4.06  0.88
 assign ((resid  20 and name HB2  ))   ( (resid  45 and name HD1* ))     4.47  2.67  0.67
 assign ((resid  20 and name HG   ))   ( (resid  24 and name HD1* ))     3.58  1.78  0.54
 assign ((resid  20 and name HD1* ))   ( (resid  36 and name HB2  ))     5.08  3.28  0.76
 assign ((resid  21 and name HB*  ))   ( (resid  22 and name HG2  ))     4.45  2.65  0.67
 assign ((resid  18 and name HB1  ))   ( (resid  22 and name HG2  ))     5.28  3.48  0.79
 assign ((resid  22 and name HG2  ))   ( (resid  65 and name HD1* ))     3.71  1.91  0.56
 assign ((resid  22 and name HG1  ))   ( (resid  65 and name HD1* ))     3.76  1.96  0.56
 assign ((resid  22 and name HG1  ))   ( (resid  65 and name HD2* ))     3.66  1.86  0.55
 assign ((resid  22 and name HB1  ))   ( (resid  65 and name HD1* ))     3.79  1.99  0.57
 assign ((resid  22 and name HB1  ))   ( (resid  65 and name HD2* ))     3.66  1.86  0.55
 assign ((resid  19 and name HA   ))   ( (resid  22 and name HG2  ))     4.55  2.75  0.68
 assign ((resid  19 and name HA   ))   ( (resid  22 and name HG1  ))     4.51  2.71  0.68
 assign ((resid  22 and name HG1  ))   ( (resid  69 and name HZ   ))     4.53  2.73  0.68
 assign ((resid  22 and name HB1  ))   ( (resid  69 and name HZ   ))     6.00  4.20  0.90
 assign ((resid  23 and name HE*  ))   ( (resid  62 and name HB*  ))     3.10  1.30  0.47
 assign ((resid  23 and name HE*  ))   ( (resid  58 and name HB1  ))     3.55  1.75  0.53
 assign ((resid  23 and name HE*  ))   ( (resid  65 and name HD1* ))     4.20  2.40  0.63
 assign ((resid   6 and name HD1* ))   ( (resid  23 and name HE*  ))     2.56  0.76  0.38
 assign ((resid   6 and name HG2* ))   ( (resid  23 and name HE*  ))     3.65  1.85  0.55
 assign ((resid  23 and name HE*  ))   ( (resid  73 and name HG2* ))     4.97  3.17  0.75
 assign ((resid   6 and name HB   ))   ( (resid  23 and name HG2  ))     6.00  4.20  0.90
 assign ((resid  23 and name HG2  ))   ( (resid  24 and name HG11 ))     6.00  4.20  0.90
 assign ((resid  23 and name HG2  ))   ( (resid  62 and name HB*  ))     5.26  3.46  0.79
 assign ((resid  19 and name HB*  ))   ( (resid  23 and name HG2  ))     4.78  2.98  0.72
 assign ((resid   6 and name HG2* ))   ( (resid  23 and name HG2  ))     5.74  3.94  0.86
 assign ((resid  23 and name HG1  ))   ( (resid  45 and name HD1* ))     3.45  1.65  0.52
 assign ((resid  23 and name HG1  ))   ( (resid  43 and name HD2* ))     4.31  2.51  0.65
 assign ((resid   6 and name HG2* ))   ( (resid  23 and name HG1  ))     5.02  3.22  0.75
 assign ((resid  23 and name HB2  ))   ( (resid  45 and name HD1* ))     3.64  1.84  0.55
 assign ((resid  23 and name HB1  ))   ( (resid  45 and name HG2* ))     4.01  2.21  0.60
 assign ((resid  23 and name HB1  ))   ( (resid  45 and name HD1* ))     4.17  2.37  0.63
 assign ((resid  23 and name HB1  ))   ( (resid  58 and name HD1* ))     4.90  3.10  0.74
 assign ((resid  23 and name HA   ))   ( (resid  65 and name HD1* ))     3.91  2.11  0.59
 assign ((resid  23 and name HA   ))   ( (resid  58 and name HD1* ))     4.10  2.30  0.62
 assign ((resid  23 and name HE*  ))   ( (resid  61 and name HG*  ))     3.53  1.73  0.53
 assign ((resid  23 and name HE*  ))   ( (resid  62 and name HA   ))     3.72  1.92  0.56
 assign ((resid   8 and name HE*  ))   ( (resid  23 and name HB1  ))     5.32  3.52  0.80
 assign ((resid   8 and name HE*  ))   ( (resid  23 and name HB2  ))     5.51  3.71  0.83
 assign ((resid   8 and name HE*  ))   ( (resid  23 and name HG1  ))     3.91  2.11  0.59
 assign ((resid   8 and name HE*  ))   ( (resid  23 and name HG2  ))     4.10  2.30  0.62
 assign ((resid  23 and name HE*  ))   ( (resid  26 and name HN   ))     4.69  2.89  0.70
 assign ((resid  23 and name HE*  ))   ( (resid  61 and name HN   ))     4.20  2.40  0.63
 assign ((resid  23 and name HE*  ))   ( (resid  30 and name HE*  ))     5.16  3.36  0.77
 assign ((resid   8 and name HE*  ))   ( (resid  23 and name HE*  ))     4.14  2.34  0.62
 assign ((resid  20 and name HD2* ))   ( (resid  24 and name HD1* ))     3.98  2.18  0.60
 assign ((resid  20 and name HD2* ))   ( (resid  24 and name HG2* ))     5.66  3.86  0.85
 assign ((resid  53 and name HB2  ))   ( (resid  54 and name HG2* ))     4.49  2.69  0.67
 assign ((resid  26 and name HG2  ))   ( (resid  58 and name HD1* ))     4.35  2.55  0.65
 assign ((resid  23 and name HA   ))   ( (resid  26 and name HG1  ))     3.92  2.12  0.59
 assign ((resid  23 and name HA   ))   ( (resid  26 and name HG2  ))     4.72  2.92  0.71
 assign ((resid  26 and name HB2  ))   ( (resid  30 and name HE*  ))     4.77  2.97  0.72
 assign ((resid  26 and name HG1  ))   ( (resid  61 and name HN   ))     5.59  3.79  0.84
 assign ((resid  27 and name HB*  ))   ( (resid  30 and name HD*  ))     4.23  2.43  0.63
 assign ((resid  27 and name HA   ))   ( (resid  47 and name HG2* ))     3.72  1.92  0.56
 assign ((resid  27 and name HA   ))   ( (resid  58 and name HD1* ))     4.25  2.45  0.64
 assign ((resid  27 and name HB*  ))   ( (resid  47 and name HG11 ))     3.91  2.11  0.59
 assign ((resid  23 and name HE*  ))   ( (resid  27 and name HB*  ))     5.16  3.36  0.77
 assign ((resid  26 and name HB1  ))   ( (resid  27 and name HB*  ))     5.51  3.71  0.83
 assign ((resid  27 and name HB*  ))   ( (resid  34 and name HB   ))     3.51  1.71  0.53
 assign ((resid  27 and name HB*  ))   ( (resid  47 and name HG2* ))     2.75  0.95  0.41
 assign ((resid  30 and name HB2  ))   ( (resid  54 and name HG2* ))     4.54  2.74  0.68
 assign ((resid  30 and name HB2  ))   ( (resid  54 and name HG1* ))     4.56  2.76  0.68
 assign ((resid  30 and name HB1  ))   ( (resid  54 and name HG2* ))     4.54  2.74  0.68
 assign ((resid  30 and name HB1  ))   ( (resid  54 and name HG1* ))     4.56  2.76  0.68
 assign ((resid  30 and name HD*  ))   ( (resid  58 and name HD2* ))     4.76  2.96  0.71
 assign ((resid  26 and name HA   ))   ( (resid  30 and name HD*  ))     5.52  3.72  0.83
 assign ((resid  29 and name HA   ))   ( (resid  30 and name HD*  ))     6.00  4.20  0.90
 assign ((resid  27 and name HA   ))   ( (resid  30 and name HE*  ))     6.00  4.20  0.90
 assign ((resid  31 and name HB*  ))   ( (resid  50 and name HG1* ))     5.17  3.37  0.78
 assign ((resid  30 and name HN   ))   ( (resid  31 and name HA   ))     4.73  2.93  0.71
 assign ((resid  30 and name HN   ))   ( (resid  31 and name HB*  ))     4.84  3.04  0.73
 assign ((resid  30 and name HD*  ))   ( (resid  32 and name HA1  ))     5.51  3.71  0.83
 assign ((resid  27 and name HB*  ))   ( (resid  32 and name HA1  ))     4.40  2.60  0.66
 assign ((resid  32 and name HA1  ))   ( (resid  47 and name HG2* ))     4.44  2.64  0.67
 assign ((resid  32 and name HA1  ))   ( (resid  50 and name HG1* ))     3.64  1.84  0.55
 assign ((resid  33 and name HG2* ))   ( (resid  47 and name HG2* ))     4.41  2.61  0.66
 assign ((resid  33 and name HB   ))   ( (resid  47 and name HA   ))     4.93  3.13  0.74
 assign ((resid  33 and name HB   ))   ( (resid  48 and name HN   ))     4.09  2.29  0.61
 assign ((resid  34 and name HG1* ))   ( (resid  36 and name HD*  ))     4.03  2.23  0.60
 assign ((resid  34 and name HG2* ))   ( (resid  36 and name HD*  ))     3.97  2.17  0.60
 assign ((resid  34 and name HB   ))   ( (resid  47 and name HG11 ))     4.92  3.12  0.74
 assign ((resid  28 and name HD2  ))   ( (resid  34 and name HG1* ))     6.00  4.20  0.90
 assign ((resid  28 and name HD1  ))   ( (resid  34 and name HG1* ))     6.00  4.20  0.90
 assign ((resid  27 and name HB*  ))   ( (resid  34 and name HG1* ))     3.14  1.34  0.47
 assign ((resid  27 and name HB*  ))   ( (resid  34 and name HG2* ))     3.54  1.74  0.53
 assign ((resid  34 and name HG2* ))   ( (resid  47 and name HG11 ))     4.30  2.50  0.65
 assign ((resid  34 and name HG2* ))   ( (resid  45 and name HB   ))     5.03  3.23  0.75
 assign ((resid  24 and name HG11 ))   ( (resid  34 and name HG1* ))     3.94  2.14  0.59
 assign ((resid  40 and name HA1  ))   ( (resid  42 and name HN   ))     5.23  3.43  0.78
 assign ((resid  40 and name HA2  ))   ( (resid  42 and name HN   ))     5.23  3.43  0.78
 assign ((resid  10 and name HN   ))   ( (resid  41 and name HB1  ))     4.11  2.31  0.62
 assign ((resid  41 and name HB1  ))   ( (resid  42 and name HA   ))     5.42  3.62  0.81
 assign ((resid   9 and name HA   ))   ( (resid  41 and name HB1  ))     4.80  3.00  0.72
 assign ((resid   9 and name HA   ))   ( (resid  41 and name HB2  ))     5.61  3.81  0.84
 assign ((resid   9 and name HG*  ))   ( (resid  41 and name HB1  ))     5.02  3.22  0.75
 assign ((resid  16 and name HD1* ))   ( (resid  41 and name HB1  ))     4.21  2.41  0.63
 assign ((resid  16 and name HD2* ))   ( (resid  41 and name HB1  ))     5.45  3.65  0.82
 assign ((resid   9 and name HG*  ))   ( (resid  41 and name HB2  ))     5.15  3.35  0.77
 assign ((resid  16 and name HD1* ))   ( (resid  41 and name HB2  ))     4.73  2.93  0.71
 assign ((resid   9 and name HG*  ))   ( (resid  42 and name HA   ))     3.93  2.13  0.59
 assign ((resid   9 and name HB2  ))   ( (resid  42 and name HA   ))     5.48  3.68  0.82
 assign ((resid  42 and name HA   ))   ( (resid  43 and name HB1  ))     4.85  3.05  0.73
 assign ((resid  16 and name HD1* ))   ( (resid  42 and name HA   ))     4.15  2.35  0.62
 assign ((resid  16 and name HD1* ))   ( (resid  42 and name HB2  ))     5.13  3.33  0.77
 assign ((resid  16 and name HD1* ))   ( (resid  42 and name HB1  ))     5.13  3.33  0.77
 assign ((resid   9 and name HA   ))   ( (resid  42 and name HB2  ))     5.00  3.20  0.75
 assign ((resid  10 and name HN   ))   ( (resid  42 and name HA   ))     4.62  2.82  0.69
 assign ((resid  41 and name HN   ))   ( (resid  42 and name HA   ))     5.10  3.30  0.77
 assign ((resid  39 and name HN   ))   ( (resid  42 and name HB1  ))     6.00  4.20  0.90
 assign ((resid  39 and name HN   ))   ( (resid  43 and name HA   ))     5.57  3.77  0.84
 assign ((resid   8 and name HN   ))   ( (resid  43 and name HB1  ))     5.76  3.96  0.86
 assign ((resid   8 and name HD*  ))   ( (resid  43 and name HB1  ))     5.43  3.63  0.81
 assign ((resid  19 and name HN   ))   ( (resid  43 and name HD2* ))     4.99  3.19  0.75
 assign ((resid  36 and name HD*  ))   ( (resid  43 and name HD2* ))     5.57  3.77  0.84
 assign ((resid  20 and name HN   ))   ( (resid  43 and name HD1* ))     5.06  3.26  0.76
 assign ((resid   8 and name HD*  ))   ( (resid  43 and name HD1* ))     4.56  2.76  0.68
 assign ((resid  36 and name HB2  ))   ( (resid  43 and name HD1* ))     3.91  2.11  0.59
 assign ((resid   8 and name HB*  ))   ( (resid  43 and name HD2* ))     3.74  1.94  0.56
 assign ((resid  23 and name HG2  ))   ( (resid  43 and name HD2* ))     5.30  3.50  0.80
 assign ((resid  20 and name HB1  ))   ( (resid  43 and name HD2* ))     3.89  2.09  0.58
 assign ((resid  16 and name HB1  ))   ( (resid  43 and name HD2* ))     3.01  1.21  0.45
 assign ((resid  20 and name HB2  ))   ( (resid  43 and name HD2* ))     3.70  1.90  0.56
 assign ((resid  16 and name HD2* ))   ( (resid  43 and name HD2* ))     3.62  1.82  0.54
 assign ((resid  20 and name HD2* ))   ( (resid  43 and name HD2* ))     4.34  2.54  0.65
 assign ((resid  20 and name HD1* ))   ( (resid  43 and name HD2* ))     4.34  2.54  0.65
 assign ((resid  20 and name HD2* ))   ( (resid  43 and name HD1* ))     3.87  2.07  0.58
 assign ((resid  16 and name HD2* ))   ( (resid  43 and name HG   ))     5.15  3.35  0.77
 assign ((resid  44 and name HA   ))   ( (resid  45 and name HB   ))     4.92  3.12  0.74
 assign ((resid  44 and name HA   ))   ( (resid  45 and name HD1* ))     4.83  3.03  0.72
 assign ((resid  44 and name HG2  ))   ( (resid  46 and name HG*  ))     4.48  2.68  0.67
 assign ((resid  44 and name HG1  ))   ( (resid  46 and name HG*  ))     4.48  2.68  0.67
 assign ((resid  37 and name HB   ))   ( (resid  44 and name HB2  ))     4.55  2.75  0.68
 assign ((resid   7 and name HA   ))   ( (resid  44 and name HB1  ))     5.44  3.64  0.82
 assign ((resid   7 and name HA   ))   ( (resid  44 and name HG2  ))     5.44  3.64  0.82
 assign ((resid  29 and name HB*  ))   ( (resid  30 and name HA   ))     5.18  3.38  0.78
 assign ((resid  27 and name HN   ))   ( (resid  47 and name HD1* ))     4.62  2.82  0.69
 assign ((resid  27 and name HN   ))   ( (resid  47 and name HG2* ))     5.35  3.55  0.80
 assign ((resid  30 and name HD*  ))   ( (resid  47 and name HG2* ))     4.08  2.28  0.61
 assign ((resid   3 and name HA   ))   ( (resid  47 and name HG2* ))     6.00  4.20  0.90
 assign ((resid  47 and name HG2* ))   ( (resid  49 and name HA1  ))     5.22  3.42  0.78
 assign ((resid  27 and name HA   ))   ( (resid  47 and name HD1* ))     4.49  2.69  0.67
 assign ((resid  27 and name HB*  ))   ( (resid  47 and name HD1* ))     3.11  1.31  0.47
 assign ((resid  23 and name HB1  ))   ( (resid  47 and name HD1* ))     3.63  1.83  0.54
 assign ((resid  23 and name HE*  ))   ( (resid  47 and name HD1* ))     3.41  1.61  0.51
 assign ((resid  23 and name HB2  ))   ( (resid  47 and name HD1* ))     5.07  3.27  0.76
 assign ((resid  27 and name HB*  ))   ( (resid  47 and name HG12 ))     4.15  2.35  0.62
 assign ((resid  34 and name HB   ))   ( (resid  47 and name HG12 ))     4.71  2.91  0.71
 assign ((resid  47 and name HB   ))   ( (resid  50 and name HG2* ))     4.19  2.39  0.63
 assign ((resid  27 and name HB*  ))   ( (resid  47 and name HB   ))     4.94  3.14  0.74
 assign ((resid  47 and name HB   ))   ( (resid  48 and name HG2* ))     6.00  4.20  0.90
 assign ((resid   4 and name HG*  ))   ( (resid  47 and name HB   ))     4.92  3.12  0.74
 assign ((resid  27 and name HB*  ))   ( (resid  47 and name HA   ))     4.98  3.18  0.75
 assign ((resid   4 and name HG*  ))   ( (resid  47 and name HG2* ))     5.53  3.73  0.83
 assign ((resid  48 and name HA   ))   ( (resid  49 and name HA2  ))     4.69  2.89  0.70
 assign ((resid  48 and name HB   ))   ( (resid  49 and name HA2  ))     5.12  3.32  0.77
 assign ((resid  33 and name HN   ))   ( (resid  48 and name HB   ))     5.12  3.32  0.77
 assign ((resid  50 and name HG2* ))   ( (resid  55 and name HG1  ))     3.77  1.97  0.57
 assign ((resid  50 and name HG1* ))   ( (resid  58 and name HG   ))     4.85  3.05  0.73
 assign ((resid  50 and name HG1* ))   ( (resid  51 and name HD2  ))     4.31  2.51  0.65
 assign ((resid  50 and name HG2* ))   ( (resid  51 and name HD2  ))     4.79  2.99  0.72
 assign ((resid  30 and name HD*  ))   ( (resid  50 and name HG1* ))     4.33  2.53  0.65
 assign ((resid  30 and name HD*  ))   ( (resid  50 and name HG2* ))     4.30  2.50  0.65
 assign ((resid  51 and name HG2  ))   ( (resid  54 and name HN   ))     4.67  2.87  0.70
 assign ((resid  51 and name HB1  ))   ( (resid  54 and name HN   ))     4.86  3.06  0.73
 assign ((resid  51 and name HG1  ))   ( (resid  54 and name HN   ))     4.67  2.87  0.70
 assign ((resid  50 and name HA   ))   ( (resid  51 and name HD2  ))     3.56  1.76  0.53
 assign ((resid  51 and name HD2  ))   ( (resid  54 and name HB   ))     3.87  2.07  0.58
 assign ((resid  51 and name HD1  ))   ( (resid  54 and name HB   ))     4.38  2.58  0.66
 assign ((resid  51 and name HB2  ))   ( (resid  54 and name HG2* ))     4.14  2.34  0.62
 assign ((resid  51 and name HB1  ))   ( (resid  54 and name HG2* ))     4.49  2.69  0.67
 assign ((resid  51 and name HG2  ))   ( (resid  54 and name HG2* ))     3.62  1.82  0.54
 assign ((resid  51 and name HG2  ))   ( (resid  54 and name HG1* ))     5.32  3.52  0.80
 assign ((resid  51 and name HG1  ))   ( (resid  54 and name HG1* ))     5.32  3.52  0.80
 assign ((resid  54 and name HG2* ))   ( (resid  57 and name HB2  ))     5.02  3.22  0.75
 assign ((resid  51 and name HG1  ))   ( (resid  54 and name HG2* ))     3.62  1.82  0.54
 assign ((resid  53 and name HG1  ))   ( (resid  54 and name HG2* ))     3.71  1.91  0.56
 assign ((resid  54 and name HG1* ))   ( (resid  57 and name HB2  ))     5.18  3.38  0.78
 assign ((resid  54 and name HG1* ))   ( (resid  57 and name HG*  ))     5.26  3.46  0.79
 assign ((resid  54 and name HG1* ))   ( (resid  58 and name HD2* ))     3.55  1.75  0.53
 assign ((resid  54 and name HG2* ))   ( (resid  58 and name HD2* ))     3.98  2.18  0.60
 assign ((resid  54 and name HB   ))   ( (resid  58 and name HD2* ))     4.42  2.62  0.66
 assign ((resid  51 and name HD1  ))   ( (resid  54 and name HG2* ))     3.64  1.84  0.55
 assign ((resid  54 and name HG1* ))   ( (resid  58 and name HA   ))     5.89  4.09  0.88
 assign ((resid  51 and name HD2  ))   ( (resid  54 and name HG2* ))     3.75  1.95  0.56
 assign ((resid  30 and name HE*  ))   ( (resid  54 and name HG2* ))     3.97  2.17  0.60
 assign ((resid  50 and name HG2* ))   ( (resid  55 and name HB1  ))     5.82  4.02  0.87
 assign ((resid  47 and name HG2* ))   ( (resid  55 and name HG2  ))     5.54  3.74  0.83
 assign ((resid  55 and name HG2  ))   ( (resid  77 and name HD1* ))     6.00  4.20  0.90
 assign ((resid  55 and name HD2  ))   ( (resid  77 and name HG2* ))     4.44  2.64  0.67
 assign ((resid  50 and name HG2* ))   ( (resid  55 and name HD2  ))     5.37  3.57  0.81
 assign ((resid  55 and name HD1  ))   ( (resid  77 and name HG2* ))     4.44  2.64  0.67
 assign ((resid  50 and name HG2* ))   ( (resid  55 and name HD1  ))     5.37  3.57  0.81
 assign ((resid  56 and name HB2  ))   ( (resid  77 and name HD1* ))     5.25  3.45  0.79
 assign ((resid  30 and name HE*  ))   ( (resid  58 and name HB2  ))     5.73  3.93  0.86
 assign ((resid  57 and name HN   ))   ( (resid  58 and name HB2  ))     5.99  4.19  0.90
 assign ((resid  30 and name HE*  ))   ( (resid  58 and name HB1  ))     5.43  3.63  0.81
 assign ((resid  30 and name HE*  ))   ( (resid  58 and name HD2* ))     3.83  2.03  0.57
 assign ((resid  30 and name HE*  ))   ( (resid  58 and name HD1* ))     3.10  1.30  0.47
 assign ((resid  27 and name HN   ))   ( (resid  58 and name HD2* ))     5.99  4.19  0.90
 assign ((resid  54 and name HA   ))   ( (resid  58 and name HD2* ))     5.20  3.40  0.78
 assign ((resid  26 and name HB1  ))   ( (resid  58 and name HD1* ))     3.10  1.30  0.47
 assign ((resid  26 and name HB2  ))   ( (resid  58 and name HD1* ))     3.30  1.50  0.50
 assign ((resid  26 and name HG1  ))   ( (resid  58 and name HD1* ))     3.42  1.62  0.51
 assign ((resid  57 and name HB2  ))   ( (resid  58 and name HD2* ))     3.77  1.97  0.57
 assign ((resid  27 and name HB*  ))   ( (resid  58 and name HD2* ))     4.26  2.46  0.64
 assign ((resid  50 and name HG2* ))   ( (resid  58 and name HD2* ))     3.71  1.91  0.56
 assign ((resid  54 and name HG1* ))   ( (resid  58 and name HD1* ))     3.76  1.96  0.56
 assign ((resid  23 and name HE*  ))   ( (resid  58 and name HB2  ))     5.23  3.43  0.78
 assign ((resid  57 and name HB2  ))   ( (resid  58 and name HB2  ))     5.64  3.84  0.85
 assign ((resid  55 and name HA   ))   ( (resid  58 and name HA   ))     5.37  3.57  0.81
 assign ((resid  59 and name HA   ))   ( (resid  75 and name HD*  ))     5.54  3.74  0.83
 assign ((resid  61 and name HA   ))   ( (resid  65 and name HD2* ))     4.87  3.07  0.73
 assign ((resid  61 and name HB2  ))   ( (resid  65 and name HD1* ))     5.09  3.29  0.76
 assign ((resid  58 and name HD1* ))   ( (resid  61 and name HB2  ))     4.30  2.50  0.65
 assign ((resid  61 and name HB1  ))   ( (resid  65 and name HD1* ))     4.62  2.82  0.69
 assign ((resid  26 and name HB1  ))   ( (resid  58 and name HD2* ))     4.07  2.27  0.61
 assign ((resid  30 and name HE*  ))   ( (resid  61 and name HG*  ))     4.73  2.93  0.71
 assign ((resid   8 and name HZ   ))   ( (resid  62 and name HB*  ))     3.29  1.49  0.49
 assign ((resid   8 and name HD*  ))   ( (resid  62 and name HA   ))     5.45  3.65  0.82
 assign ((resid   8 and name HD*  ))   ( (resid  62 and name HB*  ))     4.44  2.64  0.67
 assign ((resid  62 and name HB*  ))   ( (resid  66 and name HN   ))     4.74  2.94  0.71
 assign ((resid  62 and name HB*  ))   ( (resid  63 and name HA   ))     4.42  2.62  0.66
 assign ((resid   6 and name HD1* ))   ( (resid  62 and name HA   ))     5.68  3.88  0.85
 assign ((resid  62 and name HA   ))   ( (resid  73 and name HG1* ))     5.87  4.07  0.88
 assign ((resid  45 and name HD1* ))   ( (resid  62 and name HB*  ))     4.67  2.87  0.70
 assign ((resid  62 and name HB*  ))   ( (resid  73 and name HG1* ))     3.54  1.74  0.53
 assign ((resid   6 and name HG2* ))   ( (resid  62 and name HB*  ))     3.17  1.37  0.48
 assign ((resid  62 and name HB*  ))   ( (resid  73 and name HG2* ))     3.06  1.26  0.46
 assign ((resid  60 and name HD*  ))   ( (resid  63 and name HG1  ))     5.24  3.44  0.79
 assign ((resid  62 and name HB*  ))   ( (resid  63 and name HG1  ))     4.10  2.30  0.62
 assign ((resid  63 and name HG2  ))   ( (resid  66 and name HB*  ))     4.55  2.75  0.68
 assign ((resid  62 and name HB*  ))   ( (resid  63 and name HG2  ))     4.47  2.67  0.67
 assign ((resid  63 and name HG2  ))   ( (resid  73 and name HG1* ))     3.59  1.79  0.54
 assign ((resid  63 and name HG1  ))   ( (resid  73 and name HG2* ))     5.06  3.26  0.76
 assign ((resid  63 and name HG2  ))   ( (resid  73 and name HG2* ))     5.23  3.43  0.78
 assign ((resid  63 and name HG1  ))   ( (resid  75 and name HD*  ))     5.32  3.52  0.80
 assign ((resid  67 and name HA   ))   ( (resid  70 and name HB2  ))     5.47  3.67  0.82
 assign ((resid  67 and name HA   ))   ( (resid  70 and name HB1  ))     6.00  4.20  0.90
 assign ((resid  70 and name HB1  ))   ( (resid  71 and name HG2* ))     4.50  2.70  0.68
 assign ((resid  70 and name HB2  ))   ( (resid  71 and name HG2* ))     5.17  3.37  0.78
 assign ((resid  15 and name HB*  ))   ( (resid  70 and name HB2  ))     5.80  4.00  0.87
 assign ((resid   8 and name HB*  ))   ( (resid  71 and name HB   ))     5.45  3.65  0.82
 assign ((resid  69 and name HB1  ))   ( (resid  71 and name HG2* ))     4.09  2.29  0.61
 assign ((resid  16 and name HG   ))   ( (resid  71 and name HD1* ))     4.66  2.86  0.70
 assign ((resid  69 and name HB2  ))   ( (resid  71 and name HD1* ))     3.86  2.06  0.58
 assign ((resid   8 and name HB*  ))   ( (resid  71 and name HD1* ))     3.55  1.75  0.53
 assign ((resid  69 and name HB1  ))   ( (resid  71 and name HD1* ))     3.92  2.12  0.59
 assign ((resid  16 and name HA   ))   ( (resid  71 and name HD1* ))     3.76  1.96  0.56
 assign ((resid  71 and name HB   ))   ( (resid  72 and name HA   ))     5.07  3.27  0.76
 assign ((resid  70 and name HA   ))   ( (resid  71 and name HG2* ))     5.01  3.21  0.75
 assign ((resid  69 and name HA   ))   ( (resid  71 and name HD1* ))     5.10  3.30  0.77
 assign ((resid  66 and name HA   ))   ( (resid  71 and name HD1* ))     3.59  1.79  0.54
 assign ((resid   8 and name HA   ))   ( (resid  71 and name HD1* ))     4.87  3.07  0.73
 assign ((resid  69 and name HD*  ))   ( (resid  71 and name HD1* ))     3.75  1.95  0.56
 assign ((resid  16 and name HN   ))   ( (resid  71 and name HD1* ))     4.83  3.03  0.72
 assign ((resid   8 and name HD*  ))   ( (resid  71 and name HB   ))     4.68  2.88  0.70
 assign ((resid  19 and name HN   ))   ( (resid  71 and name HD1* ))     4.58  2.78  0.69
 assign ((resid  69 and name HE*  ))   ( (resid  71 and name HD1* ))     4.38  2.58  0.66
 assign ((resid  66 and name HN   ))   ( (resid  71 and name HD1* ))     4.63  2.83  0.69
 assign ((resid  66 and name HN   ))   ( (resid  71 and name HG12 ))     5.49  3.69  0.82
 assign ((resid  68 and name HN   ))   ( (resid  71 and name HG12 ))     6.00  4.20  0.90
 assign ((resid  69 and name HD*  ))   ( (resid  71 and name HG12 ))     4.40  2.60  0.66
 assign ((resid  10 and name HN   ))   ( (resid  72 and name HG2* ))     5.87  4.07  0.88
 assign ((resid  71 and name HA   ))   ( (resid  72 and name HG2* ))     4.46  2.66  0.67
 assign ((resid   9 and name HB2  ))   ( (resid  72 and name HB   ))     4.22  2.42  0.63
 assign ((resid  62 and name HB*  ))   ( (resid  73 and name HA   ))     5.44  3.64  0.82
 assign ((resid  71 and name HG11 ))   ( (resid  73 and name HA   ))     6.00  4.20  0.90
 assign ((resid  62 and name HB*  ))   ( (resid  73 and name HB   ))     4.76  2.96  0.71
 assign ((resid  71 and name HG11 ))   ( (resid  73 and name HB   ))     5.28  3.48  0.79
 assign ((resid   6 and name HG2* ))   ( (resid  73 and name HB   ))     4.95  3.15  0.74
 assign ((resid  71 and name HD1* ))   ( (resid  73 and name HB   ))     5.33  3.53  0.80
 assign ((resid   6 and name HG2* ))   ( (resid  73 and name HG1* ))     4.37  2.57  0.66
 assign ((resid  72 and name HG2* ))   ( (resid  73 and name HG1* ))     4.65  2.85  0.70
 assign ((resid  66 and name HB*  ))   ( (resid  73 and name HG2* ))     3.54  1.74  0.53
 assign ((resid  63 and name HB2  ))   ( (resid  73 and name HG1* ))     4.65  2.85  0.70
 assign ((resid  63 and name HG1  ))   ( (resid  73 and name HG1* ))     4.07  2.27  0.61
 assign ((resid  23 and name HG2  ))   ( (resid  73 and name HG2* ))     6.00  4.20  0.90
 assign ((resid  73 and name HG2* ))   ( (resid  75 and name HB2  ))     5.50  3.70  0.83
 assign ((resid   8 and name HB*  ))   ( (resid  73 and name HA   ))     5.12  3.32  0.77
 assign ((resid  72 and name HA   ))   ( (resid  73 and name HA   ))     5.02  3.22  0.75
 assign ((resid  73 and name HA   ))   ( (resid  74 and name HA   ))     4.84  3.04  0.73
 assign ((resid  72 and name HB   ))   ( (resid  73 and name HA   ))     5.47  3.67  0.82
 assign ((resid  73 and name HA   ))   ( (resid  74 and name HB   ))     5.22  3.42  0.78
 assign ((resid  72 and name HB   ))   ( (resid  73 and name HB   ))     5.60  3.80  0.84
 assign ((resid  72 and name HA   ))   ( (resid  73 and name HB   ))     4.92  3.12  0.74
 assign ((resid  63 and name HA   ))   ( (resid  73 and name HG1* ))     3.12  1.32  0.47
 assign ((resid  72 and name HA   ))   ( (resid  73 and name HG1* ))     3.86  2.06  0.58
 assign ((resid  72 and name HA   ))   ( (resid  73 and name HG2* ))     5.51  3.71  0.83
 assign ((resid   6 and name HA   ))   ( (resid  73 and name HG2* ))     5.17  3.37  0.78
 assign ((resid  62 and name HA   ))   ( (resid  73 and name HG2* ))     4.70  2.90  0.70
 assign ((resid  63 and name HA   ))   ( (resid  73 and name HG2* ))     4.40  2.60  0.66
 assign ((resid   8 and name HD*  ))   ( (resid  73 and name HA   ))     4.34  2.54  0.65
 assign ((resid   8 and name HD*  ))   ( (resid  73 and name HB   ))     3.53  1.73  0.53
 assign ((resid   8 and name HD*  ))   ( (resid  73 and name HG1* ))     4.58  2.78  0.69
 assign ((resid   8 and name HA   ))   ( (resid  73 and name HG2* ))     3.96  2.16  0.59
 assign ((resid   8 and name HZ   ))   ( (resid  73 and name HG2* ))     3.77  1.97  0.57
 assign ((resid   9 and name HN   ))   ( (resid  73 and name HA   ))     4.23  2.43  0.63
 assign ((resid   7 and name HN   ))   ( (resid  73 and name HA   ))     5.56  3.76  0.83
 assign ((resid  66 and name HN   ))   ( (resid  73 and name HG1* ))     4.30  2.50  0.65
 assign ((resid  73 and name HG1* ))   ( (resid  75 and name HN   ))     5.11  3.31  0.77
 assign ((resid   7 and name HN   ))   ( (resid  74 and name HB   ))     5.59  3.79  0.84
 assign ((resid   7 and name HN   ))   ( (resid  74 and name HG2* ))     4.60  2.80  0.69
 assign ((resid  74 and name HB   ))   ( (resid  75 and name HD*  ))     6.00  4.20  0.90
 assign ((resid  73 and name HA   ))   ( (resid  74 and name HG2* ))     4.28  2.48  0.64
 assign ((resid   7 and name HA   ))   ( (resid  74 and name HG2* ))     5.16  3.36  0.77
 assign ((resid  74 and name HG2* ))   ( (resid  75 and name HD*  ))     5.58  3.78  0.84
 assign ((resid   7 and name HB2  ))   ( (resid  74 and name HB   ))     5.76  3.96  0.86
 assign ((resid   7 and name HB2  ))   ( (resid  74 and name HG2* ))     4.09  2.29  0.61
 assign ((resid  73 and name HG2* ))   ( (resid  74 and name HA   ))     4.45  2.65  0.67
 assign ((resid  73 and name HG1* ))   ( (resid  74 and name HB   ))     5.18  3.38  0.78
 assign ((resid  73 and name HG2* ))   ( (resid  74 and name HB   ))     4.92  3.12  0.74
 assign ((resid  73 and name HG2* ))   ( (resid  74 and name HG2* ))     4.26  2.46  0.64
 assign ((resid   7 and name HN   ))   ( (resid  75 and name HA   ))     4.48  2.68  0.67
 assign ((resid   6 and name HG12 ))   ( (resid  75 and name HB1  ))     4.01  2.21  0.60
 assign ((resid   6 and name HG11 ))   ( (resid  75 and name HA   ))     5.38  3.58  0.81
 assign ((resid  75 and name HA   ))   ( (resid  76 and name HG2* ))     5.64  3.84  0.85
 assign ((resid   6 and name HG12 ))   ( (resid  75 and name HA   ))     4.79  2.99  0.72
 assign ((resid   6 and name HG2* ))   ( (resid  75 and name HA   ))     4.71  2.91  0.71
 assign ((resid  59 and name HB*  ))   ( (resid  75 and name HA   ))     6.00  4.20  0.90
 assign ((resid  75 and name HA   ))   ( (resid  77 and name HG2* ))     6.00  4.20  0.90
 assign ((resid  75 and name HA   ))   ( (resid  77 and name HD1* ))     6.00  4.20  0.90
 assign ((resid   6 and name HG12 ))   ( (resid  75 and name HB2  ))     4.18  2.38  0.63
 assign ((resid  75 and name HD*  ))   ( (resid  77 and name HD1* ))     3.76  1.96  0.56
 assign ((resid  75 and name HD*  ))   ( (resid  77 and name HG11 ))     4.48  2.68  0.67
 assign ((resid  75 and name HE*  ))   ( (resid  77 and name HG11 ))     4.69  2.89  0.70
 assign ((resid  75 and name HD*  ))   ( (resid  77 and name HG2* ))     4.97  3.17  0.75
 assign ((resid  56 and name HA   ))   ( (resid  77 and name HD1* ))     3.83  2.03  0.57
 assign ((resid  56 and name HE*  ))   ( (resid  77 and name HD1* ))     4.41  2.61  0.66
 assign ((resid   4 and name HG*  ))   ( (resid  77 and name HG11 ))     5.05  3.25  0.76
 assign ((resid  56 and name HG2  ))   ( (resid  77 and name HD1* ))     3.88  2.08  0.58
 assign ((resid  36 and name HB2  ))   ( (resid  45 and name HG12 ))     4.76  2.96  0.71
 assign ((resid   6 and name HA   ))   ( (resid  45 and name HD1* ))     5.64  3.84  0.85
 assign ((resid  23 and name HA   ))   ( (resid  45 and name HD1* ))     5.95  4.15  0.89
 assign ((resid  20 and name HA   ))   ( (resid  45 and name HD1* ))     3.55  1.75  0.53
 assign ((resid   8 and name HB*  ))   ( (resid  45 and name HD1* ))     4.38  2.58  0.66
 assign ((resid  23 and name HG2  ))   ( (resid  45 and name HD1* ))     3.75  1.95  0.56
 assign ((resid  23 and name HE*  ))   ( (resid  45 and name HD1* ))     3.97  2.17  0.60
 assign ((resid  45 and name HD1* ))   ( (resid  73 and name HG2* ))     5.26  3.46  0.79
 assign ((resid   6 and name HG2* ))   ( (resid  45 and name HD1* ))     3.54  1.74  0.53
 assign ((resid  53 and name HG2  ))   ( (resid  54 and name HG2* ))     4.44  2.64  0.67
 assign ((resid   6 and name HG2* ))   ( (resid  61 and name HG*  ))     6.00  4.20  0.90
 assign ((resid  55 and name HA   ))   ( (resid  58 and name HD2* ))     3.53  1.73  0.53
 assign ((resid  50 and name HG2* ))   ( (resid  55 and name HA   ))     4.21  2.41  0.63
 assign ((resid  21 and name HN   ))   ( (resid  21 and name HB*  ))     3.38  1.58  0.51
 assign ((resid   3 and name HG*  ))   ( (resid   4 and name HA   ))     4.26  2.46  0.64
 assign ((resid   3 and name HA   ))   ( (resid  48 and name HG2* ))     5.04  3.24  0.76
 assign ((resid   3 and name HB2  ))   ( (resid  48 and name HG2* ))     4.49  2.69  0.67
 assign ((resid   3 and name HB1  ))   ( (resid  48 and name HG2* ))     4.49  2.69  0.67
 assign ((resid   3 and name HG*  ))   ( (resid  48 and name HG2* ))     4.21  2.41  0.63
 assign ((resid   3 and name HG*  ))   ( (resid  77 and name HG2* ))     5.96  4.16  0.89
 assign ((resid   4 and name HA   ))   ( (resid   5 and name HA   ))     4.82  3.02  0.72
 assign ((resid   4 and name HA   ))   ( (resid   5 and name HB2  ))     5.22  3.42  0.78
 assign ((resid   4 and name HA   ))   ( (resid   5 and name HB1  ))     5.22  3.42  0.78
 assign ((resid   6 and name HG12 ))   ( (resid  62 and name HB*  ))     4.32  2.52  0.65
 assign ((resid   6 and name HD1* ))   ( (resid  23 and name HB1  ))     3.93  2.13  0.59
 assign ((resid   6 and name HD1* ))   ( (resid  45 and name HG2* ))     3.05  1.25  0.46
 assign ((resid   6 and name HA   ))   ( (resid  75 and name HA   ))     3.94  2.14  0.59
 assign ((resid   6 and name HB   ))   ( (resid  23 and name HE*  ))     4.89  3.09  0.73
 assign ((resid   6 and name HB   ))   ( (resid  45 and name HB   ))     3.73  1.93  0.56
 assign ((resid   7 and name HD1  ))   ( (resid  74 and name HG2* ))     4.23  2.43  0.63
 assign ((resid   7 and name HB1  ))   ( (resid  74 and name HB   ))     5.76  3.96  0.86
 assign ((resid   7 and name HA   ))   ( (resid  74 and name HN   ))     5.88  4.08  0.88
 assign ((resid   9 and name HB2  ))   ( (resid   9 and name HE   ))     4.70  2.90  0.70
 assign ((resid   9 and name HB1  ))   ( (resid   9 and name HE   ))     4.70  2.90  0.70
 assign ((resid   9 and name HG*  ))   ( (resid  42 and name HB2  ))     4.38  2.58  0.66
 assign ((resid   9 and name HG*  ))   ( (resid  42 and name HB1  ))     4.38  2.58  0.66
 assign ((resid   9 and name HA   ))   ( (resid  10 and name HA1  ))     4.56  2.76  0.68
 assign ((resid  10 and name HA2  ))   ( (resid  71 and name HA   ))     4.17  2.37  0.63
 assign ((resid  10 and name HA2  ))   ( (resid  11 and name HB2  ))     4.49  2.69  0.67
 assign ((resid  11 and name HB1  ))   ( (resid  71 and name HG2* ))     5.68  3.88  0.85
 assign ((resid  11 and name HB2  ))   ( (resid  71 and name HG2* ))     5.97  4.17  0.90
 assign ((resid  10 and name HA1  ))   ( (resid  11 and name HB2  ))     4.96  3.16  0.74
 assign ((resid  11 and name HB1  ))   ( (resid  41 and name HD21 ))     5.92  4.12  0.89
 assign ((resid  11 and name HB2  ))   ( (resid  41 and name HD21 ))     5.79  3.99  0.87
 assign ((resid  12 and name HA   ))   ( (resid  13 and name HB2  ))     5.33  3.53  0.80
 assign ((resid  13 and name HB2  ))   ( (resid  41 and name HA   ))     5.50  3.70  0.83
 assign ((resid  12 and name HA   ))   ( (resid  13 and name HB1  ))     5.35  3.55  0.80
 assign ((resid  13 and name HB1  ))   ( (resid  41 and name HA   ))     6.00  4.20  0.90
 assign ((resid  14 and name HB1  ))   ( (resid  15 and name HA   ))     4.79  2.99  0.72
 assign ((resid  14 and name HB2  ))   ( (resid  15 and name HB*  ))     4.42  2.62  0.66
 assign ((resid  14 and name HN   ))   ( (resid  15 and name HA   ))     5.41  3.61  0.81
 assign ((resid  54 and name HG1* ))   ( (resid  58 and name HG   ))     3.87  2.07  0.58
 assign ((resid  16 and name HD2* ))   ( (resid  71 and name HD1* ))     3.12  1.32  0.47
 assign ((resid   8 and name HD*  ))   ( (resid  16 and name HA   ))     4.87  3.07  0.73
 assign ((resid  17 and name HA   ))   ( (resid  21 and name HN   ))     4.97  3.17  0.75
 assign ((resid  18 and name HD1  ))   ( (resid  69 and name HD*  ))     4.33  2.53  0.65
 assign ((resid  29 and name HE*  ))   ( (resid  30 and name HN   ))     5.62  3.82  0.84
 assign ((resid  15 and name HA   ))   ( (resid  18 and name HE2  ))     5.29  3.49  0.79
 assign ((resid  15 and name HA   ))   ( (resid  18 and name HE1  ))     5.29  3.49  0.79
 assign ((resid  14 and name HB1  ))   ( (resid  18 and name HE1  ))     4.60  2.80  0.69
 assign ((resid  14 and name HB1  ))   ( (resid  18 and name HE2  ))     4.60  2.80  0.69
 assign ((resid  18 and name HA   ))   ( (resid  21 and name HD*  ))     4.63  2.83  0.69
 assign ((resid  18 and name HB1  ))   ( (resid  19 and name HB*  ))     5.21  3.41  0.78
 assign ((resid  18 and name HB2  ))   ( (resid  19 and name HB*  ))     5.06  3.26  0.76
 assign ((resid  19 and name HB*  ))   ( (resid  69 and name HE*  ))     3.63  1.83  0.54
 assign ((resid  17 and name HN   ))   ( (resid  19 and name HB*  ))     5.26  3.46  0.79
 assign ((resid  19 and name HB*  ))   ( (resid  66 and name HN   ))     5.00  3.20  0.75
 assign ((resid  19 and name HB*  ))   ( (resid  65 and name HN   ))     5.31  3.51  0.80
 assign ((resid  20 and name HB2  ))   ( (resid  24 and name HD1* ))     5.99  4.19  0.90
 assign ((resid  20 and name HG   ))   ( (resid  38 and name HD2* ))     4.68  2.88  0.70
 assign ((resid  20 and name HG   ))   ( (resid  24 and name HG11 ))     5.33  3.53  0.80
 assign ((resid  20 and name HG   ))   ( (resid  38 and name HG   ))     6.00  4.20  0.90
 assign ((resid  20 and name HD2* ))   ( (resid  24 and name HG11 ))     5.15  3.35  0.77
 assign ((resid  20 and name HD2* ))   ( (resid  36 and name HB2  ))     5.08  3.28  0.76
 assign ((resid  17 and name HA   ))   ( (resid  20 and name HG   ))     5.09  3.29  0.76
 assign ((resid  20 and name HB2  ))   ( (resid  21 and name HN   ))     4.51  2.71  0.68
 assign ((resid  20 and name HD2* ))   ( (resid  24 and name HN   ))     5.83  4.03  0.87
 assign ((resid  20 and name HN   ))   ( (resid  21 and name HA   ))     5.65  3.85  0.85
 assign ((resid  21 and name HA   ))   ( (resid  24 and name HG2* ))     4.56  2.76  0.68
 assign ((resid  21 and name HA   ))   ( (resid  24 and name HD1* ))     3.58  1.78  0.54
 assign ((resid  20 and name HD1* ))   ( (resid  21 and name HA   ))     5.06  3.26  0.76
 assign ((resid  20 and name HD2* ))   ( (resid  21 and name HA   ))     5.06  3.26  0.76
 assign ((resid  21 and name HN   ))   ( (resid  21 and name HG2  ))     4.69  2.89  0.70
 assign ((resid  21 and name HN   ))   ( (resid  21 and name HD*  ))     4.69  2.89  0.70
 assign ((resid  21 and name HN   ))   ( (resid  21 and name HE*  ))     4.58  2.78  0.69
 assign ((resid  21 and name HD*  ))   ( (resid  22 and name HN   ))     4.96  3.16  0.74
 assign ((resid  21 and name HE*  ))   ( (resid  22 and name HN   ))     4.60  2.80  0.69
 assign ((resid  18 and name HA   ))   ( (resid  21 and name HE*  ))     4.38  2.58  0.66
 assign ((resid  21 and name HN   ))   ( (resid  22 and name HG2  ))     4.66  2.86  0.70
 assign ((resid  21 and name HN   ))   ( (resid  22 and name HB2  ))     5.30  3.50  0.80
 assign ((resid  22 and name HB1  ))   ( (resid  25 and name HN   ))     5.81  4.01  0.87
 assign ((resid  22 and name HB2  ))   ( (resid  65 and name HD1* ))     3.74  1.94  0.56
 assign ((resid  22 and name HB2  ))   ( (resid  65 and name HD2* ))     3.78  1.98  0.57
 assign ((resid  22 and name HA   ))   ( (resid  65 and name HD1* ))     4.84  3.04  0.73
 assign ((resid  22 and name HA   ))   ( (resid  65 and name HD2* ))     5.24  3.44  0.79
 assign ((resid   6 and name HG2* ))   ( (resid  23 and name HB1  ))     5.53  3.73  0.83
 assign ((resid  23 and name HB2  ))   ( (resid  43 and name HD2* ))     5.50  3.70  0.83
 assign ((resid  23 and name HG1  ))   ( (resid  62 and name HB*  ))     5.13  3.33  0.77
 assign ((resid   6 and name HB   ))   ( (resid  23 and name HG1  ))     5.42  3.62  0.81
 assign ((resid   6 and name HD1* ))   ( (resid  23 and name HG2  ))     5.03  3.23  0.75
 assign ((resid  19 and name HB*  ))   ( (resid  23 and name HE*  ))     5.43  3.63  0.81
 assign ((resid  23 and name HE*  ))   ( (resid  58 and name HD1* ))     2.44  0.64  0.37
 assign ((resid  20 and name HA   ))   ( (resid  23 and name HG1  ))     5.21  3.41  0.78
 assign ((resid  23 and name HE*  ))   ( (resid  59 and name HA   ))     4.88  3.08  0.73
 assign ((resid  22 and name HN   ))   ( (resid  23 and name HG2  ))     5.03  3.23  0.75
 assign ((resid  23 and name HE*  ))   ( (resid  26 and name HE21 ))     5.71  3.91  0.86
 assign ((resid  22 and name HN   ))   ( (resid  23 and name HE*  ))     6.00  4.20  0.90
 assign ((resid  24 and name HA   ))   ( (resid  28 and name HN   ))     4.67  2.87  0.70
 assign ((resid  24 and name HG12 ))   ( (resid  36 and name HD*  ))     5.56  3.76  0.83
 assign ((resid  24 and name HG12 ))   ( (resid  25 and name HN   ))     5.03  3.23  0.75
 assign ((resid  24 and name HN   ))   ( (resid  24 and name HG12 ))     4.16  2.36  0.62
 assign ((resid  24 and name HG2* ))   ( (resid  28 and name HE   ))     4.61  2.81  0.69
 assign ((resid  24 and name HA   ))   ( (resid  34 and name HB   ))     4.33  2.53  0.65
 assign ((resid  24 and name HG2* ))   ( (resid  27 and name HB*  ))     3.82  2.02  0.57
 assign ((resid  24 and name HA   ))   ( (resid  25 and name HA   ))     5.01  3.21  0.75
 assign ((resid  24 and name HB   ))   ( (resid  25 and name HA   ))     4.99  3.19  0.75
 assign ((resid  21 and name HA   ))   ( (resid  24 and name HG12 ))     5.41  3.61  0.81
 assign ((resid  20 and name HA   ))   ( (resid  24 and name HG11 ))     5.10  3.30  0.77
 assign ((resid  24 and name HG12 ))   ( (resid  34 and name HB   ))     4.98  3.18  0.75
 assign ((resid  20 and name HD1* ))   ( (resid  24 and name HG2* ))     5.66  3.86  0.85
 assign ((resid  20 and name HD1* ))   ( (resid  24 and name HG11 ))     5.15  3.35  0.77
 assign ((resid  20 and name HD1* ))   ( (resid  24 and name HD1* ))     3.98  2.18  0.60
 assign ((resid  24 and name HA   ))   ( (resid  34 and name HG2* ))     3.68  1.88  0.55
 assign ((resid  24 and name HG11 ))   ( (resid  34 and name HG2* ))     3.90  2.10  0.59
 assign ((resid  24 and name HG12 ))   ( (resid  34 and name HG2* ))     3.93  2.13  0.59
 assign ((resid  24 and name HD1* ))   ( (resid  34 and name HG2* ))     3.60  1.80  0.54
 assign ((resid  25 and name HA   ))   ( (resid  27 and name HB*  ))     5.51  3.71  0.83
 assign ((resid  24 and name HG2* ))   ( (resid  25 and name HA   ))     3.68  1.88  0.55
 assign ((resid  24 and name HG2* ))   ( (resid  25 and name HB2  ))     4.62  2.82  0.69
 assign ((resid  22 and name HA   ))   ( (resid  25 and name HG1  ))     5.67  3.87  0.85
 assign ((resid  61 and name HA   ))   ( (resid  64 and name HG2  ))     4.48  2.68  0.67
 assign ((resid  22 and name HA   ))   ( (resid  25 and name HD1  ))     4.19  2.39  0.63
 assign ((resid  22 and name HA   ))   ( (resid  25 and name HD2  ))     4.65  2.85  0.70
 assign ((resid  26 and name HG2  ))   ( (resid  27 and name HN   ))     4.58  2.78  0.69
 assign ((resid  26 and name HG2  ))   ( (resid  30 and name HE*  ))     5.36  3.56  0.80
 assign ((resid  22 and name HA   ))   ( (resid  26 and name HG2  ))     5.16  3.36  0.77
 assign ((resid  26 and name HG1  ))   ( (resid  65 and name HD1* ))     5.22  3.42  0.78
 assign ((resid  26 and name HB2  ))   ( (resid  27 and name HB*  ))     5.20  3.40  0.78
 assign ((resid  27 and name HB*  ))   ( (resid  32 and name HA2  ))     5.92  4.12  0.89
 assign ((resid  27 and name HB*  ))   ( (resid  33 and name HA   ))     5.28  3.48  0.79
 assign ((resid  27 and name HB*  ))   ( (resid  30 and name HN   ))     4.75  2.95  0.71
 assign ((resid  27 and name HB*  ))   ( (resid  34 and name HA   ))     4.83  3.03  0.72
 assign ((resid  25 and name HN   ))   ( (resid  27 and name HB*  ))     5.57  3.77  0.84
 assign ((resid  27 and name HB*  ))   ( (resid  29 and name HN   ))     5.87  4.07  0.88
 assign ((resid  28 and name HB2  ))   ( (resid  28 and name HE   ))     4.82  3.02  0.72
 assign ((resid  28 and name HB1  ))   ( (resid  28 and name HE   ))     5.16  3.36  0.77
 assign ((resid  28 and name HG1  ))   ( (resid  28 and name HE   ))     3.95  2.15  0.59
 assign ((resid   8 and name HD*  ))   ( (resid  45 and name HG11 ))     4.50  2.70  0.68
 assign ((resid  36 and name HD*  ))   ( (resid  45 and name HG11 ))     5.74  3.94  0.86
 assign ((resid  43 and name HA   ))   ( (resid  45 and name HG11 ))     5.41  3.61  0.81
 assign ((resid  25 and name HA   ))   ( (resid  28 and name HD2  ))     5.32  3.52  0.80
 assign ((resid  25 and name HA   ))   ( (resid  28 and name HD1  ))     5.32  3.52  0.80
 assign ((resid  25 and name HA   ))   ( (resid  28 and name HG1  ))     3.50  1.70  0.53
 assign ((resid  27 and name HB*  ))   ( (resid  28 and name HA   ))     4.39  2.59  0.66
 assign ((resid  27 and name HB*  ))   ( (resid  28 and name HB2  ))     5.12  3.32  0.77
 assign ((resid  27 and name HB*  ))   ( (resid  28 and name HG1  ))     4.20  2.40  0.63
 assign ((resid  24 and name HG2* ))   ( (resid  28 and name HB2  ))     4.04  2.24  0.61
 assign ((resid  24 and name HG2* ))   ( (resid  28 and name HA   ))     5.07  3.27  0.76
 assign ((resid  28 and name HA   ))   ( (resid  34 and name HG1* ))     5.40  3.60  0.81
 assign ((resid  29 and name HB*  ))   ( (resid  31 and name HN   ))     5.22  3.42  0.78
 assign ((resid  28 and name HN   ))   ( (resid  29 and name HB*  ))     5.03  3.23  0.75
 assign ((resid  29 and name HG2  ))   ( (resid  30 and name HD*  ))     4.99  3.19  0.75
 assign ((resid  29 and name HG2  ))   ( (resid  30 and name HE*  ))     5.43  3.63  0.81
 assign ((resid  29 and name HG1  ))   ( (resid  30 and name HD*  ))     4.99  3.19  0.75
 assign ((resid  29 and name HG1  ))   ( (resid  30 and name HE*  ))     5.43  3.63  0.81
 assign ((resid  29 and name HE*  ))   ( (resid  30 and name HE*  ))     4.28  2.48  0.64
 assign ((resid  26 and name HG1  ))   ( (resid  30 and name HZ   ))     6.00  4.20  0.90
 assign ((resid  30 and name HD*  ))   ( (resid  31 and name HB*  ))     5.54  3.74  0.83
 assign ((resid  30 and name HA   ))   ( (resid  31 and name HB*  ))     4.10  2.30  0.62
 assign ((resid  31 and name HB*  ))   ( (resid  32 and name HA2  ))     4.81  3.01  0.72
 assign ((resid  31 and name HB*  ))   ( (resid  32 and name HA1  ))     5.00  3.20  0.75
 assign ((resid  31 and name HA   ))   ( (resid  32 and name HA1  ))     4.98  3.18  0.75
 assign ((resid  32 and name HA1  ))   ( (resid  50 and name HN   ))     5.48  3.68  0.82
 assign ((resid  33 and name HG2* ))   ( (resid  47 and name HA   ))     4.19  2.39  0.63
 assign ((resid  33 and name HG2* ))   ( (resid  34 and name HA   ))     4.32  2.52  0.65
 assign ((resid  32 and name HA1  ))   ( (resid  33 and name HB   ))     4.89  3.09  0.73
 assign ((resid  76 and name HG2* ))   ( (resid  78 and name HD*  ))     4.60  2.80  0.69
 assign ((resid  76 and name HG2* ))   ( (resid  78 and name HG*  ))     3.76  1.96  0.56
 assign ((resid  33 and name HG2* ))   ( (resid  34 and name HB   ))     4.57  2.77  0.69
 assign ((resid  24 and name HD1* ))   ( (resid  34 and name HB   ))     5.75  3.95  0.86
 assign ((resid  24 and name HD1* ))   ( (resid  34 and name HG1* ))     4.09  2.29  0.61
 assign ((resid  33 and name HA   ))   ( (resid  34 and name HB   ))     4.78  2.98  0.72
 assign ((resid  24 and name HA   ))   ( (resid  34 and name HG1* ))     3.55  1.75  0.53
 assign ((resid  33 and name HA   ))   ( (resid  34 and name HG1* ))     4.51  2.71  0.68
 assign ((resid  34 and name HG2* ))   ( (resid  36 and name HB1  ))     4.49  2.69  0.67
 assign ((resid  23 and name HA   ))   ( (resid  34 and name HG2* ))     5.71  3.91  0.86
 assign ((resid  33 and name HA   ))   ( (resid  34 and name HG2* ))     6.00  4.20  0.90
 assign ((resid  34 and name HG1* ))   ( (resid  36 and name HE*  ))     4.74  2.94  0.71
 assign ((resid  24 and name HN   ))   ( (resid  34 and name HG2* ))     4.73  2.93  0.71
 assign ((resid  33 and name HN   ))   ( (resid  34 and name HG2* ))     6.00  4.20  0.90
 assign ((resid  34 and name HG2* ))   ( (resid  36 and name HN   ))     5.06  3.26  0.76
 assign ((resid  34 and name HG2* ))   ( (resid  46 and name HN   ))     4.81  3.01  0.72
 assign ((resid  28 and name HN   ))   ( (resid  34 and name HG1* ))     4.63  2.83  0.69
 assign ((resid  35 and name HB   ))   ( (resid  45 and name HG2* ))     4.98  3.18  0.75
 assign ((resid   9 and name HG*  ))   ( (resid  72 and name HB   ))     4.94  3.14  0.74
 assign ((resid   9 and name HB1  ))   ( (resid  72 and name HB   ))     4.22  2.42  0.63
 assign ((resid  36 and name HA   ))   ( (resid  45 and name HA   ))     3.73  1.93  0.56
 assign ((resid  35 and name HA   ))   ( (resid  36 and name HE*  ))     5.04  3.24  0.76
 assign ((resid  36 and name HA   ))   ( (resid  46 and name HN   ))     4.03  2.23  0.60
 assign ((resid  36 and name HA   ))   ( (resid  45 and name HG11 ))     4.83  3.03  0.72
 assign ((resid  35 and name HG2* ))   ( (resid  36 and name HA   ))     5.26  3.46  0.79
 assign ((resid  36 and name HE*  ))   ( (resid  43 and name HD1* ))     5.13  3.33  0.77
 assign ((resid  36 and name HA   ))   ( (resid  43 and name HD1* ))     4.04  2.24  0.61
 assign ((resid  36 and name HA   ))   ( (resid  45 and name HG2* ))     4.06  2.26  0.61
 assign ((resid  36 and name HB2  ))   ( (resid  45 and name HG2* ))     4.49  2.69  0.67
 assign ((resid  37 and name HB   ))   ( (resid  38 and name HD2* ))     5.04  3.24  0.76
 assign ((resid  37 and name HB   ))   ( (resid  44 and name HB1  ))     4.04  2.24  0.61
 assign ((resid  37 and name HG2* ))   ( (resid  44 and name HB1  ))     4.49  2.69  0.67
 assign ((resid  36 and name HA   ))   ( (resid  37 and name HB   ))     5.01  3.21  0.75
 assign ((resid  36 and name HD*  ))   ( (resid  37 and name HB   ))     6.00  4.20  0.90
 assign ((resid  36 and name HD*  ))   ( (resid  37 and name HG2* ))     5.58  3.78  0.84
 assign ((resid  37 and name HB   ))   ( (resid  44 and name HN   ))     4.84  3.04  0.73
 assign ((resid  37 and name HG2* ))   ( (resid  39 and name HB2  ))     4.02  2.22  0.60
 assign ((resid  37 and name HG2* ))   ( (resid  39 and name HB1  ))     4.02  2.22  0.60
 assign ((resid  38 and name HD2* ))   ( (resid  39 and name HB2  ))     6.00  4.20  0.90
 assign ((resid  38 and name HD2* ))   ( (resid  39 and name HB1  ))     6.00  4.20  0.90
 assign ((resid  39 and name HN   ))   ( (resid  39 and name HB2  ))     4.15  2.35  0.62
 assign ((resid  39 and name HN   ))   ( (resid  39 and name HB1  ))     4.15  2.35  0.62
 assign ((resid  39 and name HN   ))   ( (resid  42 and name HB2  ))     6.00  4.20  0.90
 assign ((resid  20 and name HN   ))   ( (resid  43 and name HG   ))     6.00  4.20  0.90
 assign ((resid   8 and name HD*  ))   ( (resid  43 and name HA   ))     6.00  4.20  0.90
 assign ((resid  38 and name HA   ))   ( (resid  43 and name HB2  ))     4.92  3.12  0.74
 assign ((resid  38 and name HA   ))   ( (resid  43 and name HA   ))     3.59  1.79  0.54
 assign ((resid  38 and name HA   ))   ( (resid  43 and name HD1* ))     3.69  1.89  0.55
 assign ((resid  42 and name HA   ))   ( (resid  43 and name HD2* ))     6.00  4.20  0.90
 assign ((resid  36 and name HB1  ))   ( (resid  43 and name HD1* ))     3.85  2.05  0.58
 assign ((resid  16 and name HA   ))   ( (resid  43 and name HD1* ))     5.51  3.71  0.83
 assign ((resid  17 and name HA   ))   ( (resid  43 and name HD1* ))     5.80  4.00  0.87
 assign ((resid  20 and name HA   ))   ( (resid  43 and name HD1* ))     4.34  2.54  0.65
 assign ((resid  43 and name HB2  ))   ( (resid  71 and name HD1* ))     6.00  4.20  0.90
 assign ((resid  20 and name HD1* ))   ( (resid  43 and name HD1* ))     3.87  2.07  0.58
 assign ((resid  16 and name HD2* ))   ( (resid  43 and name HD1* ))     4.84  3.04  0.73
 assign ((resid  19 and name HB*  ))   ( (resid  43 and name HD1* ))     5.46  3.66  0.82
 assign ((resid  20 and name HB2  ))   ( (resid  43 and name HD1* ))     3.55  1.75  0.53
 assign ((resid  20 and name HB1  ))   ( (resid  43 and name HD1* ))     4.09  2.29  0.61
 assign ((resid  43 and name HD1* ))   ( (resid  45 and name HG11 ))     3.45  1.65  0.52
 assign ((resid  37 and name HN   ))   ( (resid  44 and name HB2  ))     5.12  3.32  0.77
 assign ((resid   5 and name HA   ))   ( (resid  46 and name HA   ))     4.21  2.41  0.63
 assign ((resid  37 and name HG2* ))   ( (resid  44 and name HB2  ))     5.45  3.65  0.82
 assign ((resid  23 and name HN   ))   ( (resid  45 and name HD1* ))     4.53  2.73  0.68
 assign ((resid  24 and name HN   ))   ( (resid  45 and name HD1* ))     4.86  3.06  0.73
 assign ((resid  20 and name HN   ))   ( (resid  45 and name HD1* ))     4.77  2.97  0.72
 assign ((resid  35 and name HN   ))   ( (resid  45 and name HG2* ))     4.40  2.60  0.66
 assign ((resid   8 and name HD*  ))   ( (resid  45 and name HD1* ))     3.56  1.76  0.53
 assign ((resid  36 and name HD*  ))   ( (resid  45 and name HD1* ))     5.76  3.96  0.86
 assign ((resid  36 and name HA   ))   ( (resid  45 and name HD1* ))     5.10  3.30  0.77
 assign ((resid  36 and name HA   ))   ( (resid  45 and name HG12 ))     5.39  3.59  0.81
 assign ((resid  36 and name HD*  ))   ( (resid  45 and name HG12 ))     5.97  4.17  0.90
 assign ((resid  36 and name HD*  ))   ( (resid  45 and name HG2* ))     4.79  2.99  0.72
 assign ((resid   8 and name HE*  ))   ( (resid  45 and name HG2* ))     5.45  3.65  0.82
 assign ((resid  45 and name HG2* ))   ( (resid  46 and name HA   ))     4.78  2.98  0.72
 assign ((resid  45 and name HG2* ))   ( (resid  47 and name HA   ))     5.44  3.64  0.82
 assign ((resid  44 and name HA   ))   ( (resid  45 and name HG2* ))     5.64  3.84  0.85
 assign ((resid  36 and name HB1  ))   ( (resid  45 and name HG2* ))     4.36  2.56  0.65
 assign ((resid  36 and name HB2  ))   ( (resid  45 and name HG11 ))     4.75  2.95  0.71
 assign ((resid  45 and name HG2* ))   ( (resid  47 and name HG11 ))     3.02  1.22  0.45
 assign ((resid  23 and name HE*  ))   ( (resid  45 and name HG2* ))     4.39  2.59  0.66
 assign ((resid  16 and name HD2* ))   ( (resid  71 and name HG2* ))     3.48  1.68  0.52
 assign ((resid  19 and name HB*  ))   ( (resid  45 and name HD1* ))     4.27  2.47  0.64
 assign ((resid  43 and name HB1  ))   ( (resid  45 and name HD1* ))     4.89  3.09  0.73
 assign ((resid   6 and name HB   ))   ( (resid  45 and name HD1* ))     3.69  1.89  0.55
 assign ((resid  43 and name HG   ))   ( (resid  45 and name HD1* ))     4.02  2.22  0.60
 assign ((resid  47 and name HD1* ))   ( (resid  50 and name HG2* ))     4.44  2.64  0.67
 assign ((resid   6 and name HG2* ))   ( (resid  47 and name HD1* ))     4.56  2.76  0.68
 assign ((resid   6 and name HG11 ))   ( (resid  47 and name HD1* ))     4.31  2.51  0.65
 assign ((resid  45 and name HB   ))   ( (resid  47 and name HD1* ))     3.90  2.10  0.59
 assign ((resid  23 and name HG1  ))   ( (resid  47 and name HD1* ))     5.54  3.74  0.83
 assign ((resid  23 and name HG2  ))   ( (resid  47 and name HD1* ))     6.00  4.20  0.90
 assign ((resid  34 and name HA   ))   ( (resid  47 and name HD1* ))     4.51  2.71  0.68
 assign ((resid  34 and name HA   ))   ( (resid  47 and name HG12 ))     4.41  2.61  0.66
 assign ((resid  47 and name HG2* ))   ( (resid  48 and name HA   ))     4.83  3.03  0.72
 assign ((resid  48 and name HG2* ))   ( (resid  49 and name HA2  ))     4.08  2.28  0.61
 assign ((resid  47 and name HG2* ))   ( (resid  48 and name HB   ))     5.01  3.21  0.75
 assign ((resid  49 and name HA2  ))   ( (resid  50 and name HG1* ))     5.50  3.70  0.83
 assign ((resid  48 and name HG2* ))   ( (resid  49 and name HA1  ))     4.91  3.11  0.74
 assign ((resid  49 and name HA1  ))   ( (resid  50 and name HG1* ))     4.82  3.02  0.72
 assign ((resid  33 and name HN   ))   ( (resid  49 and name HA1  ))     3.69  1.89  0.55
 assign ((resid  33 and name HN   ))   ( (resid  50 and name HG1* ))     4.56  2.76  0.68
 assign ((resid  32 and name HA1  ))   ( (resid  50 and name HG2* ))     5.05  3.25  0.76
 assign ((resid  32 and name HA2  ))   ( (resid  50 and name HG1* ))     4.10  2.30  0.62
 assign ((resid  50 and name HG1* ))   ( (resid  51 and name HD1  ))     4.10  2.30  0.62
 assign ((resid  50 and name HA   ))   ( (resid  51 and name HD1  ))     3.57  1.77  0.54
 assign ((resid  47 and name HG2* ))   ( (resid  50 and name HG2* ))     2.68  0.88  0.40
 assign ((resid  27 and name HB*  ))   ( (resid  50 and name HG2* ))     4.74  2.94  0.71
 assign ((resid  47 and name HG2* ))   ( (resid  50 and name HG1* ))     2.81  1.01  0.42
 assign ((resid  33 and name HG2* ))   ( (resid  50 and name HG1* ))     6.00  4.20  0.90
 assign ((resid  48 and name HG2* ))   ( (resid  50 and name HG1* ))     6.00  4.20  0.90
 assign ((resid  27 and name HB*  ))   ( (resid  50 and name HG1* ))     4.70  2.90  0.70
 assign ((resid  51 and name HB2  ))   ( (resid  54 and name HN   ))     4.76  2.96  0.71
 assign ((resid  30 and name HD*  ))   ( (resid  51 and name HD2  ))     5.22  3.42  0.78
 assign ((resid  51 and name HB2  ))   ( (resid  53 and name HN   ))     4.37  2.57  0.66
 assign ((resid  51 and name HB1  ))   ( (resid  53 and name HN   ))     4.61  2.81  0.69
 assign ((resid  51 and name HG1  ))   ( (resid  52 and name HN   ))     5.14  3.34  0.77
 assign ((resid  52 and name HG*  ))   ( (resid  77 and name HG2* ))     4.99  3.19  0.75
 assign ((resid  52 and name HA   ))   ( (resid  55 and name HD2  ))     4.88  3.08  0.73
 assign ((resid  55 and name HA   ))   ( (resid  55 and name HD2  ))     5.46  3.66  0.82
 assign ((resid  52 and name HG*  ))   ( (resid  53 and name HA   ))     4.24  2.44  0.64
 assign ((resid  53 and name HB1  ))   ( (resid  54 and name HN   ))     4.13  2.33  0.62
 assign ((resid  53 and name HB2  ))   ( (resid  54 and name HN   ))     4.13  2.33  0.62
 assign ((resid  61 and name HG*  ))   ( (resid  62 and name HB*  ))     5.07  3.27  0.76
 assign ((resid   4 and name HE*  ))   ( (resid  61 and name HG*  ))     6.00  4.20  0.90
 assign ((resid  58 and name HG   ))   ( (resid  61 and name HG*  ))     6.00  4.20  0.90
 assign ((resid  60 and name HD*  ))   ( (resid  61 and name HG*  ))     6.00  4.20  0.90
 assign ((resid  54 and name HB   ))   ( (resid  57 and name HG*  ))     5.29  3.49  0.79
 assign ((resid  56 and name HB1  ))   ( (resid  57 and name HG*  ))     5.62  3.82  0.84
 assign ((resid  50 and name HB   ))   ( (resid  54 and name HG1* ))     4.55  2.75  0.68
 assign ((resid  51 and name HD1  ))   ( (resid  54 and name HG1* ))     4.87  3.07  0.73
 assign ((resid  30 and name HA   ))   ( (resid  54 and name HG1* ))     5.79  3.99  0.87
 assign ((resid  50 and name HA   ))   ( (resid  54 and name HG2* ))     4.71  2.91  0.71
 assign ((resid  50 and name HA   ))   ( (resid  54 and name HB   ))     4.75  2.95  0.71
 assign ((resid  53 and name HE21 ))   ( (resid  54 and name HA   ))     4.36  2.56  0.65
 assign ((resid  54 and name HG2* ))   ( (resid  56 and name HN   ))     5.96  4.16  0.89
 assign ((resid  54 and name HG1* ))   ( (resid  58 and name HN   ))     5.35  3.55  0.80
 assign ((resid  56 and name HG1  ))   ( (resid  77 and name HD1* ))     4.99  3.19  0.75
 assign ((resid  52 and name HG*  ))   ( (resid  56 and name HG1  ))     4.71  2.91  0.71
 assign ((resid  52 and name HG*  ))   ( (resid  56 and name HG2  ))     4.24  2.44  0.64
 assign ((resid  52 and name HG*  ))   ( (resid  56 and name HD*  ))     4.51  2.71  0.68
 assign ((resid  56 and name HD*  ))   ( (resid  57 and name HG*  ))     6.00  4.20  0.90
 assign ((resid  57 and name HG*  ))   ( (resid  60 and name HD*  ))     6.00  4.20  0.90
 assign ((resid  52 and name HG*  ))   ( (resid  56 and name HE*  ))     3.85  2.05  0.58
 assign ((resid  59 and name HB*  ))   ( (resid  60 and name HE*  ))     4.96  3.16  0.74
 assign ((resid  56 and name HB2  ))   ( (resid  57 and name HG*  ))     3.62  1.82  0.54
 assign ((resid  56 and name HG1  ))   ( (resid  57 and name HG*  ))     4.95  3.15  0.74
 assign ((resid  56 and name HG2  ))   ( (resid  57 and name HG*  ))     5.74  3.94  0.86
 assign ((resid  57 and name HG*  ))   ( (resid  58 and name HD2* ))     4.15  2.35  0.62
 assign ((resid  54 and name HG2* ))   ( (resid  57 and name HG*  ))     4.46  2.66  0.67
 assign ((resid  56 and name HA   ))   ( (resid  57 and name HG*  ))     5.16  3.36  0.77
 assign ((resid  55 and name HA   ))   ( (resid  57 and name HG*  ))     5.20  3.40  0.78
 assign ((resid  54 and name HA   ))   ( (resid  57 and name HG*  ))     3.67  1.87  0.55
 assign ((resid  53 and name HE21 ))   ( (resid  57 and name HG*  ))     4.78  2.98  0.72
 assign ((resid  56 and name HN   ))   ( (resid  57 and name HG*  ))     4.37  2.57  0.66
 assign ((resid  57 and name HG*  ))   ( (resid  59 and name HN   ))     5.60  3.80  0.84
 assign ((resid  53 and name HE22 ))   ( (resid  57 and name HG*  ))     5.68  3.88  0.85
 assign ((resid  19 and name HN   ))   ( (resid  65 and name HD2* ))     5.29  3.49  0.79
 assign ((resid  26 and name HE21 ))   ( (resid  58 and name HD1* ))     5.73  3.93  0.86
 assign ((resid  65 and name HD2* ))   ( (resid  69 and name HZ   ))     3.21  1.41  0.48
 assign ((resid  55 and name HA   ))   ( (resid  58 and name HG   ))     4.86  3.06  0.73
 assign ((resid   6 and name HG2* ))   ( (resid  58 and name HA   ))     5.66  3.86  0.85
 assign ((resid  19 and name HB*  ))   ( (resid  65 and name HD2* ))     3.69  1.89  0.55
 assign ((resid   6 and name HG12 ))   ( (resid  59 and name HA   ))     4.57  2.77  0.69
 assign ((resid   6 and name HD1* ))   ( (resid  59 and name HA   ))     4.96  3.16  0.74
 assign ((resid   6 and name HG2* ))   ( (resid  59 and name HA   ))     5.21  3.41  0.78
 assign ((resid  57 and name HA   ))   ( (resid  60 and name HG2  ))     4.45  2.65  0.67
 assign ((resid  57 and name HA   ))   ( (resid  60 and name HG1  ))     5.14  3.34  0.77
 assign ((resid  57 and name HA   ))   ( (resid  60 and name HE*  ))     3.98  2.18  0.60
 assign ((resid  59 and name HB*  ))   ( (resid  60 and name HA   ))     4.13  2.33  0.62
 assign ((resid  62 and name HB*  ))   ( (resid  65 and name HN   ))     4.75  2.95  0.71
 assign ((resid  58 and name HA   ))   ( (resid  62 and name HB*  ))     4.92  3.12  0.74
 assign ((resid   4 and name HE*  ))   ( (resid  62 and name HB*  ))     4.74  2.94  0.71
 assign ((resid   6 and name HB   ))   ( (resid  62 and name HB*  ))     5.33  3.53  0.80
 assign ((resid  62 and name HB*  ))   ( (resid  66 and name HB*  ))     5.33  3.53  0.80
 assign ((resid  61 and name HB2  ))   ( (resid  62 and name HB*  ))     4.51  2.71  0.68
 assign ((resid  62 and name HB*  ))   ( (resid  65 and name HB2  ))     4.95  3.15  0.74
 assign ((resid  61 and name HG*  ))   ( (resid  62 and name HA   ))     5.67  3.87  0.85
 assign ((resid  62 and name HB*  ))   ( (resid  65 and name HB1  ))     5.40  3.60  0.81
 assign ((resid  59 and name HB*  ))   ( (resid  62 and name HB*  ))     4.15  2.35  0.62
 assign ((resid  63 and name HA   ))   ( (resid  75 and name HE*  ))     5.19  3.39  0.78
 assign ((resid  60 and name HA   ))   ( (resid  63 and name HG1  ))     3.92  2.12  0.59
 assign ((resid  60 and name HA   ))   ( (resid  63 and name HG2  ))     5.23  3.43  0.78
 assign ((resid  59 and name HB*  ))   ( (resid  63 and name HG1  ))     4.73  2.93  0.71
 assign ((resid  59 and name HB*  ))   ( (resid  63 and name HG2  ))     5.03  3.23  0.75
 assign ((resid  60 and name HG1  ))   ( (resid  63 and name HB2  ))     5.17  3.37  0.78
 assign ((resid  62 and name HB*  ))   ( (resid  63 and name HB2  ))     5.60  3.80  0.84
 assign ((resid  60 and name HD*  ))   ( (resid  63 and name HB2  ))     5.85  4.05  0.88
 assign ((resid  63 and name HB2  ))   ( (resid  66 and name HB*  ))     6.00  4.20  0.90
 assign ((resid  63 and name HB1  ))   ( (resid  73 and name HG1* ))     4.43  2.63  0.66
 assign ((resid  64 and name HB2  ))   ( (resid  65 and name HD2* ))     4.65  2.85  0.70
 assign ((resid  64 and name HD1  ))   ( (resid  65 and name HD2* ))     4.91  3.11  0.74
 assign ((resid  78 and name HD*  ))   ( (resid  81 and name HD1* ))     5.09  3.29  0.76
 assign ((resid  65 and name HB1  ))   ( (resid  71 and name HD1* ))     4.96  3.16  0.74
 assign ((resid  65 and name HB2  ))   ( (resid  71 and name HD1* ))     5.20  3.40  0.78
 assign ((resid  65 and name HB2  ))   ( (resid  71 and name HG11 ))     5.60  3.80  0.84
 assign ((resid  65 and name HB2  ))   ( (resid  66 and name HB*  ))     4.93  3.13  0.74
 assign ((resid  64 and name HG1  ))   ( (resid  65 and name HB1  ))     5.34  3.54  0.80
 assign ((resid  65 and name HB1  ))   ( (resid  68 and name HB1  ))     5.51  3.71  0.83
 assign ((resid  65 and name HB1  ))   ( (resid  66 and name HB*  ))     5.24  3.44  0.79
 assign ((resid  61 and name HG*  ))   ( (resid  65 and name HG   ))     5.96  4.16  0.89
 assign ((resid  62 and name HB*  ))   ( (resid  65 and name HD1* ))     4.25  2.45  0.64
 assign ((resid   6 and name HG2* ))   ( (resid  65 and name HD1* ))     5.45  3.65  0.82
 assign ((resid  65 and name HD1* ))   ( (resid  71 and name HD1* ))     5.71  3.91  0.86
 assign ((resid  23 and name HG2  ))   ( (resid  65 and name HD1* ))     3.79  1.99  0.57
 assign ((resid  58 and name HD1* ))   ( (resid  62 and name HB*  ))     4.89  3.09  0.73
 assign ((resid  64 and name HG1  ))   ( (resid  65 and name HD2* ))     3.93  2.13  0.59
 assign ((resid  22 and name HG2  ))   ( (resid  65 and name HD2* ))     3.78  1.98  0.57
 assign ((resid  23 and name HG2  ))   ( (resid  58 and name HD1* ))     5.98  4.18  0.90
 assign ((resid  23 and name HG2  ))   ( (resid  65 and name HD2* ))     6.00  4.20  0.90
 assign ((resid  19 and name HA   ))   ( (resid  65 and name HB2  ))     4.83  3.03  0.72
 assign ((resid  19 and name HA   ))   ( (resid  65 and name HG   ))     5.21  3.41  0.78
 assign ((resid  62 and name HA   ))   ( (resid  65 and name HG   ))     4.54  2.74  0.68
 assign ((resid  62 and name HA   ))   ( (resid  65 and name HD1* ))     3.52  1.72  0.53
 assign ((resid  19 and name HA   ))   ( (resid  65 and name HD2* ))     3.41  1.61  0.51
 assign ((resid  65 and name HA   ))   ( (resid  69 and name HD*  ))     4.42  2.62  0.66
 assign ((resid  65 and name HB1  ))   ( (resid  69 and name HE*  ))     4.32  2.52  0.65
 assign ((resid   8 and name HZ   ))   ( (resid  65 and name HB1  ))     4.38  2.58  0.66
 assign ((resid  64 and name HN   ))   ( (resid  65 and name HB2  ))     5.33  3.53  0.80
 assign ((resid  64 and name HN   ))   ( (resid  65 and name HG   ))     5.30  3.50  0.80
 assign ((resid  65 and name HG   ))   ( (resid  69 and name HD*  ))     5.57  3.77  0.84
 assign ((resid  20 and name HN   ))   ( (resid  65 and name HD1* ))     4.75  2.95  0.71
 assign ((resid  65 and name HD1* ))   ( (resid  69 and name HE*  ))     3.74  1.94  0.56
 assign ((resid   8 and name HD*  ))   ( (resid  65 and name HD1* ))     4.81  3.01  0.72
 assign ((resid  65 and name HN   ))   ( (resid  66 and name HA   ))     5.86  4.06  0.88
 assign ((resid  66 and name HA   ))   ( (resid  72 and name HN   ))     6.00  4.20  0.90
 assign ((resid  66 and name HB*  ))   ( (resid  71 and name HN   ))     3.70  1.90  0.56
 assign ((resid  65 and name HN   ))   ( (resid  66 and name HB*  ))     4.56  2.76  0.68
 assign ((resid   8 and name HE*  ))   ( (resid  66 and name HB*  ))     3.30  1.50  0.50
 assign ((resid   8 and name HD*  ))   ( (resid  66 and name HB*  ))     4.02  2.22  0.60
 assign ((resid   8 and name HE*  ))   ( (resid  66 and name HA   ))     4.34  2.54  0.65
 assign ((resid  66 and name HB*  ))   ( (resid  73 and name HA   ))     4.23  2.43  0.63
 assign ((resid  66 and name HB*  ))   ( (resid  71 and name HA   ))     5.09  3.29  0.76
 assign ((resid  66 and name HB*  ))   ( (resid  72 and name HA   ))     3.56  1.76  0.53
 assign ((resid  66 and name HB*  ))   ( (resid  70 and name HA   ))     4.99  3.19  0.75
 assign ((resid  65 and name HA   ))   ( (resid  66 and name HB*  ))     5.32  3.52  0.80
 assign ((resid  66 and name HA   ))   ( (resid  71 and name HG11 ))     3.38  1.58  0.51
 assign ((resid  66 and name HA   ))   ( (resid  71 and name HG12 ))     3.37  1.57  0.51
 assign ((resid  66 and name HA   ))   ( (resid  71 and name HG2* ))     4.49  2.69  0.67
 assign ((resid  66 and name HA   ))   ( (resid  73 and name HG1* ))     4.94  3.14  0.74
 assign ((resid  66 and name HA   ))   ( (resid  73 and name HG2* ))     5.69  3.89  0.85
 assign ((resid  66 and name HB*  ))   ( (resid  73 and name HB   ))     2.86  1.06  0.43
 assign ((resid  66 and name HB*  ))   ( (resid  67 and name HB*  ))     3.71  1.91  0.56
 assign ((resid  63 and name HB1  ))   ( (resid  66 and name HB*  ))     4.93  3.13  0.74
 assign ((resid  66 and name HB*  ))   ( (resid  71 and name HB   ))     4.55  2.75  0.68
 assign ((resid  63 and name HG1  ))   ( (resid  66 and name HB*  ))     5.54  3.74  0.83
 assign ((resid  66 and name HB*  ))   ( (resid  71 and name HG11 ))     3.32  1.52  0.50
 assign ((resid  66 and name HB*  ))   ( (resid  71 and name HG12 ))     3.94  2.14  0.59
 assign ((resid  66 and name HB*  ))   ( (resid  71 and name HG2* ))     5.00  3.20  0.75
 assign ((resid  66 and name HB*  ))   ( (resid  73 and name HG1* ))     2.75  0.95  0.41
 assign ((resid  66 and name HB*  ))   ( (resid  71 and name HD1* ))     4.13  2.33  0.62
 assign ((resid  66 and name HA   ))   ( (resid  71 and name HB   ))     4.44  2.64  0.67
 assign ((resid  66 and name HA   ))   ( (resid  68 and name HB1  ))     5.51  3.71  0.83
 assign ((resid  67 and name HA   ))   ( (resid  68 and name HA   ))     4.82  3.02  0.72
 assign ((resid  67 and name HG2  ))   ( (resid  68 and name HA   ))     4.97  3.17  0.75
 assign ((resid  67 and name HG1  ))   ( (resid  68 and name HA   ))     5.19  3.39  0.78
 assign ((resid  64 and name HA   ))   ( (resid  67 and name HG1  ))     4.53  2.73  0.68
 assign ((resid  67 and name HA   ))   ( (resid  71 and name HN   ))     4.81  3.01  0.72
 assign ((resid  67 and name HB*  ))   ( (resid  71 and name HN   ))     5.69  3.89  0.85
 assign ((resid  67 and name HN   ))   ( (resid  68 and name HA   ))     5.16  3.36  0.77
 assign ((resid  68 and name HA   ))   ( (resid  69 and name HD*  ))     5.59  3.79  0.84
 assign ((resid  64 and name HE   ))   ( (resid  68 and name HB2  ))     5.22  3.42  0.78
 assign ((resid  67 and name HN   ))   ( (resid  68 and name HB2  ))     5.70  3.90  0.86
 assign ((resid  68 and name HB2  ))   ( (resid  69 and name HD*  ))     5.33  3.53  0.80
 assign ((resid  68 and name HG2  ))   ( (resid  69 and name HZ   ))     4.06  2.26  0.61
 assign ((resid  68 and name HG1  ))   ( (resid  69 and name HD*  ))     3.94  2.14  0.59
 assign ((resid  65 and name HN   ))   ( (resid  68 and name HB2  ))     5.39  3.59  0.81
 assign ((resid  65 and name HN   ))   ( (resid  68 and name HB1  ))     4.93  3.13  0.74
 assign ((resid  64 and name HE   ))   ( (resid  68 and name HG2  ))     5.83  4.03  0.87
 assign ((resid  68 and name HA   ))   ( (resid  69 and name HA   ))     4.74  2.94  0.71
 assign ((resid  68 and name HB2  ))   ( (resid  69 and name HA   ))     5.93  4.13  0.89
 assign ((resid  68 and name HB1  ))   ( (resid  69 and name HA   ))     4.72  2.92  0.71
 assign ((resid  65 and name HA   ))   ( (resid  68 and name HG2  ))     4.28  2.48  0.64
 assign ((resid  68 and name HG2  ))   ( (resid  69 and name HA   ))     5.18  3.38  0.78
 assign ((resid  65 and name HA   ))   ( (resid  68 and name HG1  ))     4.59  2.79  0.69
 assign ((resid  68 and name HG1  ))   ( (resid  69 and name HA   ))     4.58  2.78  0.69
 assign ((resid  65 and name HD2* ))   ( (resid  68 and name HA   ))     5.77  3.97  0.87
 assign ((resid  65 and name HD2* ))   ( (resid  68 and name HB2  ))     4.20  2.40  0.63
 assign ((resid  65 and name HD2* ))   ( (resid  68 and name HB1  ))     4.10  2.30  0.62
 assign ((resid  65 and name HD2* ))   ( (resid  68 and name HG2  ))     4.51  2.71  0.68
 assign ((resid  65 and name HD2* ))   ( (resid  68 and name HG1  ))     4.90  3.10  0.74
 assign ((resid  15 and name HB*  ))   ( (resid  69 and name HB2  ))     3.66  1.86  0.55
 assign ((resid  68 and name HB1  ))   ( (resid  69 and name HB2  ))     5.05  3.25  0.76
 assign ((resid  69 and name HB2  ))   ( (resid  71 and name HG12 ))     4.33  2.53  0.65
 assign ((resid  69 and name HB2  ))   ( (resid  71 and name HG2* ))     4.13  2.33  0.62
 assign ((resid  15 and name HB*  ))   ( (resid  69 and name HB1  ))     3.51  1.71  0.53
 assign ((resid  69 and name HB1  ))   ( (resid  71 and name HG12 ))     4.39  2.59  0.66
 assign ((resid  68 and name HN   ))   ( (resid  69 and name HB2  ))     5.00  3.20  0.75
 assign ((resid  15 and name HB*  ))   ( (resid  70 and name HB1  ))     5.36  3.56  0.80
 assign ((resid  69 and name HA   ))   ( (resid  70 and name HB2  ))     4.45  2.65  0.67
 assign ((resid  70 and name HB2  ))   ( (resid  71 and name HA   ))     5.83  4.03  0.87
 assign ((resid  69 and name HA   ))   ( (resid  70 and name HB1  ))     4.89  3.09  0.73
 assign ((resid  70 and name HB1  ))   ( (resid  71 and name HA   ))     5.01  3.21  0.75
 assign ((resid   8 and name HD*  ))   ( (resid  71 and name HG2* ))     4.69  2.89  0.70
 assign ((resid  69 and name HD*  ))   ( (resid  71 and name HG2* ))     5.01  3.21  0.75
 assign ((resid  69 and name HB2  ))   ( (resid  71 and name HG11 ))     4.95  3.15  0.74
 assign ((resid  72 and name HB   ))   ( (resid  73 and name HG1* ))     5.25  3.45  0.79
 assign ((resid  66 and name HB*  ))   ( (resid  72 and name HG2* ))     4.49  2.69  0.67
 assign ((resid  71 and name HB   ))   ( (resid  72 and name HG2* ))     5.28  3.48  0.79
 assign ((resid   9 and name HD*  ))   ( (resid  72 and name HG2* ))     4.78  2.98  0.72
 assign ((resid  71 and name HB   ))   ( (resid  72 and name HB   ))     5.51  3.71  0.83
 assign ((resid   9 and name HD*  ))   ( (resid  72 and name HB   ))     4.82  3.02  0.72
 assign ((resid  72 and name HG2* ))   ( (resid  73 and name HA   ))     5.26  3.46  0.79
 assign ((resid   9 and name HN   ))   ( (resid  72 and name HB   ))     3.93  2.13  0.59
 assign ((resid   8 and name HZ   ))   ( (resid  73 and name HB   ))     4.09  2.29  0.61
 assign ((resid   9 and name HN   ))   ( (resid  73 and name HG1* ))     5.75  3.95  0.86
 assign ((resid   7 and name HA   ))   ( (resid  73 and name HG2* ))     4.84  3.04  0.73
 assign ((resid   8 and name HB*  ))   ( (resid  73 and name HB   ))     5.48  3.68  0.82
 assign ((resid  73 and name HG1* ))   ( (resid  74 and name HA   ))     4.33  2.53  0.65
 assign ((resid  73 and name HG1* ))   ( (resid  74 and name HG2* ))     4.87  3.07  0.73
 assign ((resid  74 and name HG2* ))   ( (resid  75 and name HB1  ))     5.49  3.69  0.82
 assign ((resid   7 and name HD2  ))   ( (resid  74 and name HG2* ))     4.23  2.43  0.63
 assign ((resid  74 and name HB   ))   ( (resid  75 and name HA   ))     5.83  4.03  0.87
 assign ((resid   6 and name HG2* ))   ( (resid  75 and name HB2  ))     4.45  2.65  0.67
 assign ((resid   7 and name HN   ))   ( (resid  75 and name HB2  ))     5.90  4.10  0.89
 assign ((resid  76 and name HB   ))   ( (resid  77 and name HG2* ))     4.82  3.02  0.72
 assign ((resid  76 and name HB   ))   ( (resid  77 and name HG12 ))     5.24  3.44  0.79
 assign ((resid   4 and name HB2  ))   ( (resid  76 and name HB   ))     6.00  4.20  0.90
 assign ((resid  35 and name HG2* ))   ( (resid  36 and name HD*  ))     4.75  2.95  0.71
 assign ((resid  76 and name HG2* ))   ( (resid  78 and name HE   ))     4.81  3.01  0.72
 assign ((resid  58 and name HN   ))   ( (resid  77 and name HD1* ))     5.68  3.88  0.85
 assign ((resid   4 and name HA   ))   ( (resid  77 and name HG12 ))     5.46  3.66  0.82
 assign ((resid  55 and name HA   ))   ( (resid  77 and name HD1* ))     5.11  3.31  0.77
 assign ((resid  55 and name HB1  ))   ( (resid  77 and name HD1* ))     3.50  1.70  0.53
 assign ((resid   4 and name HG*  ))   ( (resid  77 and name HG2* ))     4.29  2.49  0.64
 assign ((resid   4 and name HG*  ))   ( (resid  77 and name HG12 ))     4.24  2.44  0.64
 assign ((resid  77 and name HG11 ))   ( (resid  78 and name HA   ))     4.90  3.10  0.74
 assign ((resid  79 and name HA1  ))   ( (resid  81 and name HN   ))     4.64  2.84  0.70
 assign ((resid  79 and name HA1  ))   ( (resid  81 and name HG   ))     5.24  3.44  0.79
 assign ((resid  79 and name HA2  ))   ( (resid  81 and name HG   ))     5.24  3.44  0.79
 assign ((resid  80 and name HB*  ))   ( (resid  81 and name HG   ))     5.24  3.44  0.79
 assign ((resid  80 and name HB*  ))   ( (resid  81 and name HD1* ))     6.00  4.20  0.90
 assign ((resid  80 and name HA   ))   ( (resid  81 and name HN   ))     3.27  1.47  0.49
 assign ((resid  81 and name HN   ))   ( (resid  81 and name HB1  ))     3.76  1.96  0.56
 assign ((resid  81 and name HN   ))   ( (resid  81 and name HD1* ))     4.70  2.90  0.70
 assign ((resid  81 and name HN   ))   ( (resid  81 and name HD2* ))     4.88  3.08  0.73
 assign ((resid  81 and name HD1* ))   ( (resid  82 and name HA   ))     5.85  4.05  0.88
 assign ((resid  25 and name HA   ))   ( (resid  28 and name HG2  ))     4.64  2.84  0.70
 assign ((resid  27 and name HB*  ))   ( (resid  28 and name HG2  ))     4.48  2.68  0.67
 assign ((resid  28 and name HG2  ))   ( (resid  34 and name HG1* ))     4.15  2.35  0.62
 assign ((resid  28 and name HG2  ))   ( (resid  34 and name HG2* ))     4.90  3.10  0.74
 assign ((resid  23 and name HE*  ))   ( (resid  27 and name HN   ))     4.96  3.16  0.74
 assign ((resid  11 and name HA   ))   ( (resid  41 and name HB2  ))     4.80  3.00  0.72
 assign ((resid  11 and name HA   ))   ( (resid  41 and name HB1  ))     4.23  2.43  0.63
 assign ((resid  53 and name HN   ))   ( (resid  55 and name HB2  ))     5.17  3.37  0.78
 assign ((resid  52 and name HN   ))   ( (resid  55 and name HB2  ))     5.81  4.01  0.87
 assign ((resid  52 and name HG*  ))   ( (resid  56 and name HN   ))     5.09  3.29  0.76
 assign ((resid  48 and name HN   ))   ( (resid  50 and name HG2* ))     4.54  2.74  0.68
 assign ((resid  14 and name HB1  ))   ( (resid  18 and name HD2  ))     5.36  3.56  0.80
 assign ((resid  14 and name HB2  ))   ( (resid  18 and name HD1  ))     5.66  3.86  0.85
 assign ((resid  23 and name HE*  ))   ( (resid  26 and name HG2  ))     4.00  2.20  0.60
 assign ((resid  24 and name HG2* ))   ( (resid  28 and name HG2  ))     3.38  1.58  0.51
 assign ((resid  24 and name HG2* ))   ( (resid  28 and name HG*  ))     3.40  1.60  0.51
 assign ((resid  27 and name HA   ))   ( (resid  50 and name HG1* ))     5.29  3.49  0.79
 assign ((resid  24 and name HG2* ))   ( (resid  28 and name HG1  ))     3.36  1.56  0.50
 assign ((resid  38 and name HB2  ))   ( (resid  39 and name HN   ))     5.27  3.47  0.79
 assign ((resid  38 and name HA   ))   ( (resid  42 and name HN   ))     6.00  4.20  0.90
 assign ((resid  36 and name HD*  ))   ( (resid  38 and name HD1* ))     4.07  2.27  0.61
 assign ((resid  36 and name HE*  ))   ( (resid  38 and name HD2* ))     4.19  2.39  0.63
 assign ((resid  17 and name HN   ))   ( (resid  38 and name HD1* ))     4.95  3.15  0.74
 assign ((resid  38 and name HD1* ))   ( (resid  39 and name HN   ))     5.30  3.50  0.80
 assign ((resid  38 and name HD2* ))   ( (resid  42 and name HN   ))     6.00  4.20  0.90
 assign ((resid  17 and name HN   ))   ( (resid  38 and name HD2* ))     5.48  3.68  0.82
 assign ((resid  37 and name HN   ))   ( (resid  38 and name HD2* ))     4.43  2.63  0.66
 assign ((resid  38 and name HD2* ))   ( (resid  39 and name HN   ))     4.84  3.04  0.73
 assign ((resid  38 and name HD2* ))   ( (resid  43 and name HN   ))     5.33  3.53  0.80
 assign ((resid  38 and name HD2* ))   ( (resid  43 and name HA   ))     3.72  1.92  0.56
 assign ((resid  38 and name HD1* ))   ( (resid  43 and name HA   ))     5.68  3.88  0.85
 assign ((resid  16 and name HB2  ))   ( (resid  38 and name HD2* ))     4.14  2.34  0.62
 assign ((resid  36 and name HB2  ))   ( (resid  38 and name HD2* ))     4.69  2.89  0.70
 assign ((resid  17 and name HA   ))   ( (resid  38 and name HD2* ))     4.55  2.75  0.68
 assign ((resid  17 and name HG2  ))   ( (resid  38 and name HD1* ))     3.96  2.16  0.59
 assign ((resid  36 and name HB2  ))   ( (resid  38 and name HD1* ))     5.20  3.40  0.78
 assign ((resid  20 and name HD2* ))   ( (resid  38 and name HD1* ))     5.33  3.53  0.80
 assign ((resid  20 and name HD1* ))   ( (resid  38 and name HD1* ))     5.33  3.53  0.80
 assign ((resid  17 and name HA   ))   ( (resid  38 and name HD1* ))     4.62  2.82  0.69
 assign ((resid   4 and name HB1  ))   ( (resid  77 and name HG2* ))     4.20  2.40  0.63
 assign ((resid   4 and name HE*  ))   ( (resid  55 and name HG2  ))     4.80  3.00  0.72
 assign ((resid   4 and name HE*  ))   ( (resid  59 and name HB*  ))     3.12  1.32  0.47
 assign ((resid  44 and name HA   ))   ( (resid  46 and name HG*  ))     5.41  3.61  0.81
 assign ((resid   7 and name HG2  ))   ( (resid  44 and name HA   ))     4.73  2.93  0.71
 assign ((resid  16 and name HB2  ))   ( (resid  43 and name HD2* ))     4.13  2.33  0.62
 assign ((resid  16 and name HB2  ))   ( (resid  43 and name HD1* ))     5.42  3.62  0.81
 assign ((resid  43 and name HD1* ))   ( (resid  44 and name HB1  ))     5.84  4.04  0.88
 assign ((resid  32 and name HA1  ))   ( (resid  49 and name HA1  ))     5.18  3.38  0.78
 assign ((resid  50 and name HG1* ))   ( (resid  55 and name HA   ))     5.45  3.65  0.82
 assign ((resid  53 and name HE21 ))   ( (resid  54 and name HG2* ))     3.82  2.02  0.57
 assign ((resid  53 and name HE21 ))   ( (resid  54 and name HB   ))     4.62  2.82  0.69
 assign ((resid  53 and name HE22 ))   ( (resid  54 and name HG2* ))     5.09  3.29  0.76
 assign ((resid  58 and name HA   ))   ( (resid  61 and name HG*  ))     3.96  2.16  0.59
 assign ((resid   6 and name HD1* ))   ( (resid  58 and name HB1  ))     4.07  2.27  0.61
 assign ((resid   6 and name HD1* ))   ( (resid  58 and name HB2  ))     3.58  1.78  0.54
 assign ((resid  58 and name HD1* ))   ( (resid  61 and name HG*  ))     3.57  1.77  0.54
 assign ((resid  61 and name HA   ))   ( (resid  64 and name HD2  ))     5.06  3.26  0.76
 assign ((resid  61 and name HA   ))   ( (resid  64 and name HD1  ))     4.83  3.03  0.72
 assign ((resid  15 and name HA   ))   ( (resid  69 and name HB2  ))     4.44  2.64  0.67
 assign ((resid  15 and name HA   ))   ( (resid  69 and name HB1  ))     3.64  1.84  0.55
 assign ((resid  43 and name HD2* ))   ( (resid  71 and name HD1* ))     4.14  2.34  0.62
 assign ((resid  16 and name HG   ))   ( (resid  71 and name HG2* ))     4.25  2.45  0.64
 assign ((resid   8 and name HB*  ))   ( (resid  71 and name HG2* ))     4.70  2.90  0.70
 assign ((resid   4 and name HA   ))   ( (resid  77 and name HG2* ))     3.91  2.11  0.59
 assign ((resid   4 and name HE*  ))   ( (resid  77 and name HG2* ))     3.59  1.79  0.54
 assign ((resid  16 and name HD1* ))   ( (resid  71 and name HD1* ))     4.87  3.07  0.73
 assign ((resid   8 and name HA   ))   ( (resid   8 and name HD*  ))     3.84  2.04  0.58
 assign ((resid   8 and name HD*  ))   ( (resid   8 and name HZ   ))     3.83  2.03  0.57
 assign ((resid  30 and name HA   ))   ( (resid  30 and name HD*  ))     3.19  1.39  0.48
 assign ((resid  30 and name HE*  ))   ( (resid  30 and name HZ   ))     2.40  0.60  0.36
 assign ((resid  36 and name HA   ))   ( (resid  36 and name HD*  ))     4.00  2.20  0.60
 assign ((resid  75 and name HA   ))   ( (resid  75 and name HD*  ))     4.09  2.29  0.61
 assign ((resid  36 and name HD*  ))   ( (resid  37 and name HN   ))     4.04  2.24  0.61
 assign ((resid  30 and name HD*  ))   ( (resid  57 and name HG*  ))     5.88  4.08  0.88
 assign ((resid  26 and name HA   ))   ( (resid  30 and name HE*  ))     4.62  2.82  0.69
 assign ((resid  29 and name HE*  ))   ( (resid  30 and name HZ   ))     5.26  3.46  0.79
 assign ((resid  65 and name HB2  ))   ( (resid  69 and name HD*  ))     4.31  2.51  0.65
 assign ((resid   8 and name HD*  ))   ( (resid  20 and name HN   ))     5.19  3.39  0.78
 assign ((resid   8 and name HE*  ))   ( (resid  62 and name HA   ))     3.94  2.14  0.59
 assign ((resid   8 and name HZ   ))   ( (resid  62 and name HA   ))     3.31  1.51  0.50
 assign ((resid   7 and name HA   ))   ( (resid   8 and name HD*  ))     4.78  2.98  0.72
 assign ((resid   8 and name HE*  ))   ( (resid  65 and name HB2  ))     4.16  2.36  0.62
 assign ((resid   8 and name HD*  ))   ( (resid  43 and name HB2  ))     5.33  3.53  0.80
 assign ((resid   8 and name HD*  ))   ( (resid  43 and name HG   ))     3.51  1.71  0.53
 assign ((resid   8 and name HD*  ))   ( (resid  71 and name HG11 ))     3.80  2.00  0.57
 assign ((resid   8 and name HD*  ))   ( (resid  71 and name HG12 ))     4.16  2.36  0.62
 assign ((resid   8 and name HD*  ))   ( (resid  43 and name HD2* ))     3.35  1.55  0.50
 assign ((resid   8 and name HD*  ))   ( (resid  16 and name HD2* ))     4.00  2.20  0.60
 assign ((resid   8 and name HD*  ))   ( (resid  19 and name HB*  ))     4.10  2.30  0.62
 assign ((resid   8 and name HD*  ))   ( (resid  71 and name HD1* ))     3.31  1.51  0.50
 assign ((resid   8 and name HD*  ))   ( (resid  73 and name HG2* ))     3.89  2.09  0.58
 assign ((resid   8 and name HE*  ))   ( (resid  73 and name HB   ))     3.79  1.99  0.57
 assign ((resid   8 and name HE*  ))   ( (resid  62 and name HB*  ))     3.53  1.73  0.53
 assign ((resid   8 and name HE*  ))   ( (resid  65 and name HB1  ))     4.25  2.45  0.64
 assign ((resid   8 and name HE*  ))   ( (resid  71 and name HG12 ))     4.72  2.92  0.71
 assign ((resid   8 and name HE*  ))   ( (resid  45 and name HD1* ))     3.31  1.51  0.50
 assign ((resid   8 and name HE*  ))   ( (resid  43 and name HD2* ))     4.05  2.25  0.61
 assign ((resid   8 and name HE*  ))   ( (resid  73 and name HG1* ))     3.96  2.16  0.59
 assign ((resid   8 and name HE*  ))   ( (resid  19 and name HB*  ))     3.97  2.17  0.60
 assign ((resid   8 and name HE*  ))   ( (resid  71 and name HD1* ))     3.82  2.02  0.57
 assign ((resid   8 and name HE*  ))   ( (resid  73 and name HG2* ))     3.68  1.88  0.55
 assign ((resid   8 and name HZ   ))   ( (resid  63 and name HA   ))     5.66  3.86  0.85
 assign ((resid   8 and name HZ   ))   ( (resid  23 and name HG2  ))     4.61  2.81  0.69
 assign ((resid   8 and name HZ   ))   ( (resid  23 and name HG1  ))     4.56  2.76  0.68
 assign ((resid   8 and name HZ   ))   ( (resid  65 and name HB2  ))     4.28  2.48  0.64
 assign ((resid   8 and name HZ   ))   ( (resid  65 and name HG   ))     4.27  2.47  0.64
 assign ((resid   8 and name HZ   ))   ( (resid  66 and name HB*  ))     4.32  2.52  0.65
 assign ((resid   8 and name HZ   ))   ( (resid  65 and name HD1* ))     3.68  1.88  0.55
 assign ((resid   8 and name HZ   ))   ( (resid  73 and name HG1* ))     4.34  2.54  0.65
 assign ((resid   8 and name HZ   ))   ( (resid  19 and name HB*  ))     4.12  2.32  0.62
 assign ((resid   6 and name HG2* ))   ( (resid   8 and name HZ   ))     3.87  2.07  0.58
 assign ((resid  26 and name HG1  ))   ( (resid  30 and name HE*  ))     4.83  3.03  0.72
 assign ((resid  30 and name HE*  ))   ( (resid  57 and name HG*  ))     5.16  3.36  0.77
 assign ((resid  26 and name HB1  ))   ( (resid  30 and name HE*  ))     4.20  2.40  0.63
 assign ((resid  29 and name HB*  ))   ( (resid  30 and name HE*  ))     4.82  3.02  0.72
 assign ((resid  26 and name HB1  ))   ( (resid  30 and name HD*  ))     4.32  2.52  0.65
 assign ((resid  29 and name HB*  ))   ( (resid  30 and name HD*  ))     4.35  2.55  0.65
 assign ((resid  30 and name HD*  ))   ( (resid  58 and name HD1* ))     4.39  2.59  0.66
 assign ((resid  30 and name HD*  ))   ( (resid  54 and name HG2* ))     3.46  1.66  0.52
 assign ((resid  27 and name HA   ))   ( (resid  30 and name HD*  ))     3.93  2.13  0.59
 assign ((resid  30 and name HZ   ))   ( (resid  57 and name HG*  ))     4.39  2.59  0.66
 assign ((resid  26 and name HB1  ))   ( (resid  30 and name HZ   ))     4.89  3.09  0.73
 assign ((resid  30 and name HZ   ))   ( (resid  57 and name HB2  ))     5.55  3.75  0.83
 assign ((resid  30 and name HZ   ))   ( (resid  58 and name HD1* ))     4.49  2.69  0.67
 assign ((resid  30 and name HZ   ))   ( (resid  58 and name HD2* ))     4.66  2.86  0.70
 assign ((resid  30 and name HD*  ))   ( (resid  54 and name HG1* ))     3.64  1.84  0.55
 assign ((resid  30 and name HE*  ))   ( (resid  54 and name HG1* ))     4.33  2.53  0.65
 assign ((resid  30 and name HN   ))   ( (resid  30 and name HE*  ))     4.91  3.11  0.74
 assign ((resid  36 and name HA   ))   ( (resid  36 and name HE*  ))     5.78  3.98  0.87
 assign ((resid  35 and name HA   ))   ( (resid  36 and name HD*  ))     4.11  2.31  0.62
 assign ((resid  36 and name HE*  ))   ( (resid  38 and name HG   ))     3.72  1.92  0.56
 assign ((resid  36 and name HE*  ))   ( (resid  38 and name HB2  ))     4.55  2.75  0.68
 assign ((resid  36 and name HD*  ))   ( (resid  38 and name HG   ))     4.16  2.36  0.62
 assign ((resid  36 and name HD*  ))   ( (resid  38 and name HB2  ))     4.73  2.93  0.71
 assign ((resid  36 and name HD*  ))   ( (resid  43 and name HB2  ))     5.96  4.16  0.89
 assign ((resid  35 and name HG2* ))   ( (resid  36 and name HE*  ))     5.48  3.68  0.82
 assign ((resid  36 and name HD*  ))   ( (resid  43 and name HD1* ))     3.13  1.33  0.47
 assign ((resid  36 and name HD*  ))   ( (resid  38 and name HD2* ))     3.14  1.34  0.47
 assign ((resid  24 and name HD1* ))   ( (resid  36 and name HD*  ))     4.12  2.32  0.62
 assign ((resid  20 and name HD1* ))   ( (resid  36 and name HD*  ))     3.84  2.04  0.58
 assign ((resid  20 and name HD2* ))   ( (resid  36 and name HD*  ))     3.84  2.04  0.58
 assign ((resid  36 and name HE*  ))   ( (resid  38 and name HD1* ))     3.06  1.26  0.46
 assign ((resid  24 and name HD1* ))   ( (resid  36 and name HE*  ))     3.67  1.87  0.55
 assign ((resid  20 and name HD1* ))   ( (resid  36 and name HE*  ))     4.38  2.58  0.66
 assign ((resid  20 and name HD2* ))   ( (resid  36 and name HE*  ))     4.38  2.58  0.66
 assign ((resid  68 and name HG2  ))   ( (resid  69 and name HD*  ))     4.40  2.60  0.66
 assign ((resid  68 and name HB1  ))   ( (resid  69 and name HD*  ))     3.82  2.02  0.57
 assign ((resid  15 and name HB*  ))   ( (resid  69 and name HD*  ))     3.73  1.93  0.56
 assign ((resid  18 and name HB1  ))   ( (resid  69 and name HD*  ))     4.17  2.37  0.63
 assign ((resid  65 and name HB1  ))   ( (resid  69 and name HD*  ))     3.92  2.12  0.59
 assign ((resid  65 and name HD1* ))   ( (resid  69 and name HD*  ))     4.27  2.47  0.64
 assign ((resid  65 and name HD2* ))   ( (resid  69 and name HD*  ))     3.56  1.76  0.53
 assign ((resid  19 and name HA   ))   ( (resid  69 and name HD*  ))     4.37  2.57  0.66
 assign ((resid   8 and name HE*  ))   ( (resid  72 and name HN   ))     6.00  4.20  0.90
 assign ((resid   8 and name HE*  ))   ( (resid  74 and name HN   ))     6.00  4.20  0.90
 assign ((resid  21 and name HE*  ))   ( (resid  69 and name HZ   ))     4.91  3.11  0.74
 assign ((resid  22 and name HG2  ))   ( (resid  69 and name HZ   ))     4.71  2.91  0.71
 assign ((resid  68 and name HB1  ))   ( (resid  69 and name HZ   ))     5.88  4.08  0.88
 assign ((resid  18 and name HB1  ))   ( (resid  69 and name HZ   ))     3.92  2.12  0.59
 assign ((resid  18 and name HB2  ))   ( (resid  69 and name HZ   ))     4.01  2.21  0.60
 assign ((resid  19 and name HB*  ))   ( (resid  69 and name HZ   ))     4.77  2.97  0.72
 assign ((resid  69 and name HZ   ))   ( (resid  71 and name HD1* ))     5.71  3.91  0.86
 assign ((resid  66 and name HA   ))   ( (resid  69 and name HE*  ))     5.95  4.15  0.89
 assign ((resid  21 and name HE*  ))   ( (resid  69 and name HE*  ))     5.51  3.71  0.83
 assign ((resid  65 and name HB2  ))   ( (resid  69 and name HE*  ))     4.29  2.49  0.64
 assign ((resid  68 and name HG2  ))   ( (resid  69 and name HE*  ))     4.17  2.37  0.63
 assign ((resid  63 and name HG2  ))   ( (resid  75 and name HD*  ))     4.79  2.99  0.72
 assign ((resid   4 and name HG*  ))   ( (resid  75 and name HD*  ))     4.87  3.07  0.73
 assign ((resid   4 and name HE*  ))   ( (resid  75 and name HD*  ))     3.70  1.90  0.56
 assign ((resid  75 and name HD*  ))   ( (resid  77 and name HG12 ))     3.77  1.97  0.57
 assign ((resid  62 and name HB*  ))   ( (resid  75 and name HD*  ))     3.93  2.13  0.59
 assign ((resid  75 and name HD*  ))   ( (resid  76 and name HG2* ))     5.52  3.72  0.83
 assign ((resid  59 and name HB*  ))   ( (resid  75 and name HD*  ))     3.61  1.81  0.54
 assign ((resid  73 and name HG1* ))   ( (resid  75 and name HD*  ))     3.76  1.96  0.56
 assign ((resid   6 and name HG2* ))   ( (resid  75 and name HD*  ))     3.76  1.96  0.56
 assign ((resid  73 and name HG2* ))   ( (resid  75 and name HD*  ))     3.32  1.52  0.50
 assign ((resid   7 and name HN   ))   ( (resid  75 and name HD*  ))     5.54  3.74  0.83
 assign ((resid  59 and name HA   ))   ( (resid  75 and name HE*  ))     5.19  3.39  0.78
 assign ((resid  75 and name HD*  ))   ( (resid  76 and name HA   ))     4.22  2.42  0.63
 assign ((resid  74 and name HA   ))   ( (resid  75 and name HD*  ))     4.30  2.50  0.65
 assign ((resid  63 and name HA   ))   ( (resid  75 and name HD*  ))     6.00  4.20  0.90
 assign ((resid  75 and name HD*  ))   ( (resid  76 and name HB   ))     6.00  4.20  0.90
 assign ((resid  63 and name HG1  ))   ( (resid  75 and name HE*  ))     3.53  1.73  0.53
 assign ((resid  63 and name HG2  ))   ( (resid  75 and name HE*  ))     3.68  1.88  0.55
 assign ((resid   4 and name HE*  ))   ( (resid  75 and name HE*  ))     4.41  2.61  0.66
 assign ((resid  75 and name HE*  ))   ( (resid  77 and name HG12 ))     4.22  2.42  0.63
 assign ((resid  62 and name HB*  ))   ( (resid  75 and name HE*  ))     4.26  2.46  0.64
 assign ((resid  59 and name HB*  ))   ( (resid  75 and name HE*  ))     3.17  1.37  0.48
 assign ((resid  75 and name HE*  ))   ( (resid  77 and name HD1* ))     3.48  1.68  0.52
 assign ((resid  73 and name HG1* ))   ( (resid  75 and name HE*  ))     3.46  1.66  0.52
 assign ((resid   6 and name HG2* ))   ( (resid  75 and name HE*  ))     5.25  3.45  0.79
 assign ((resid  73 and name HG2* ))   ( (resid  75 and name HE*  ))     4.07  2.27  0.61
 assign ((resid   8 and name HD*  ))   ( (resid  66 and name HA   ))     6.00  4.20  0.90
 assign ((resid   1 and name HN   ))   ( (resid   1 and name HG*  ))     4.30  2.50  0.65
 assign ((resid   3 and name HN   ))   ( (resid   3 and name HB*  ))     3.68  1.88  0.55
 assign ((resid   3 and name HB*  ))   ( (resid   4 and name HN   ))     3.61  1.81  0.54
 assign ((resid   3 and name HB*  ))   ( (resid  48 and name HB   ))     5.57  3.77  0.84
 assign ((resid   3 and name HB*  ))   ( (resid  48 and name HG2* ))     3.91  2.11  0.59
 assign ((resid   4 and name HB2  ))   ( (resid  55 and name HD*  ))     5.29  3.49  0.79
 assign ((resid   4 and name HB1  ))   ( (resid  55 and name HD*  ))     4.17  2.37  0.63
 assign ((resid   5 and name HB*  ))   ( (resid   6 and name HG11 ))     5.29  3.49  0.79
 assign ((resid   5 and name HB*  ))   ( (resid  47 and name HN   ))     5.40  3.60  0.81
 assign ((resid   5 and name HB*  ))   ( (resid  76 and name HN   ))     4.35  2.55  0.65
 assign ((resid   5 and name HB*  ))   ( (resid  76 and name HB   ))     4.66  2.86  0.70
 assign ((resid   6 and name HA   ))   ( (resid   7 and name HB*  ))     5.65  3.85  0.85
 assign ((resid   7 and name HN   ))   ( (resid   7 and name HG*  ))     4.28  2.48  0.64
 assign ((resid   7 and name HN   ))   ( (resid   7 and name HD*  ))     5.04  3.24  0.76
 assign ((resid   7 and name HN   ))   ( (resid  44 and name HG*  ))     5.53  3.73  0.83
 assign ((resid   7 and name HA   ))   ( (resid   7 and name HG*  ))     3.49  1.69  0.52
 assign ((resid   7 and name HA   ))   ( (resid   7 and name HD*  ))     4.11  2.31  0.62
 assign ((resid   7 and name HA   ))   ( (resid  44 and name HG*  ))     4.62  2.82  0.69
 assign ((resid   7 and name HB*  ))   ( (resid   7 and name HG*  ))     2.31  0.51  0.35
 assign ((resid   7 and name HB*  ))   ( (resid   7 and name HD*  ))     2.51  0.71  0.38
 assign ((resid   7 and name HB*  ))   ( (resid   8 and name HN   ))     4.02  2.22  0.60
 assign ((resid   7 and name HB*  ))   ( (resid  43 and name HN   ))     5.51  3.71  0.83
 assign ((resid   7 and name HB*  ))   ( (resid  44 and name HA   ))     4.87  3.07  0.73
 assign ((resid   7 and name HB*  ))   ( (resid  44 and name HB2  ))     5.24  3.44  0.79
 assign ((resid   7 and name HB*  ))   ( (resid  74 and name HN   ))     4.15  2.35  0.62
 assign ((resid   7 and name HB*  ))   ( (resid  74 and name HB   ))     4.97  3.17  0.75
 assign ((resid   7 and name HB*  ))   ( (resid  74 and name HG2* ))     3.48  1.68  0.52
 assign ((resid   7 and name HG*  ))   ( (resid  43 and name HN   ))     4.97  3.17  0.75
 assign ((resid   7 and name HG*  ))   ( (resid  44 and name HA   ))     4.13  2.33  0.62
 assign ((resid   7 and name HG*  ))   ( (resid  44 and name HB1  ))     4.99  3.19  0.75
 assign ((resid   7 and name HG*  ))   ( (resid  44 and name HG*  ))     4.42  2.62  0.66
 assign ((resid   7 and name HG*  ))   ( (resid  74 and name HN   ))     5.81  4.01  0.87
 assign ((resid   7 and name HG*  ))   ( (resid  74 and name HG2* ))     4.63  2.83  0.69
 assign ((resid   7 and name HD*  ))   ( (resid   8 and name HN   ))     5.02  3.22  0.75
 assign ((resid   7 and name HD*  ))   ( (resid  43 and name HN   ))     4.85  3.05  0.73
 assign ((resid   7 and name HD*  ))   ( (resid  74 and name HG2* ))     3.67  1.87  0.55
 assign ((resid   7 and name HE   ))   ( (resid  44 and name HG*  ))     4.42  2.62  0.66
 assign ((resid   8 and name HD*  ))   ( (resid   9 and name HB*  ))     5.81  4.01  0.87
 assign ((resid   9 and name HN   ))   ( (resid   9 and name HB*  ))     3.11  1.31  0.47
 assign ((resid   9 and name HA   ))   ( (resid  42 and name HB*  ))     4.26  2.46  0.64
 assign ((resid   9 and name HB*  ))   ( (resid   9 and name HE   ))     4.08  2.28  0.61
 assign ((resid   9 and name HB*  ))   ( (resid  10 and name HA1  ))     5.59  3.79  0.84
 assign ((resid   9 and name HB*  ))   ( (resid  42 and name HA   ))     4.66  2.86  0.70
 assign ((resid   9 and name HB*  ))   ( (resid  42 and name HB*  ))     5.28  3.48  0.79
 assign ((resid   9 and name HB*  ))   ( (resid  72 and name HN   ))     4.53  2.73  0.68
 assign ((resid   9 and name HB*  ))   ( (resid  72 and name HG2* ))     4.24  2.44  0.64
 assign ((resid   9 and name HG*  ))   ( (resid  42 and name HB*  ))     3.78  1.98  0.57
 assign ((resid   9 and name HD*  ))   ( (resid  42 and name HB*  ))     4.38  2.58  0.66
 assign ((resid   9 and name HE   ))   ( (resid  42 and name HB*  ))     4.43  2.63  0.66
 assign ((resid  11 and name HN   ))   ( (resid  12 and name HB*  ))     4.58  2.78  0.69
 assign ((resid  12 and name HB*  ))   ( (resid  13 and name HN   ))     3.96  2.16  0.59
 assign ((resid  12 and name HB*  ))   ( (resid  15 and name HN   ))     3.81  2.01  0.57
 assign ((resid  12 and name HB*  ))   ( (resid  15 and name HA   ))     5.47  3.67  0.82
 assign ((resid  12 and name HB*  ))   ( (resid  15 and name HB*  ))     3.22  1.42  0.48
 assign ((resid  12 and name HB*  ))   ( (resid  71 and name HG2* ))     4.68  2.88  0.70
 assign ((resid  13 and name HN   ))   ( (resid  13 and name HD*  ))     3.90  2.10  0.59
 assign ((resid  13 and name HA   ))   ( (resid  13 and name HD*  ))     2.93  1.13  0.44
 assign ((resid  13 and name HB2  ))   ( (resid  13 and name HD*  ))     3.12  1.32  0.47
 assign ((resid  13 and name HB1  ))   ( (resid  13 and name HD*  ))     3.09  1.29  0.46
 assign ((resid  13 and name HB1  ))   ( (resid  14 and name HG*  ))     4.61  2.81  0.69
 assign ((resid  13 and name HD*  ))   ( (resid  14 and name HN   ))     4.28  2.48  0.64
 assign ((resid  13 and name HD*  ))   ( (resid  16 and name HB2  ))     4.17  2.37  0.63
 assign ((resid  13 and name HD*  ))   ( (resid  16 and name HB1  ))     4.21  2.41  0.63
 assign ((resid  13 and name HD*  ))   ( (resid  17 and name HN   ))     4.36  2.56  0.65
 assign ((resid  13 and name HD*  ))   ( (resid  17 and name HA   ))     4.90  3.10  0.74
 assign ((resid  13 and name HD*  ))   ( (resid  17 and name HB2  ))     5.72  3.92  0.86
 assign ((resid  13 and name HD*  ))   ( (resid  17 and name HG*  ))     3.23  1.43  0.48
 assign ((resid  13 and name HD*  ))   ( (resid  41 and name HA   ))     4.46  2.66  0.67
 assign ((resid  13 and name HD*  ))   ( (resid  41 and name HD21 ))     5.92  4.12  0.89
 assign ((resid  14 and name HN   ))   ( (resid  14 and name HG*  ))     3.29  1.49  0.49
 assign ((resid  14 and name HA   ))   ( (resid  17 and name HG*  ))     4.82  3.02  0.72
 assign ((resid  14 and name HB2  ))   ( (resid  18 and name HE*  ))     4.63  2.83  0.69
 assign ((resid  14 and name HB1  ))   ( (resid  18 and name HE*  ))     3.97  2.17  0.60
 assign ((resid  14 and name HG*  ))   ( (resid  15 and name HN   ))     4.43  2.63  0.66
 assign ((resid  14 and name HG*  ))   ( (resid  18 and name HD2  ))     4.97  3.17  0.75
 assign ((resid  14 and name HG*  ))   ( (resid  18 and name HD1  ))     5.01  3.21  0.75
 assign ((resid  14 and name HG*  ))   ( (resid  18 and name HE*  ))     3.93  2.13  0.59
 assign ((resid  15 and name HA   ))   ( (resid  18 and name HE*  ))     4.62  2.82  0.69
 assign ((resid  16 and name HD1* ))   ( (resid  42 and name HB*  ))     4.48  2.68  0.67
 assign ((resid  17 and name HA   ))   ( (resid  17 and name HG*  ))     3.50  1.70  0.53
 assign ((resid  17 and name HA   ))   ( (resid  20 and name HD*  ))     4.48  2.68  0.67
 assign ((resid  17 and name HG*  ))   ( (resid  18 and name HN   ))     4.37  2.57  0.66
 assign ((resid  17 and name HG*  ))   ( (resid  38 and name HD2* ))     4.35  2.55  0.65
 assign ((resid  18 and name HA   ))   ( (resid  18 and name HE*  ))     5.01  3.21  0.75
 assign ((resid  18 and name HA   ))   ( (resid  21 and name HG*  ))     5.81  4.01  0.87
 assign ((resid  18 and name HB1  ))   ( (resid  18 and name HE*  ))     4.82  3.02  0.72
 assign ((resid  18 and name HG2  ))   ( (resid  18 and name HE*  ))     3.21  1.41  0.48
 assign ((resid  18 and name HG1  ))   ( (resid  18 and name HE*  ))     3.42  1.62  0.51
 assign ((resid  18 and name HE*  ))   ( (resid  69 and name HD*  ))     5.81  4.01  0.87
 assign ((resid  20 and name HN   ))   ( (resid  20 and name HD*  ))     3.83  2.03  0.57
 assign ((resid  20 and name HA   ))   ( (resid  20 and name HD*  ))     3.29  1.49  0.49
 assign ((resid  20 and name HD*  ))   ( (resid  21 and name HN   ))     4.23  2.43  0.63
 assign ((resid  20 and name HD*  ))   ( (resid  21 and name HB*  ))     4.96  3.16  0.74
 assign ((resid  20 and name HD*  ))   ( (resid  23 and name HN   ))     4.63  2.83  0.69
 assign ((resid  20 and name HD*  ))   ( (resid  23 and name HB2  ))     5.01  3.21  0.75
 assign ((resid  20 and name HD*  ))   ( (resid  23 and name HB1  ))     5.70  3.90  0.86
 assign ((resid  20 and name HD*  ))   ( (resid  23 and name HG2  ))     5.92  4.12  0.89
 assign ((resid  20 and name HD*  ))   ( (resid  23 and name HG1  ))     5.50  3.70  0.83
 assign ((resid  20 and name HD*  ))   ( (resid  24 and name HN   ))     4.62  2.82  0.69
 assign ((resid  20 and name HD*  ))   ( (resid  24 and name HA   ))     4.63  2.83  0.69
 assign ((resid  20 and name HD*  ))   ( (resid  24 and name HB   ))     4.97  3.17  0.75
 assign ((resid  20 and name HD*  ))   ( (resid  24 and name HG2* ))     4.30  2.50  0.65
 assign ((resid  20 and name HD*  ))   ( (resid  24 and name HG12 ))     3.72  1.92  0.56
 assign ((resid  20 and name HD*  ))   ( (resid  24 and name HG11 ))     4.01  2.21  0.60
 assign ((resid  20 and name HD*  ))   ( (resid  24 and name HD1* ))     3.29  1.49  0.49
 assign ((resid  20 and name HD*  ))   ( (resid  34 and name HG2* ))     4.18  2.38  0.63
 assign ((resid  20 and name HD*  ))   ( (resid  36 and name HA   ))     4.81  3.01  0.72
 assign ((resid  20 and name HD*  ))   ( (resid  36 and name HB2  ))     4.07  2.27  0.61
 assign ((resid  20 and name HD*  ))   ( (resid  36 and name HB1  ))     4.61  2.81  0.69
 assign ((resid  20 and name HD*  ))   ( (resid  36 and name HD*  ))     3.32  1.52  0.50
 assign ((resid  20 and name HD*  ))   ( (resid  36 and name HE*  ))     3.64  1.84  0.55
 assign ((resid  20 and name HD*  ))   ( (resid  37 and name HN   ))     5.39  3.59  0.81
 assign ((resid  20 and name HD*  ))   ( (resid  38 and name HG   ))     5.68  3.88  0.85
 assign ((resid  20 and name HD*  ))   ( (resid  38 and name HD1* ))     3.90  2.10  0.59
 assign ((resid  20 and name HD*  ))   ( (resid  38 and name HD2* ))     4.12  2.32  0.62
 assign ((resid  20 and name HD*  ))   ( (resid  43 and name HG   ))     4.45  2.65  0.67
 assign ((resid  20 and name HD*  ))   ( (resid  43 and name HD1* ))     3.08  1.28  0.46
 assign ((resid  20 and name HD*  ))   ( (resid  43 and name HD2* ))     3.55  1.75  0.53
 assign ((resid  20 and name HD*  ))   ( (resid  45 and name HG2* ))     3.73  1.93  0.56
 assign ((resid  20 and name HD*  ))   ( (resid  45 and name HG12 ))     4.30  2.50  0.65
 assign ((resid  20 and name HD*  ))   ( (resid  45 and name HG11 ))     4.05  2.25  0.61
 assign ((resid  20 and name HD*  ))   ( (resid  45 and name HD1* ))     3.24  1.44  0.49
 assign ((resid  21 and name HN   ))   ( (resid  21 and name HG*  ))     4.09  2.29  0.61
 assign ((resid  21 and name HA   ))   ( (resid  21 and name HG*  ))     3.28  1.48  0.49
 assign ((resid  21 and name HG*  ))   ( (resid  21 and name HD*  ))     2.40  0.60  0.36
 assign ((resid  21 and name HG*  ))   ( (resid  22 and name HN   ))     4.08  2.28  0.61
 assign ((resid  21 and name HG*  ))   ( (resid  22 and name HG2  ))     5.38  3.58  0.81
 assign ((resid  21 and name HG*  ))   ( (resid  25 and name HN   ))     4.70  2.90  0.70
 assign ((resid  21 and name HG*  ))   ( (resid  25 and name HB2  ))     4.64  2.84  0.70
 assign ((resid  21 and name HG*  ))   ( (resid  25 and name HD2  ))     4.85  3.05  0.73
 assign ((resid  24 and name HG2* ))   ( (resid  28 and name HD*  ))     3.18  1.38  0.48
 assign ((resid  25 and name HA   ))   ( (resid  28 and name HD*  ))     4.64  2.84  0.70
 assign ((resid  26 and name HN   ))   ( (resid  29 and name HD*  ))     5.81  4.01  0.87
 assign ((resid  26 and name HA   ))   ( (resid  29 and name HD*  ))     3.49  1.69  0.52
 assign ((resid  26 and name HG2  ))   ( (resid  29 and name HD*  ))     5.31  3.51  0.80
 assign ((resid  26 and name HE21 ))   ( (resid  29 and name HD*  ))     5.10  3.30  0.77
 assign ((resid  26 and name HE22 ))   ( (resid  29 and name HD*  ))     4.46  2.66  0.67
 assign ((resid  28 and name HN   ))   ( (resid  28 and name HD*  ))     5.02  3.22  0.75
 assign ((resid  28 and name HN   ))   ( (resid  29 and name HG*  ))     5.14  3.34  0.77
 assign ((resid  28 and name HA   ))   ( (resid  28 and name HD*  ))     3.79  1.99  0.57
 assign ((resid  28 and name HB2  ))   ( (resid  29 and name HG*  ))     5.59  3.79  0.84
 assign ((resid  28 and name HB1  ))   ( (resid  28 and name HD*  ))     2.64  0.84  0.40
 assign ((resid  28 and name HG1  ))   ( (resid  28 and name HD*  ))     2.55  0.75  0.38
 assign ((resid  28 and name HD*  ))   ( (resid  34 and name HG1* ))     5.29  3.49  0.79
 assign ((resid  28 and name HD*  ))   ( (resid  34 and name HG2* ))     5.72  3.92  0.86
 assign ((resid  29 and name HN   ))   ( (resid  29 and name HG*  ))     3.51  1.71  0.53
 assign ((resid  29 and name HN   ))   ( (resid  29 and name HD*  ))     4.23  2.43  0.63
 assign ((resid  29 and name HB*  ))   ( (resid  29 and name HD*  ))     2.95  1.15  0.44
 assign ((resid  29 and name HG*  ))   ( (resid  29 and name HD*  ))     2.35  0.55  0.35
 assign ((resid  29 and name HG*  ))   ( (resid  29 and name HE*  ))     3.21  1.41  0.48
 assign ((resid  29 and name HG*  ))   ( (resid  30 and name HD*  ))     4.37  2.57  0.66
 assign ((resid  29 and name HG*  ))   ( (resid  30 and name HE*  ))     4.77  2.97  0.72
 assign ((resid  29 and name HD*  ))   ( (resid  30 and name HD*  ))     5.04  3.24  0.76
 assign ((resid  29 and name HD*  ))   ( (resid  30 and name HE*  ))     4.38  2.58  0.66
 assign ((resid  30 and name HN   ))   ( (resid  30 and name HB*  ))     3.25  1.45  0.49
 assign ((resid  30 and name HB*  ))   ( (resid  31 and name HB*  ))     5.09  3.29  0.76
 assign ((resid  30 and name HB*  ))   ( (resid  32 and name HN   ))     4.41  2.61  0.66
 assign ((resid  30 and name HB*  ))   ( (resid  47 and name HG2* ))     5.39  3.59  0.81
 assign ((resid  30 and name HB*  ))   ( (resid  50 and name HG1* ))     4.08  2.28  0.61
 assign ((resid  30 and name HB*  ))   ( (resid  54 and name HG1* ))     3.83  2.03  0.57
 assign ((resid  30 and name HB*  ))   ( (resid  54 and name HG2* ))     3.87  2.07  0.58
 assign ((resid  30 and name HB*  ))   ( (resid  58 and name HD2* ))     5.81  4.01  0.87
 assign ((resid  37 and name HB   ))   ( (resid  39 and name HB*  ))     5.31  3.51  0.80
 assign ((resid  37 and name HB   ))   ( (resid  44 and name HG*  ))     4.49  2.69  0.67
 assign ((resid  37 and name HG2* ))   ( (resid  39 and name HB*  ))     3.16  1.36  0.47
 assign ((resid  39 and name HN   ))   ( (resid  42 and name HB*  ))     5.20  3.40  0.78
 assign ((resid  39 and name HA   ))   ( (resid  40 and name HA*  ))     5.47  3.67  0.82
 assign ((resid  40 and name HA*  ))   ( (resid  41 and name HN   ))     3.08  1.28  0.46
 assign ((resid  40 and name HA*  ))   ( (resid  41 and name HA   ))     5.57  3.77  0.84
 assign ((resid  41 and name HN   ))   ( (resid  42 and name HB*  ))     4.57  2.77  0.69
 assign ((resid  42 and name HB*  ))   ( (resid  43 and name HN   ))     3.54  1.74  0.53
 assign ((resid  42 and name HB*  ))   ( (resid  43 and name HA   ))     4.72  2.92  0.71
 assign ((resid  42 and name HB*  ))   ( (resid  44 and name HN   ))     5.81  4.01  0.87
 assign ((resid  44 and name HG*  ))   ( (resid  45 and name HN   ))     3.59  1.79  0.54
 assign ((resid  44 and name HG*  ))   ( (resid  46 and name HN   ))     5.03  3.23  0.75
 assign ((resid  44 and name HG*  ))   ( (resid  46 and name HG*  ))     3.91  2.11  0.59
 assign ((resid  46 and name HN   ))   ( (resid  46 and name HD*  ))     4.54  2.74  0.68
 assign ((resid  46 and name HA   ))   ( (resid  46 and name HD*  ))     4.61  2.81  0.69
 assign ((resid  46 and name HB1  ))   ( (resid  46 and name HD*  ))     3.39  1.59  0.51
 assign ((resid  46 and name HD*  ))   ( (resid  47 and name HN   ))     5.81  4.01  0.87
 assign ((resid  51 and name HG*  ))   ( (resid  52 and name HN   ))     4.37  2.57  0.66
 assign ((resid  51 and name HG*  ))   ( (resid  53 and name HN   ))     4.05  2.25  0.61
 assign ((resid  51 and name HG*  ))   ( (resid  53 and name HG2  ))     4.14  2.34  0.62
 assign ((resid  51 and name HG*  ))   ( (resid  53 and name HG1  ))     3.66  1.86  0.55
 assign ((resid  51 and name HG*  ))   ( (resid  53 and name HE21 ))     4.88  3.08  0.73
 assign ((resid  51 and name HG*  ))   ( (resid  53 and name HE22 ))     5.81  4.01  0.87
 assign ((resid  51 and name HG*  ))   ( (resid  54 and name HN   ))     4.02  2.22  0.60
 assign ((resid  51 and name HG*  ))   ( (resid  54 and name HB   ))     3.94  2.14  0.59
 assign ((resid  51 and name HG*  ))   ( (resid  54 and name HG1* ))     4.63  2.83  0.69
 assign ((resid  52 and name HN   ))   ( (resid  52 and name HB*  ))     3.13  1.33  0.47
 assign ((resid  52 and name HB*  ))   ( (resid  52 and name HG*  ))     2.38  0.58  0.36
 assign ((resid  52 and name HB*  ))   ( (resid  53 and name HN   ))     3.44  1.64  0.52
 assign ((resid  55 and name HB1  ))   ( (resid  55 and name HD*  ))     3.71  1.91  0.56
 assign ((resid  55 and name HD*  ))   ( (resid  77 and name HG2* ))     3.90  2.10  0.59
 assign ((resid  55 and name HD*  ))   ( (resid  77 and name HD1* ))     5.51  3.71  0.83
 assign ((resid  77 and name HB   ))   ( (resid  79 and name HA*  ))     5.81  4.01  0.87
 assign ((resid  78 and name HN   ))   ( (resid  78 and name HB*  ))     3.43  1.63  0.51
 assign ((resid  78 and name HN   ))   ( (resid  79 and name HA*  ))     5.17  3.37  0.78
 assign ((resid  78 and name HB*  ))   ( (resid  78 and name HG*  ))     2.38  0.58  0.36
 assign ((resid  78 and name HB*  ))   ( (resid  78 and name HD*  ))     2.93  1.13  0.44
 assign ((resid  78 and name HB*  ))   ( (resid  79 and name HN   ))     3.24  1.44  0.49
 assign ((resid  78 and name HB*  ))   ( (resid  79 and name HA*  ))     4.30  2.50  0.65
 assign ((resid  78 and name HB*  ))   ( (resid  80 and name HN   ))     4.39  2.59  0.66
 assign ((resid  78 and name HB*  ))   ( (resid  81 and name HN   ))     4.05  2.25  0.61
 assign ((resid  78 and name HB*  ))   ( (resid  81 and name HD1* ))     4.63  2.83  0.69
 assign ((resid  79 and name HA*  ))   ( (resid  81 and name HG   ))     4.41  2.61  0.66
 assign ((resid  79 and name HA*  ))   ( (resid  81 and name HD1* ))     4.71  2.91  0.71
 assign ((resid  79 and name HA*  ))   ( (resid  81 and name HD2* ))     5.60  3.80  0.84
 assign ((resid  81 and name HN   ))   ( (resid  81 and name HB*  ))     3.24  1.44  0.49
 assign ((resid  81 and name HA   ))   ( (resid  82 and name HG*  ))     5.63  3.83  0.84
 assign ((resid  81 and name HB*  ))   ( (resid  81 and name HG   ))     2.52  0.72  0.38
 assign ((resid  81 and name HB*  ))   ( (resid  81 and name HD1* ))     2.67  0.87  0.40
 assign ((resid  82 and name HN   ))   ( (resid  82 and name HB*  ))     2.96  1.16  0.44
 assign ((resid  82 and name HB*  ))   ( (resid  83 and name HN   ))     3.60  1.80  0.54
 assign ((resid   6 and name HN   ))   ( (resid  45 and name O    ))     1.90  0.10  0.28
 assign ((resid   6 and name N    ))   ( (resid  45 and name O    ))     2.85  0.15  0.43
 assign ((resid   7 and name HN   ))   ( (resid  74 and name O    ))     1.90  0.10  0.28
 assign ((resid   7 and name N    ))   ( (resid  74 and name O    ))     2.85  0.15  0.43
 assign ((resid   8 and name HN   ))   ( (resid  43 and name O    ))     1.90  0.10  0.28
 assign ((resid   8 and name N    ))   ( (resid  43 and name O    ))     2.85  0.15  0.43
 assign ((resid   9 and name HN   ))   ( (resid  72 and name O    ))     1.90  0.10  0.28
 assign ((resid   9 and name N    ))   ( (resid  72 and name O    ))     2.85  0.15  0.43
 assign ((resid  14 and name O    ))   ( (resid  18 and name HN   ))     1.90  0.10  0.28
 assign ((resid  14 and name O    ))   ( (resid  18 and name N    ))     2.85  0.15  0.43
 assign ((resid  15 and name O    ))   ( (resid  19 and name HN   ))     1.90  0.10  0.28
 assign ((resid  15 and name O    ))   ( (resid  19 and name N    ))     2.85  0.15  0.43
 assign ((resid  16 and name O    ))   ( (resid  20 and name HN   ))     1.90  0.10  0.28
 assign ((resid  16 and name O    ))   ( (resid  20 and name N    ))     2.85  0.15  0.43
 assign ((resid  17 and name O    ))   ( (resid  21 and name HN   ))     1.90  0.10  0.28
 assign ((resid  17 and name O    ))   ( (resid  21 and name N    ))     2.85  0.15  0.43
 assign ((resid  19 and name O    ))   ( (resid  23 and name HN   ))     1.90  0.10  0.28
 assign ((resid  19 and name O    ))   ( (resid  23 and name N    ))     2.85  0.15  0.43
 assign ((resid  20 and name O    ))   ( (resid  24 and name HN   ))     1.90  0.10  0.28
 assign ((resid  20 and name O    ))   ( (resid  24 and name N    ))     2.85  0.15  0.43
 assign ((resid  23 and name O    ))   ( (resid  27 and name HN   ))     1.90  0.10  0.28
 assign ((resid  23 and name O    ))   ( (resid  27 and name N    ))     2.85  0.15  0.43
 assign ((resid  24 and name O    ))   ( (resid  28 and name HN   ))     1.90  0.10  0.28
 assign ((resid  24 and name O    ))   ( (resid  28 and name N    ))     2.85  0.15  0.43
 assign ((resid  25 and name O    ))   ( (resid  29 and name HN   ))     1.90  0.10  0.28
 assign ((resid  25 and name O    ))   ( (resid  29 and name N    ))     2.85  0.15  0.43
 assign ((resid  26 and name O    ))   ( (resid  30 and name HN   ))     1.90  0.10  0.28
 assign ((resid  26 and name O    ))   ( (resid  30 and name N    ))     2.85  0.15  0.43
 assign ((resid  37 and name HN   ))   ( (resid  44 and name O    ))     1.90  0.10  0.28
 assign ((resid  37 and name N    ))   ( (resid  44 and name O    ))     2.85  0.15  0.43
 assign ((resid   8 and name O    ))   ( (resid  43 and name HN   ))     1.90  0.10  0.28
 assign ((resid   8 and name O    ))   ( (resid  43 and name N    ))     2.85  0.15  0.43
 assign ((resid   6 and name O    ))   ( (resid  45 and name HN   ))     1.90  0.10  0.28
 assign ((resid   6 and name O    ))   ( (resid  45 and name N    ))     2.85  0.15  0.43
 assign ((resid  51 and name O    ))   ( (resid  55 and name HN   ))     1.90  0.10  0.28
 assign ((resid  51 and name O    ))   ( (resid  55 and name N    ))     2.85  0.15  0.43
 assign ((resid  54 and name O    ))   ( (resid  58 and name HN   ))     1.90  0.10  0.28
 assign ((resid  54 and name O    ))   ( (resid  58 and name N    ))     2.85  0.15  0.43
 assign ((resid  57 and name O    ))   ( (resid  61 and name HN   ))     1.90  0.10  0.28
 assign ((resid  57 and name O    ))   ( (resid  61 and name N    ))     2.85  0.15  0.43
 assign ((resid  58 and name O    ))   ( (resid  62 and name HN   ))     1.90  0.10  0.28
 assign ((resid  58 and name O    ))   ( (resid  62 and name N    ))     2.85  0.15  0.43
 assign ((resid  59 and name O    ))   ( (resid  63 and name HN   ))     1.90  0.10  0.28
 assign ((resid  59 and name O    ))   ( (resid  63 and name N    ))     2.85  0.15  0.43
 assign ((resid  60 and name O    ))   ( (resid  64 and name HN   ))     1.90  0.10  0.28
 assign ((resid  60 and name O    ))   ( (resid  64 and name N    ))     2.85  0.15  0.43
 assign ((resid  61 and name O    ))   ( (resid  65 and name HN   ))     1.90  0.10  0.28
 assign ((resid  61 and name O    ))   ( (resid  65 and name N    ))     2.85  0.15  0.43
 assign ((resid  62 and name O    ))   ( (resid  66 and name HN   ))     1.90  0.10  0.28
 assign ((resid  62 and name O    ))   ( (resid  66 and name N    ))     2.85  0.15  0.43
 assign ((resid  65 and name O    ))   ( (resid  69 and name HN   ))     1.90  0.10  0.28
 assign ((resid  65 and name O    ))   ( (resid  69 and name N    ))     2.85  0.15  0.43
 assign ((resid  66 and name O    ))   ( (resid  71 and name HN   ))     1.90  0.10  0.28
 assign ((resid  66 and name O    ))   ( (resid  71 and name N    ))     2.85  0.15  0.43
 assign ((resid   9 and name O    ))   ( (resid  72 and name HN   ))     1.90  0.10  0.28
 assign ((resid   9 and name O    ))   ( (resid  72 and name N    ))     2.85  0.15  0.43
 assign ((resid   7 and name O    ))   ( (resid  74 and name HN   ))     1.90  0.10  0.28
 assign ((resid   7 and name O    ))   ( (resid  74 and name N    ))     2.85  0.15  0.43
!
! ACO file produced by PDBStat
! Version:  5.4-exp Compiled 2011-04-01 on (troberto.site)
!
   assign (resid   2 and name C   )   (resid   3 and name N   )
          (resid   3 and name CA  )   (resid   3 and name C   )   1.0   -121.70    41.50   2 
   assign (resid   3 and name N   )   (resid   3 and name CA  )
          (resid   3 and name C   )   (resid   4 and name N   )   1.0    141.25    27.95   2 
   assign (resid   3 and name C   )   (resid   4 and name N   )
          (resid   4 and name CA  )   (resid   4 and name C   )   1.0   -136.80    20.00   2 
   assign (resid   4 and name N   )   (resid   4 and name CA  )
          (resid   4 and name C   )   (resid   5 and name N   )   1.0    132.65    22.25   2 
   assign (resid   4 and name C   )   (resid   5 and name N   )
          (resid   5 and name CA  )   (resid   5 and name C   )   1.0   -103.30    20.30   2 
   assign (resid   5 and name N   )   (resid   5 and name CA  )
          (resid   5 and name C   )   (resid   6 and name N   )   1.0    127.90    20.30   2 
   assign (resid   5 and name C   )   (resid   6 and name N   )
          (resid   6 and name CA  )   (resid   6 and name C   )   1.0   -121.40    20.00   2 
   assign (resid   6 and name N   )   (resid   6 and name CA  )
          (resid   6 and name C   )   (resid   7 and name N   )   1.0    132.20    20.00   2 
   assign (resid   6 and name C   )   (resid   7 and name N   )
          (resid   7 and name CA  )   (resid   7 and name C   )   1.0   -114.50    26.80   2 
   assign (resid   7 and name N   )   (resid   7 and name CA  )
          (resid   7 and name C   )   (resid   8 and name N   )   1.0    128.95    25.35   2 
   assign (resid   7 and name C   )   (resid   8 and name N   )
          (resid   8 and name CA  )   (resid   8 and name C   )   1.0   -124.50    20.00   2 
   assign (resid   8 and name N   )   (resid   8 and name CA  )
          (resid   8 and name C   )   (resid   9 and name N   )   1.0    142.25    26.05   2 
   assign (resid   8 and name C   )   (resid   9 and name N   )
          (resid   9 and name CA  )   (resid   9 and name C   )   1.0   -130.60    33.90   2 
   assign (resid   9 and name N   )   (resid   9 and name CA  )
          (resid   9 and name C   )   (resid  10 and name N   )   1.0    142.95    23.45   2 
   assign (resid  12 and name C   )   (resid  13 and name N   )
          (resid  13 and name CA  )   (resid  13 and name C   )   1.0    -56.70    20.00   2 
   assign (resid  13 and name N   )   (resid  13 and name CA  )
          (resid  13 and name C   )   (resid  14 and name N   )   1.0    -37.70    26.60   2 
   assign (resid  13 and name C   )   (resid  14 and name N   )
          (resid  14 and name CA  )   (resid  14 and name C   )   1.0    -58.50    20.00   2 
   assign (resid  14 and name N   )   (resid  14 and name CA  )
          (resid  14 and name C   )   (resid  15 and name N   )   1.0    -39.70    20.00   2 
   assign (resid  14 and name C   )   (resid  15 and name N   )
          (resid  15 and name CA  )   (resid  15 and name C   )   1.0    -65.00    20.00   2 
   assign (resid  15 and name N   )   (resid  15 and name CA  )
          (resid  15 and name C   )   (resid  16 and name N   )   1.0    -39.50    20.00   2 
   assign (resid  15 and name C   )   (resid  16 and name N   )
          (resid  16 and name CA  )   (resid  16 and name C   )   1.0    -66.70    20.00   2 
   assign (resid  16 and name N   )   (resid  16 and name CA  )
          (resid  16 and name C   )   (resid  17 and name N   )   1.0    -42.60    20.10   2 
   assign (resid  16 and name C   )   (resid  17 and name N   )
          (resid  17 and name CA  )   (resid  17 and name C   )   1.0    -67.10    20.00   2 
   assign (resid  17 and name N   )   (resid  17 and name CA  )
          (resid  17 and name C   )   (resid  18 and name N   )   1.0    -35.90    20.00   2 
   assign (resid  17 and name C   )   (resid  18 and name N   )
          (resid  18 and name CA  )   (resid  18 and name C   )   1.0    -66.20    20.00   2 
   assign (resid  18 and name N   )   (resid  18 and name CA  )
          (resid  18 and name C   )   (resid  19 and name N   )   1.0    -40.85    20.55   2 
   assign (resid  18 and name C   )   (resid  19 and name N   )
          (resid  19 and name CA  )   (resid  19 and name C   )   1.0    -65.60    20.00   2 
   assign (resid  19 and name N   )   (resid  19 and name CA  )
          (resid  19 and name C   )   (resid  20 and name N   )   1.0    -43.30    20.00   2 
   assign (resid  19 and name C   )   (resid  20 and name N   )
          (resid  20 and name CA  )   (resid  20 and name C   )   1.0    -62.90    20.00   2 
   assign (resid  20 and name N   )   (resid  20 and name CA  )
          (resid  20 and name C   )   (resid  21 and name N   )   1.0    -45.00    20.00   2 
   assign (resid  20 and name C   )   (resid  21 and name N   )
          (resid  21 and name CA  )   (resid  21 and name C   )   1.0    -58.40    20.00   2 
   assign (resid  21 and name N   )   (resid  21 and name CA  )
          (resid  21 and name C   )   (resid  22 and name N   )   1.0    -36.75    27.15   2 
   assign (resid  21 and name C   )   (resid  22 and name N   )
          (resid  22 and name CA  )   (resid  22 and name C   )   1.0    -64.00    20.00   2 
   assign (resid  22 and name N   )   (resid  22 and name CA  )
          (resid  22 and name C   )   (resid  23 and name N   )   1.0    -40.00    20.00   2 
   assign (resid  22 and name C   )   (resid  23 and name N   )
          (resid  23 and name CA  )   (resid  23 and name C   )   1.0    -66.90    20.00   2 
   assign (resid  23 and name N   )   (resid  23 and name CA  )
          (resid  23 and name C   )   (resid  24 and name N   )   1.0    -43.10    20.00   2 
   assign (resid  23 and name C   )   (resid  24 and name N   )
          (resid  24 and name CA  )   (resid  24 and name C   )   1.0    -64.30    20.00   2 
   assign (resid  24 and name N   )   (resid  24 and name CA  )
          (resid  24 and name C   )   (resid  25 and name N   )   1.0    -43.90    20.00   2 
   assign (resid  24 and name C   )   (resid  25 and name N   )
          (resid  25 and name CA  )   (resid  25 and name C   )   1.0    -59.50    20.00   2 
   assign (resid  25 and name N   )   (resid  25 and name CA  )
          (resid  25 and name C   )   (resid  26 and name N   )   1.0    -38.90    22.50   2 
   assign (resid  25 and name C   )   (resid  26 and name N   )
          (resid  26 and name CA  )   (resid  26 and name C   )   1.0    -64.10    20.00   2 
   assign (resid  26 and name N   )   (resid  26 and name CA  )
          (resid  26 and name C   )   (resid  27 and name N   )   1.0    -39.40    20.00   2 
   assign (resid  26 and name C   )   (resid  27 and name N   )
          (resid  27 and name CA  )   (resid  27 and name C   )   1.0    -61.10    20.00   2 
   assign (resid  27 and name N   )   (resid  27 and name CA  )
          (resid  27 and name C   )   (resid  28 and name N   )   1.0    -40.40    22.60   2 
   assign (resid  27 and name C   )   (resid  28 and name N   )
          (resid  28 and name CA  )   (resid  28 and name C   )   1.0    -68.90    23.20   2 
   assign (resid  28 and name N   )   (resid  28 and name CA  )
          (resid  28 and name C   )   (resid  29 and name N   )   1.0    -36.70    20.00   2 
   assign (resid  28 and name C   )   (resid  29 and name N   )
          (resid  29 and name CA  )   (resid  29 and name C   )   1.0    -67.90    20.00   2 
   assign (resid  29 and name N   )   (resid  29 and name CA  )
          (resid  29 and name C   )   (resid  30 and name N   )   1.0    -31.30    21.00   2 
   assign (resid  29 and name C   )   (resid  30 and name N   )
          (resid  30 and name CA  )   (resid  30 and name C   )   1.0    -95.70    23.50   2 
   assign (resid  30 and name N   )   (resid  30 and name CA  )
          (resid  30 and name C   )   (resid  31 and name N   )   1.0      3.40    29.60   2 
   assign (resid  32 and name C   )   (resid  33 and name N   )
          (resid  33 and name CA  )   (resid  33 and name C   )   1.0   -101.70    23.50   2 
   assign (resid  33 and name N   )   (resid  33 and name CA  )
          (resid  33 and name C   )   (resid  34 and name N   )   1.0    134.00    20.00   2 
   assign (resid  33 and name C   )   (resid  34 and name N   )
          (resid  34 and name CA  )   (resid  34 and name C   )   1.0   -115.55    25.85   2 
   assign (resid  34 and name N   )   (resid  34 and name CA  )
          (resid  34 and name C   )   (resid  35 and name N   )   1.0    125.50    20.00   2 
   assign (resid  34 and name C   )   (resid  35 and name N   )
          (resid  35 and name CA  )   (resid  35 and name C   )   1.0   -128.80    49.80   2 
   assign (resid  35 and name N   )   (resid  35 and name CA  )
          (resid  35 and name C   )   (resid  36 and name N   )   1.0    159.25    25.35   2 
   assign (resid  35 and name C   )   (resid  36 and name N   )
          (resid  36 and name CA  )   (resid  36 and name C   )   1.0   -124.75    26.55   2 
   assign (resid  36 and name N   )   (resid  36 and name CA  )
          (resid  36 and name C   )   (resid  37 and name N   )   1.0    144.80    25.70   2 
   assign (resid  36 and name C   )   (resid  37 and name N   )
          (resid  37 and name CA  )   (resid  37 and name C   )   1.0   -127.00    43.90   2 
   assign (resid  37 and name N   )   (resid  37 and name CA  )
          (resid  37 and name C   )   (resid  38 and name N   )   1.0    139.75    43.65   2 
   assign (resid  37 and name C   )   (resid  38 and name N   )
          (resid  38 and name CA  )   (resid  38 and name C   )   1.0   -119.20    49.00   2 
   assign (resid  38 and name N   )   (resid  38 and name CA  )
          (resid  38 and name C   )   (resid  39 and name N   )   1.0    132.30    20.00   2 
   assign (resid  38 and name C   )   (resid  39 and name N   )
          (resid  39 and name CA  )   (resid  39 and name C   )   1.0   -109.85    43.55   2 
   assign (resid  39 and name N   )   (resid  39 and name CA  )
          (resid  39 and name C   )   (resid  40 and name N   )   1.0    150.25    59.45   2 
   assign (resid  41 and name C   )   (resid  42 and name N   )
          (resid  42 and name CA  )   (resid  42 and name C   )   1.0   -134.35    47.05   2 
   assign (resid  42 and name N   )   (resid  42 and name CA  )
          (resid  42 and name C   )   (resid  43 and name N   )   1.0    137.75    20.95   2 
   assign (resid  42 and name C   )   (resid  43 and name N   )
          (resid  43 and name CA  )   (resid  43 and name C   )   1.0   -114.65    35.35   2 
   assign (resid  43 and name N   )   (resid  43 and name CA  )
          (resid  43 and name C   )   (resid  44 and name N   )   1.0    125.10    20.00   2 
   assign (resid  43 and name C   )   (resid  44 and name N   )
          (resid  44 and name CA  )   (resid  44 and name C   )   1.0   -109.45    33.45   2 
   assign (resid  44 and name N   )   (resid  44 and name CA  )
          (resid  44 and name C   )   (resid  45 and name N   )   1.0    122.80    21.00   2 
   assign (resid  44 and name C   )   (resid  45 and name N   )
          (resid  45 and name CA  )   (resid  45 and name C   )   1.0   -119.10    25.40   2 
   assign (resid  45 and name N   )   (resid  45 and name CA  )
          (resid  45 and name C   )   (resid  46 and name N   )   1.0    131.50    20.00   2 
   assign (resid  45 and name C   )   (resid  46 and name N   )
          (resid  46 and name CA  )   (resid  46 and name C   )   1.0   -110.25    30.65   2 
   assign (resid  46 and name N   )   (resid  46 and name CA  )
          (resid  46 and name C   )   (resid  47 and name N   )   1.0    122.35    20.65   2 
   assign (resid  46 and name C   )   (resid  47 and name N   )
          (resid  47 and name CA  )   (resid  47 and name C   )   1.0   -116.05    21.85   2 
   assign (resid  47 and name N   )   (resid  47 and name CA  )
          (resid  47 and name C   )   (resid  48 and name N   )   1.0    127.50    20.00   2 
   assign (resid  47 and name C   )   (resid  48 and name N   )
          (resid  48 and name CA  )   (resid  48 and name C   )   1.0   -117.15    52.85   2 
   assign (resid  48 and name N   )   (resid  48 and name CA  )
          (resid  48 and name C   )   (resid  49 and name N   )   1.0    159.60    26.90   2 
   assign (resid  51 and name C   )   (resid  52 and name N   )
          (resid  52 and name CA  )   (resid  52 and name C   )   1.0    -50.00    20.00   2 
   assign (resid  52 and name N   )   (resid  52 and name CA  )
          (resid  52 and name C   )   (resid  53 and name N   )   1.0    -44.50    21.90   2 
   assign (resid  52 and name C   )   (resid  53 and name N   )
          (resid  53 and name CA  )   (resid  53 and name C   )   1.0    -59.00    20.00   2 
   assign (resid  53 and name N   )   (resid  53 and name CA  )
          (resid  53 and name C   )   (resid  54 and name N   )   1.0    -37.80    20.00   2 
   assign (resid  53 and name C   )   (resid  54 and name N   )
          (resid  54 and name CA  )   (resid  54 and name C   )   1.0    -71.00    20.00   2 
   assign (resid  54 and name N   )   (resid  54 and name CA  )
          (resid  54 and name C   )   (resid  55 and name N   )   1.0    -35.80    20.00   2 
   assign (resid  54 and name C   )   (resid  55 and name N   )
          (resid  55 and name CA  )   (resid  55 and name C   )   1.0    -57.80    20.00   2 
   assign (resid  55 and name N   )   (resid  55 and name CA  )
          (resid  55 and name C   )   (resid  56 and name N   )   1.0    -45.50    20.00   2 
   assign (resid  55 and name C   )   (resid  56 and name N   )
          (resid  56 and name CA  )   (resid  56 and name C   )   1.0    -60.50    20.00   2 
   assign (resid  56 and name N   )   (resid  56 and name CA  )
          (resid  56 and name C   )   (resid  57 and name N   )   1.0    -40.90    20.00   2 
   assign (resid  56 and name C   )   (resid  57 and name N   )
          (resid  57 and name CA  )   (resid  57 and name C   )   1.0    -63.80    20.00   2 
   assign (resid  57 and name N   )   (resid  57 and name CA  )
          (resid  57 and name C   )   (resid  58 and name N   )   1.0    -42.20    20.00   2 
   assign (resid  57 and name C   )   (resid  58 and name N   )
          (resid  58 and name CA  )   (resid  58 and name C   )   1.0    -74.85    38.65   2 
   assign (resid  58 and name N   )   (resid  58 and name CA  )
          (resid  58 and name C   )   (resid  59 and name N   )   1.0    -31.45    45.05   2 
   assign (resid  58 and name C   )   (resid  59 and name N   )
          (resid  59 and name CA  )   (resid  59 and name C   )   1.0    -63.00    20.00   2 
   assign (resid  59 and name N   )   (resid  59 and name CA  )
          (resid  59 and name C   )   (resid  60 and name N   )   1.0    -40.60    20.00   2 
   assign (resid  59 and name C   )   (resid  60 and name N   )
          (resid  60 and name CA  )   (resid  60 and name C   )   1.0    -64.00    20.00   2 
   assign (resid  60 and name N   )   (resid  60 and name CA  )
          (resid  60 and name C   )   (resid  61 and name N   )   1.0    -44.60    20.00   2 
   assign (resid  60 and name C   )   (resid  61 and name N   )
          (resid  61 and name CA  )   (resid  61 and name C   )   1.0    -66.20    20.00   2 
   assign (resid  61 and name N   )   (resid  61 and name CA  )
          (resid  61 and name C   )   (resid  62 and name N   )   1.0    -42.10    20.00   2 
   assign (resid  61 and name C   )   (resid  62 and name N   )
          (resid  62 and name CA  )   (resid  62 and name C   )   1.0    -60.20    20.00   2 
   assign (resid  62 and name N   )   (resid  62 and name CA  )
          (resid  62 and name C   )   (resid  63 and name N   )   1.0    -43.10    20.00   2 
   assign (resid  62 and name C   )   (resid  63 and name N   )
          (resid  63 and name CA  )   (resid  63 and name C   )   1.0    -61.50    20.00   2 
   assign (resid  63 and name N   )   (resid  63 and name CA  )
          (resid  63 and name C   )   (resid  64 and name N   )   1.0    -41.20    20.00   2 
   assign (resid  63 and name C   )   (resid  64 and name N   )
          (resid  64 and name CA  )   (resid  64 and name C   )   1.0    -62.90    20.00   2 
   assign (resid  64 and name N   )   (resid  64 and name CA  )
          (resid  64 and name C   )   (resid  65 and name N   )   1.0    -45.20    20.00   2 
   assign (resid  64 and name C   )   (resid  65 and name N   )
          (resid  65 and name CA  )   (resid  65 and name C   )   1.0    -60.80    20.00   2 
   assign (resid  65 and name N   )   (resid  65 and name CA  )
          (resid  65 and name C   )   (resid  66 and name N   )   1.0    -41.60    20.00   2 
   assign (resid  65 and name C   )   (resid  66 and name N   )
          (resid  66 and name CA  )   (resid  66 and name C   )   1.0    -62.70    20.00   2 
   assign (resid  66 and name N   )   (resid  66 and name CA  )
          (resid  66 and name C   )   (resid  67 and name N   )   1.0    -37.40    21.70   2 
   assign (resid  66 and name C   )   (resid  67 and name N   )
          (resid  67 and name CA  )   (resid  67 and name C   )   1.0    -64.00    20.00   2 
   assign (resid  67 and name N   )   (resid  67 and name CA  )
          (resid  67 and name C   )   (resid  68 and name N   )   1.0    -39.65    22.05   2 
   assign (resid  67 and name C   )   (resid  68 and name N   )
          (resid  68 and name CA  )   (resid  68 and name C   )   1.0    -64.20    23.50   2 
   assign (resid  68 and name N   )   (resid  68 and name CA  )
          (resid  68 and name C   )   (resid  69 and name N   )   1.0    -33.80    20.00   2 
   assign (resid  68 and name C   )   (resid  69 and name N   )
          (resid  69 and name CA  )   (resid  69 and name C   )   1.0   -103.00    42.10   2 
   assign (resid  69 and name N   )   (resid  69 and name CA  )
          (resid  69 and name C   )   (resid  70 and name N   )   1.0      4.70    20.00   2 
   assign (resid  70 and name C   )   (resid  71 and name N   )
          (resid  71 and name CA  )   (resid  71 and name C   )   1.0   -137.15    56.85   2 
   assign (resid  71 and name N   )   (resid  71 and name CA  )
          (resid  71 and name C   )   (resid  72 and name N   )   1.0    158.90    30.40   2 
   assign (resid  71 and name C   )   (resid  72 and name N   )
          (resid  72 and name CA  )   (resid  72 and name C   )   1.0   -128.50    44.90   2 
   assign (resid  72 and name N   )   (resid  72 and name CA  )
          (resid  72 and name C   )   (resid  73 and name N   )   1.0    141.15    25.95   2 
   assign (resid  72 and name C   )   (resid  73 and name N   )
          (resid  73 and name CA  )   (resid  73 and name C   )   1.0   -125.15    29.25   2 
   assign (resid  73 and name N   )   (resid  73 and name CA  )
          (resid  73 and name C   )   (resid  74 and name N   )   1.0    149.50    20.00   2 
   assign (resid  73 and name C   )   (resid  74 and name N   )
          (resid  74 and name CA  )   (resid  74 and name C   )   1.0   -130.85    47.15   2 
   assign (resid  74 and name N   )   (resid  74 and name CA  )
          (resid  74 and name C   )   (resid  75 and name N   )   1.0    156.95    38.35   2 
   assign (resid  74 and name C   )   (resid  75 and name N   )
          (resid  75 and name CA  )   (resid  75 and name C   )   1.0   -127.55    29.25   2 
   assign (resid  75 and name N   )   (resid  75 and name CA  )
          (resid  75 and name C   )   (resid  76 and name N   )   1.0    144.55    29.15   2 
   assign (resid  75 and name C   )   (resid  76 and name N   )
          (resid  76 and name CA  )   (resid  76 and name C   )   1.0   -127.30    33.10   2 
   assign (resid  76 and name N   )   (resid  76 and name CA  )
          (resid  76 and name C   )   (resid  77 and name N   )   1.0    149.90    26.10   2 
   assign (resid  76 and name C   )   (resid  77 and name N   )
          (resid  77 and name CA  )   (resid  77 and name C   )   1.0   -116.35    44.75   2 
   assign (resid  77 and name N   )   (resid  77 and name CA  )
          (resid  77 and name C   )   (resid  78 and name N   )   1.0    134.50    20.00   2 
   assign (resid  77 and name C   )   (resid  78 and name N   )
          (resid  78 and name CA  )   (resid  78 and name C   )   1.0   -100.40    70.00   2 
   assign (resid  78 and name N   )   (resid  78 and name CA  )
          (resid  78 and name C   )   (resid  79 and name N   )   1.0    151.20    64.80   2 

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           1H       MET   1  12.212   9.046  14.363
    2    H2   MET   1           2H       MET   1  11.094   7.887  14.872
    3    H3   MET   1           3H       MET   1  10.559   9.371  14.271
    4    HA   MET   1           HA       MET   1  11.460   8.877  12.115
    5    HB2  MET   1           2HB      MET   1  12.293   6.588  11.617
    6    HB3  MET   1           3HB      MET   1  13.308   7.413  12.789
    7    HG2  MET   1           2HG      MET   1  12.385   6.096  14.602
    8    HG3  MET   1           3HG      MET   1  11.202   5.361  13.516
    9    HE1  MET   1           3HE      MET   1  12.954   3.512  15.358
   10    HE2  MET   1           1HE      MET   1  13.422   2.281  14.189
   11    HE3  MET   1           2HE      MET   1  11.790   2.948  14.156
   12    H    GLY   2           H        GLY   2   9.946   8.208  10.629
   13    HA2  GLY   2           2HA      GLY   2   7.832   6.325  11.295
   14    HA3  GLY   2           3HA      GLY   2   7.326   8.000  11.102
   15    H    GLU   3           H        GLU   3   8.780   5.238   9.500
   16    HA   GLU   3           HA       GLU   3   7.722   6.094   6.900
   17    HB2  GLU   3           2HB      GLU   3  10.052   6.948   6.935
   18    HB3  GLU   3           3HB      GLU   3  10.660   5.345   7.326
   19    HG2  GLU   3           2HG      GLU   3   9.899   4.505   5.135
   20    HG3  GLU   3           3HG      GLU   3   9.234   6.093   4.741
   21    H    MET   4           H        MET   4   7.072   4.383   5.664
   22    HA   MET   4           HA       MET   4   7.398   1.625   6.698
   23    HB2  MET   4           2HB      MET   4   5.268   2.537   7.540
   24    HB3  MET   4           3HB      MET   4   4.812   3.060   5.921
   25    HG2  MET   4           2HG      MET   4   4.676   0.707   5.215
   26    HG3  MET   4           3HG      MET   4   5.130   0.196   6.846
   27    HE1  MET   4           3HE      MET   4   1.397  -0.796   6.915
   28    HE2  MET   4           1HE      MET   4   3.046  -1.279   7.309
   29    HE3  MET   4           2HE      MET   4   2.573  -1.036   5.625
   30    H    ASP   5           H        ASP   5   7.283  -0.054   5.069
   31    HA   ASP   5           HA       ASP   5   7.333   0.834   2.254
   32    HB2  ASP   5           2HB      ASP   5   8.649  -1.626   3.530
   33    HB3  ASP   5           3HB      ASP   5   8.789  -1.132   1.851
   34    H    ILE   6           H        ILE   6   5.408   0.195   1.319
   35    HA   ILE   6           HA       ILE   6   4.044  -2.269   2.290
   36    HB   ILE   6           HB       ILE   6   2.720   0.130   0.913
   37   HG12  ILE   6          2HG1      ILE   6   2.731  -0.535   3.892
   38   HG13  ILE   6          3HG1      ILE   6   3.620   0.788   3.148
   39   HG21  ILE   6          1HG2      ILE   6   0.604  -0.908   1.663
   40   HG22  ILE   6          2HG2      ILE   6   1.500  -2.255   2.367
   41   HG23  ILE   6          3HG2      ILE   6   1.514  -2.002   0.620
   42   HD11  ILE   6          3HD1      ILE   6   1.641   1.613   4.192
   43   HD12  ILE   6          1HD1      ILE   6   0.630   0.494   3.280
   44   HD13  ILE   6          2HD1      ILE   6   1.492   1.790   2.445
   45    H    ARG   7           H        ARG   7   4.451  -3.833   0.818
   46    HA   ARG   7           HA       ARG   7   4.820  -3.074  -2.025
   47    HB2  ARG   7           2HB      ARG   7   6.909  -3.798  -0.871
   48    HB3  ARG   7           3HB      ARG   7   6.163  -5.349  -0.485
   49    HG2  ARG   7           2HG      ARG   7   5.933  -5.799  -2.930
   50    HG3  ARG   7           3HG      ARG   7   6.760  -4.284  -3.270
   51    HD2  ARG   7           2HD      ARG   7   7.971  -6.581  -1.707
   52    HD3  ARG   7           3HD      ARG   7   8.235  -6.289  -3.424
   53    HE   ARG   7           HE       ARG   7   9.074  -4.418  -1.272
   54   HH11  ARG   7          1HH1      ARG   7   9.670  -5.903  -4.420
   55   HH12  ARG   7          2HH1      ARG   7  11.191  -5.096  -4.639
   56   HH21  ARG   7          1HH2      ARG   7  11.072  -3.388  -1.569
   57   HH22  ARG   7          2HH2      ARG   7  11.993  -3.663  -3.019
   58    H    PHE   8           H        PHE   8   3.381  -3.893  -3.383
   59    HA   PHE   8           HA       PHE   8   1.656  -6.172  -2.623
   60    HB2  PHE   8           2HB      PHE   8   1.226  -3.862  -4.576
   61    HB3  PHE   8           3HB      PHE   8   0.192  -5.284  -4.550
   62    HD1  PHE   8           HD2      PHE   8  -1.374  -5.683  -2.703
   63    HD2  PHE   8           HD1      PHE   8   1.104  -2.195  -2.755
   64    HE1  PHE   8           HE2      PHE   8  -2.777  -4.659  -0.963
   65    HE2  PHE   8           HE1      PHE   8  -0.304  -1.183  -1.013
   66    HZ   PHE   8           HZ       PHE   8  -2.243  -2.406  -0.114
   67    H    ARG   9           H        ARG   9   1.910  -7.996  -3.714
   68    HA   ARG   9           HA       ARG   9   3.174  -8.075  -6.388
   69    HB2  ARG   9           2HB      ARG   9   3.497  -9.916  -3.983
   70    HB3  ARG   9           3HB      ARG   9   3.693 -10.573  -5.602
   71    HG2  ARG   9           2HG      ARG   9   5.452  -8.797  -6.019
   72    HG3  ARG   9           3HG      ARG   9   5.337  -8.371  -4.313
   73    HD2  ARG   9           2HD      ARG   9   6.217 -10.477  -3.615
   74    HD3  ARG   9           3HD      ARG   9   5.962 -11.204  -5.206
   75    HE   ARG   9           HE       ARG   9   7.876  -8.989  -4.904
   76   HH11  ARG   9          1HH1      ARG   9   7.361 -12.401  -5.641
   77   HH12  ARG   9          2HH1      ARG   9   8.955 -12.633  -6.280
   78   HH21  ARG   9          1HH2      ARG   9   9.931  -9.291  -5.807
   79   HH22  ARG   9          2HH2      ARG   9  10.414 -10.858  -6.371
   80    H    GLY  10           H        GLY  10   2.019  -9.121  -7.945
   81    HA2  GLY  10           2HA      GLY  10   0.015 -11.101  -7.520
   82    HA3  GLY  10           3HA      GLY  10  -0.744  -9.522  -7.725
   83    H    ASP  11           H        ASP  11  -0.790 -11.942  -9.438
   84    HA   ASP  11           HA       ASP  11   0.856 -11.605 -11.751
   85    HB2  ASP  11           2HB      ASP  11  -0.154 -13.773 -11.058
   86    HB3  ASP  11           3HB      ASP  11  -1.755 -13.145 -11.404
   87    H    ASP  12           H        ASP  12  -2.132 -10.196 -10.747
   88    HA   ASP  12           HA       ASP  12  -2.720  -9.073 -13.415
   89    HB2  ASP  12           2HB      ASP  12  -4.630 -10.154 -12.270
   90    HB3  ASP  12           3HB      ASP  12  -4.409  -9.112 -10.870
   91    H    LEU  13           H        LEU  13  -1.494  -7.313 -13.726
   92    HA   LEU  13           HA       LEU  13  -0.418  -5.600 -11.771
   93    HB2  LEU  13           2HB      LEU  13   0.528  -5.799 -14.029
   94    HB3  LEU  13           3HB      LEU  13  -0.922  -5.099 -14.726
   95    HG   LEU  13           HG       LEU  13  -0.402  -2.925 -13.584
   96   HD11  LEU  13          1HD1      LEU  13   0.891  -3.737 -11.674
   97   HD12  LEU  13          2HD1      LEU  13   1.796  -2.531 -12.582
   98   HD13  LEU  13          3HD1      LEU  13   2.201  -4.242 -12.747
   99   HD21  LEU  13          3HD2      LEU  13   1.831  -3.956 -15.358
  100   HD22  LEU  13          1HD2      LEU  13   1.441  -2.260 -15.053
  101   HD23  LEU  13          2HD2      LEU  13   0.291  -3.287 -15.906
  102    H    GLU  14           H        GLU  14  -3.545  -5.616 -13.348
  103    HA   GLU  14           HA       GLU  14  -4.302  -2.916 -12.830
  104    HB2  GLU  14           2HB      GLU  14  -6.056  -5.370 -13.264
  105    HB3  GLU  14           3HB      GLU  14  -6.666  -3.720 -13.150
  106    HG2  GLU  14           2HG      GLU  14  -5.154  -3.161 -15.139
  107    HG3  GLU  14           3HG      GLU  14  -4.905  -4.897 -15.313
  108    H    ALA  15           H        ALA  15  -4.687  -5.946 -10.983
  109    HA   ALA  15           HA       ALA  15  -6.233  -4.956  -8.842
  110    HB1  ALA  15           3HB      ALA  15  -5.395  -6.954  -7.623
  111    HB2  ALA  15           1HB      ALA  15  -4.210  -7.226  -8.908
  112    HB3  ALA  15           2HB      ALA  15  -5.936  -7.346  -9.254
  113    H    LEU  16           H        LEU  16  -2.767  -4.991  -9.450
  114    HA   LEU  16           HA       LEU  16  -1.891  -3.970  -6.945
  115    HB2  LEU  16           2HB      LEU  16  -0.515  -3.758  -9.654
  116    HB3  LEU  16           3HB      LEU  16   0.255  -3.572  -8.086
  117    HG   LEU  16           HG       LEU  16  -0.915  -6.156  -9.202
  118   HD11  LEU  16          1HD1      LEU  16   1.412  -6.942  -9.302
  119   HD12  LEU  16          2HD1      LEU  16   1.979  -5.358  -8.766
  120   HD13  LEU  16          3HD1      LEU  16   1.159  -5.524 -10.320
  121   HD21  LEU  16          3HD2      LEU  16  -1.193  -6.076  -6.773
  122   HD22  LEU  16          1HD2      LEU  16   0.522  -5.710  -6.570
  123   HD23  LEU  16          2HD2      LEU  16   0.019  -7.268  -7.230
  124    H    GLU  17           H        GLU  17  -2.988  -2.490  -9.966
  125    HA   GLU  17           HA       GLU  17  -2.162   0.195  -9.456
  126    HB2  GLU  17           2HB      GLU  17  -4.316  -0.905 -11.315
  127    HB3  GLU  17           3HB      GLU  17  -3.856   0.793 -11.268
  128    HG2  GLU  17           2HG      GLU  17  -1.572   0.212 -11.979
  129    HG3  GLU  17           3HG      GLU  17  -2.009  -1.496 -12.025
  130    H    LYS  18           H        LYS  18  -5.246  -1.521  -8.849
  131    HA   LYS  18           HA       LYS  18  -6.607   0.856  -7.923
  132    HB2  LYS  18           2HB      LYS  18  -7.376  -2.086  -7.846
  133    HB3  LYS  18           3HB      LYS  18  -8.346  -0.857  -7.049
  134    HG2  LYS  18           2HG      LYS  18  -9.382  -1.286  -9.145
  135    HG3  LYS  18           3HG      LYS  18  -8.599   0.291  -9.291
  136    HD2  LYS  18           2HD      LYS  18  -6.693  -0.796 -10.461
  137    HD3  LYS  18           3HD      LYS  18  -7.523  -2.351 -10.330
  138    HE2  LYS  18           2HE      LYS  18  -7.792  -1.377 -12.565
  139    HE3  LYS  18           3HE      LYS  18  -9.346  -1.505 -11.740
  140    HZ1  LYS  18           3HZ      LYS  18  -7.725   0.978 -11.879
  141    HZ2  LYS  18           1HZ      LYS  18  -9.291   0.827 -11.261
  142    HZ3  LYS  18           2HZ      LYS  18  -9.009   0.619 -12.917
  143    H    ALA  19           H        ALA  19  -4.919  -1.891  -6.365
  144    HA   ALA  19           HA       ALA  19  -5.382  -1.184  -3.671
  145    HB1  ALA  19           3HB      ALA  19  -2.958  -2.520  -4.917
  146    HB2  ALA  19           1HB      ALA  19  -4.412  -3.341  -4.351
  147    HB3  ALA  19           2HB      ALA  19  -3.357  -2.519  -3.197
  148    H    LEU  20           H        LEU  20  -2.768  -0.331  -5.911
  149    HA   LEU  20           HA       LEU  20  -1.204   1.417  -4.446
  150    HB2  LEU  20           2HB      LEU  20  -0.567   0.612  -6.643
  151    HB3  LEU  20           3HB      LEU  20  -1.957   1.375  -7.388
  152    HG   LEU  20           HG       LEU  20  -0.965   3.609  -6.966
  153   HD11  LEU  20          1HD1      LEU  20   0.322   3.130  -4.951
  154   HD12  LEU  20          2HD1      LEU  20   1.340   3.841  -6.199
  155   HD13  LEU  20          3HD1      LEU  20   1.428   2.107  -5.874
  156   HD21  LEU  20          3HD2      LEU  20  -0.562   2.472  -9.103
  157   HD22  LEU  20          1HD2      LEU  20   0.891   1.712  -8.444
  158   HD23  LEU  20          2HD2      LEU  20   0.815   3.466  -8.641
  159    H    LYS  21           H        LYS  21  -4.006   2.176  -6.484
  160    HA   LYS  21           HA       LYS  21  -3.977   4.971  -6.315
  161    HB2  LYS  21           2HB      LYS  21  -5.179   3.563  -7.996
  162    HB3  LYS  21           3HB      LYS  21  -6.333   3.085  -6.772
  163    HG2  LYS  21           2HG      LYS  21  -6.002   6.007  -7.454
  164    HG3  LYS  21           3HG      LYS  21  -6.915   4.961  -8.531
  165    HD2  LYS  21           2HD      LYS  21  -7.534   5.561  -5.620
  166    HD3  LYS  21           3HD      LYS  21  -8.436   6.110  -7.032
  167    HE2  LYS  21           2HE      LYS  21  -9.011   3.738  -7.556
  168    HE3  LYS  21           3HE      LYS  21  -8.167   3.233  -6.087
  169    HZ1  LYS  21           3HZ      LYS  21 -10.511   3.410  -5.656
  170    HZ2  LYS  21           1HZ      LYS  21 -10.553   5.001  -6.228
  171    HZ3  LYS  21           2HZ      LYS  21  -9.713   4.635  -4.811
  172    H    GLU  22           H        GLU  22  -5.548   2.519  -4.335
  173    HA   GLU  22           HA       GLU  22  -6.850   4.305  -2.546
  174    HB2  GLU  22           2HB      GLU  22  -6.178   1.353  -2.438
  175    HB3  GLU  22           3HB      GLU  22  -6.865   2.170  -1.040
  176    HG2  GLU  22           2HG      GLU  22  -8.151   2.026  -3.779
  177    HG3  GLU  22           3HG      GLU  22  -8.576   1.020  -2.395
  178    H    MET  23           H        MET  23  -3.694   2.517  -2.295
  179    HA   MET  23           HA       MET  23  -3.210   3.357   0.385
  180    HB2  MET  23           2HB      MET  23  -1.169   2.430  -1.682
  181    HB3  MET  23           3HB      MET  23  -0.870   2.588   0.048
  182    HG2  MET  23           2HG      MET  23  -2.729   0.647  -1.316
  183    HG3  MET  23           3HG      MET  23  -1.254   0.275  -0.434
  184    HE1  MET  23           3HE      MET  23  -2.437   0.982   3.287
  185    HE2  MET  23           1HE      MET  23  -1.616   2.123   2.221
  186    HE3  MET  23           2HE      MET  23  -1.100   0.436   2.270
  187    H    ILE  24           H        ILE  24  -2.459   4.902  -2.692
  188    HA   ILE  24           HA       ILE  24  -0.872   7.042  -1.672
  189    HB   ILE  24           HB       ILE  24  -2.666   6.945  -4.151
  190   HG12  ILE  24          2HG1      ILE  24   0.358   6.582  -3.879
  191   HG13  ILE  24          3HG1      ILE  24  -0.801   5.304  -4.220
  192   HG21  ILE  24          1HG2      ILE  24  -0.563   9.023  -3.442
  193   HG22  ILE  24          2HG2      ILE  24  -2.307   9.287  -3.488
  194   HG23  ILE  24          3HG2      ILE  24  -1.430   8.927  -4.975
  195   HD11  ILE  24          3HD1      ILE  24  -1.325   6.343  -6.366
  196   HD12  ILE  24          1HD1      ILE  24   0.392   5.976  -6.216
  197   HD13  ILE  24          2HD1      ILE  24  -0.170   7.636  -6.027
  198    H    ARG  25           H        ARG  25  -4.355   6.712  -2.384
  199    HA   ARG  25           HA       ARG  25  -5.374   9.147  -1.518
  200    HB2  ARG  25           2HB      ARG  25  -6.759   7.565  -2.717
  201    HB3  ARG  25           3HB      ARG  25  -6.533   6.337  -1.485
  202    HG2  ARG  25           2HG      ARG  25  -7.871   7.808   0.097
  203    HG3  ARG  25           3HG      ARG  25  -8.231   8.840  -1.289
  204    HD2  ARG  25           2HD      ARG  25  -9.290   6.926  -2.447
  205    HD3  ARG  25           3HD      ARG  25  -8.908   5.884  -1.069
  206    HE   ARG  25           HE       ARG  25 -10.467   8.176  -0.317
  207   HH11  ARG  25          1HH1      ARG  25 -10.763   4.912  -1.653
  208   HH12  ARG  25          2HH1      ARG  25 -12.410   4.729  -1.136
  209   HH21  ARG  25          1HH2      ARG  25 -12.626   7.910   0.352
  210   HH22  ARG  25          2HH2      ARG  25 -13.465   6.432   0.000
  211    H    GLN  26           H        GLN  26  -4.499   6.286   0.398
  212    HA   GLN  26           HA       GLN  26  -5.684   7.229   2.849
  213    HB2  GLN  26           2HB      GLN  26  -3.553   5.069   2.693
  214    HB3  GLN  26           3HB      GLN  26  -4.798   5.275   3.911
  215    HG2  GLN  26           2HG      GLN  26  -5.036   4.134   1.139
  216    HG3  GLN  26           3HG      GLN  26  -5.456   3.390   2.671
  217   HE21  GLN  26          1HE2      GLN  26  -7.038   3.616   0.247
  218   HE22  GLN  26          2HE2      GLN  26  -8.498   4.435   0.668
  219    H    ALA  27           H        ALA  27  -2.374   7.065   1.519
  220    HA   ALA  27           HA       ALA  27  -0.983   8.268   3.657
  221    HB1  ALA  27           3HB      ALA  27   0.144   7.097   1.813
  222    HB2  ALA  27           1HB      ALA  27   0.785   8.728   2.000
  223    HB3  ALA  27           2HB      ALA  27  -0.340   8.365   0.686
  224    H    ARG  28           H        ARG  28  -2.905   9.641   1.066
  225    HA   ARG  28           HA       ARG  28  -2.123  12.380   1.429
  226    HB2  ARG  28           2HB      ARG  28  -4.494  11.135  -0.025
  227    HB3  ARG  28           3HB      ARG  28  -4.150  12.863  -0.028
  228    HG2  ARG  28           2HG      ARG  28  -1.981  12.428  -1.148
  229    HG3  ARG  28           3HG      ARG  28  -2.338  10.701  -1.154
  230    HD2  ARG  28           2HD      ARG  28  -2.842  11.650  -3.340
  231    HD3  ARG  28           3HD      ARG  28  -4.344  11.139  -2.567
  232    HE   ARG  28           HE       ARG  28  -4.111  13.781  -1.898
  233   HH11  ARG  28          1HH1      ARG  28  -4.149  12.099  -4.999
  234   HH12  ARG  28          2HH1      ARG  28  -4.845  13.439  -5.849
  235   HH21  ARG  28          1HH2      ARG  28  -5.012  15.517  -3.015
  236   HH22  ARG  28          2HH2      ARG  28  -5.337  15.389  -4.718
  237    H    LYS  29           H        LYS  29  -4.842  10.364   2.621
  238    HA   LYS  29           HA       LYS  29  -6.287  12.563   3.787
  239    HB2  LYS  29           2HB      LYS  29  -7.836  10.967   4.651
  240    HB3  LYS  29           3HB      LYS  29  -7.314  10.308   3.107
  241    HG2  LYS  29           2HG      LYS  29  -5.740   8.812   4.318
  242    HG3  LYS  29           3HG      LYS  29  -6.358   9.431   5.845
  243    HD2  LYS  29           2HD      LYS  29  -8.613   8.546   5.260
  244    HD3  LYS  29           3HD      LYS  29  -7.950   7.896   3.754
  245    HE2  LYS  29           2HE      LYS  29  -6.374   6.498   5.090
  246    HE3  LYS  29           3HE      LYS  29  -7.125   7.099   6.570
  247    HZ1  LYS  29           3HZ      LYS  29  -7.980   4.944   5.929
  248    HZ2  LYS  29           1HZ      LYS  29  -8.487   5.548   4.437
  249    HZ3  LYS  29           2HZ      LYS  29  -9.210   6.100   5.860
  250    H    PHE  30           H        PHE  30  -3.844  10.299   4.940
  251    HA   PHE  30           HA       PHE  30  -3.850  11.226   7.685
  252    HB2  PHE  30           2HB      PHE  30  -1.937   9.446   6.112
  253    HB3  PHE  30           3HB      PHE  30  -1.717   9.825   7.818
  254    HD1  PHE  30           HD1      PHE  30  -4.346   9.574   8.999
  255    HD2  PHE  30           HD2      PHE  30  -2.549   7.177   5.949
  256    HE1  PHE  30           HE1      PHE  30  -5.732   7.659   9.670
  257    HE2  PHE  30           HE2      PHE  30  -3.947   5.266   6.630
  258    HZ   PHE  30           HZ       PHE  30  -5.537   5.511   8.492
  259    H    ALA  31           H        ALA  31  -2.767  12.548   4.831
  260    HA   ALA  31           HA       ALA  31  -1.369  14.144   4.146
  261    HB1  ALA  31           3HB      ALA  31  -2.673  15.481   5.743
  262    HB2  ALA  31           1HB      ALA  31  -1.013  16.065   5.604
  263    HB3  ALA  31           2HB      ALA  31  -1.502  15.119   7.011
  264    H    GLY  32           H        GLY  32   0.153  12.469   3.757
  265    HA2  GLY  32           2HA      GLY  32   2.735  12.951   5.104
  266    HA3  GLY  32           3HA      GLY  32   2.157  11.297   4.895
  267    H    THR  33           H        THR  33   4.306  11.260   3.694
  268    HA   THR  33           HA       THR  33   4.172  12.328   0.950
  269    HB   THR  33           HB       THR  33   6.502  11.176   2.564
  270    HG1  THR  33           HG1      THR  33   5.539  13.770   2.111
  271   HG21  THR  33          3HG2      THR  33   6.537  12.432  -0.209
  272   HG22  THR  33          1HG2      THR  33   6.846  10.733   0.159
  273   HG23  THR  33          2HG2      THR  33   7.962  11.978   0.726
  274    H    VAL  34           H        VAL  34   4.151  10.826  -0.809
  275    HA   VAL  34           HA       VAL  34   4.246   7.957  -0.188
  276    HB   VAL  34           HB       VAL  34   1.875   8.550  -0.099
  277   HG11  VAL  34          1HG1      VAL  34   2.128   9.610  -2.927
  278   HG12  VAL  34          2HG1      VAL  34   1.864  10.573  -1.473
  279   HG13  VAL  34          3HG1      VAL  34   0.624   9.439  -2.014
  280   HG21  VAL  34          3HG2      VAL  34   2.446   6.338  -0.974
  281   HG22  VAL  34          1HG2      VAL  34   2.529   6.979  -2.618
  282   HG23  VAL  34          2HG2      VAL  34   0.988   6.948  -1.757
  283    H    THR  35           H        THR  35   5.417   6.895  -1.572
  284    HA   THR  35           HA       THR  35   5.949   7.845  -4.332
  285    HB   THR  35           HB       THR  35   8.010   6.603  -2.419
  286    HG1  THR  35           HG1      THR  35   7.403   9.285  -3.067
  287   HG21  THR  35          3HG2      THR  35   8.498   6.127  -4.808
  288   HG22  THR  35          1HG2      THR  35   9.684   7.234  -4.113
  289   HG23  THR  35          2HG2      THR  35   8.414   7.853  -5.168
  290    H    TYR  36           H        TYR  36   6.424   5.966  -5.807
  291    HA   TYR  36           HA       TYR  36   6.068   3.274  -4.758
  292    HB2  TYR  36           2HB      TYR  36   4.123   2.699  -6.124
  293    HB3  TYR  36           3HB      TYR  36   3.729   4.011  -5.027
  294    HD1  TYR  36           HD2      TYR  36   3.537   6.373  -5.946
  295    HD2  TYR  36           HD1      TYR  36   3.878   2.966  -8.506
  296    HE1  TYR  36           HE2      TYR  36   2.673   7.697  -7.822
  297    HE2  TYR  36           HE1      TYR  36   3.008   4.294 -10.380
  298    HH   TYR  36           HH       TYR  36   1.746   6.265 -10.823
  299    H    THR  37           H        THR  37   6.694   1.628  -6.147
  300    HA   THR  37           HA       THR  37   7.895   2.392  -8.751
  301    HB   THR  37           HB       THR  37   8.993   0.276  -6.838
  302    HG1  THR  37           HG1      THR  37   9.772   2.988  -7.284
  303   HG21  THR  37          3HG2      THR  37   9.568  -0.141  -9.211
  304   HG22  THR  37          1HG2      THR  37  10.995   0.341  -8.291
  305   HG23  THR  37          2HG2      THR  37  10.198   1.502  -9.354
  306    H    LEU  38           H        LEU  38   6.258   1.654 -10.075
  307    HA   LEU  38           HA       LEU  38   5.230  -1.071  -9.942
  308    HB2  LEU  38           2HB      LEU  38   4.814   1.249 -11.872
  309    HB3  LEU  38           3HB      LEU  38   4.189  -0.352 -12.228
  310    HG   LEU  38           HG       LEU  38   3.408   1.296  -9.791
  311   HD11  LEU  38          1HD1      LEU  38   1.241   1.614 -10.923
  312   HD12  LEU  38          2HD1      LEU  38   1.874   0.824 -12.369
  313   HD13  LEU  38          3HD1      LEU  38   2.566   2.353 -11.820
  314   HD21  LEU  38          3HD2      LEU  38   2.290  -1.323 -10.843
  315   HD22  LEU  38          1HD2      LEU  38   1.634  -0.387  -9.495
  316   HD23  LEU  38          2HD2      LEU  38   3.242  -1.101  -9.368
  317    H    ASP  39           H        ASP  39   6.575  -2.672 -10.574
  318    HA   ASP  39           HA       ASP  39   8.021  -2.450 -13.122
  319    HB2  ASP  39           2HB      ASP  39   9.564  -1.822 -11.155
  320    HB3  ASP  39           3HB      ASP  39   9.406  -3.485 -10.607
  321    H    GLY  40           H        GLY  40   6.705  -3.906 -14.092
  322    HA2  GLY  40           2HA      GLY  40   6.047  -5.955 -14.849
  323    HA3  GLY  40           3HA      GLY  40   7.091  -6.707 -13.660
  324    H    ASN  41           H        ASN  41   6.195  -7.525 -11.822
  325    HA   ASN  41           HA       ASN  41   3.311  -7.095 -11.271
  326    HB2  ASN  41           2HB      ASN  41   4.862  -9.721 -11.182
  327    HB3  ASN  41           3HB      ASN  41   3.234  -9.513 -10.534
  328   HD21  ASN  41          1HD2      ASN  41   1.519  -9.146 -11.989
  329   HD22  ASN  41          2HD2      ASN  41   1.640  -9.556 -13.656
  330    H    ASP  42           H        ASP  42   6.102  -6.198 -10.202
  331    HA   ASP  42           HA       ASP  42   5.471  -6.566  -7.328
  332    HB2  ASP  42           2HB      ASP  42   7.685  -7.535  -8.039
  333    HB3  ASP  42           3HB      ASP  42   8.180  -5.949  -8.594
  334    H    LEU  43           H        LEU  43   4.905  -4.792  -6.284
  335    HA   LEU  43           HA       LEU  43   5.554  -2.073  -7.269
  336    HB2  LEU  43           2HB      LEU  43   3.239  -2.354  -7.825
  337    HB3  LEU  43           3HB      LEU  43   2.910  -3.270  -6.365
  338    HG   LEU  43           HG       LEU  43   3.188  -1.156  -5.022
  339   HD11  LEU  43          1HD1      LEU  43   3.104   1.028  -6.150
  340   HD12  LEU  43          2HD1      LEU  43   3.325   0.228  -7.706
  341   HD13  LEU  43          3HD1      LEU  43   4.598   0.154  -6.488
  342   HD21  LEU  43          3HD2      LEU  43   1.000  -0.239  -5.565
  343   HD22  LEU  43          1HD2      LEU  43   0.973  -2.000  -5.661
  344   HD23  LEU  43          2HD2      LEU  43   1.028  -1.038  -7.141
  345    H    GLU  44           H        GLU  44   6.800  -1.090  -5.654
  346    HA   GLU  44           HA       GLU  44   5.948  -1.604  -2.843
  347    HB2  GLU  44           2HB      GLU  44   8.241  -2.392  -3.127
  348    HB3  GLU  44           3HB      GLU  44   8.755  -0.817  -3.731
  349    HG2  GLU  44           2HG      GLU  44   8.415   0.229  -1.597
  350    HG3  GLU  44           3HG      GLU  44   7.527  -1.152  -0.964
  351    H    ILE  45           H        ILE  45   4.866  -0.095  -2.071
  352    HA   ILE  45           HA       ILE  45   4.992   2.734  -2.866
  353    HB   ILE  45           HB       ILE  45   3.063   1.322  -0.941
  354   HG12  ILE  45          2HG1      ILE  45   2.570   1.918  -3.895
  355   HG13  ILE  45          3HG1      ILE  45   3.025   0.337  -3.275
  356   HG21  ILE  45          1HG2      ILE  45   1.570   3.243  -1.321
  357   HG22  ILE  45          2HG2      ILE  45   2.772   3.990  -2.376
  358   HG23  ILE  45          3HG2      ILE  45   3.120   3.772  -0.659
  359   HD11  ILE  45          3HD1      ILE  45   0.490   1.832  -2.627
  360   HD12  ILE  45          1HD1      ILE  45   0.958   0.263  -1.961
  361   HD13  ILE  45          2HD1      ILE  45   0.665   0.438  -3.690
  362    H    ARG  46           H        ARG  46   6.309   4.066  -1.619
  363    HA   ARG  46           HA       ARG  46   7.051   3.239   1.116
  364    HB2  ARG  46           2HB      ARG  46   8.494   5.262  -0.658
  365    HB3  ARG  46           3HB      ARG  46   9.046   4.590   0.870
  366    HG2  ARG  46           2HG      ARG  46   8.826   2.282  -0.537
  367    HG3  ARG  46           3HG      ARG  46   9.113   3.399  -1.871
  368    HD2  ARG  46           2HD      ARG  46  11.240   2.517  -1.168
  369    HD3  ARG  46           3HD      ARG  46  11.166   4.208  -0.652
  370    HE   ARG  46           HE       ARG  46  10.689   1.887   1.125
  371   HH11  ARG  46          1HH1      ARG  46  11.960   5.168   0.727
  372   HH12  ARG  46          2HH1      ARG  46  12.497   5.264   2.379
  373   HH21  ARG  46          1HH2      ARG  46  11.363   2.053   3.256
  374   HH22  ARG  46          2HH2      ARG  46  12.158   3.502   3.808
  375    H    ILE  47           H        ILE  47   5.722   4.220   2.525
  376    HA   ILE  47           HA       ILE  47   4.801   6.989   2.040
  377    HB   ILE  47           HB       ILE  47   3.629   4.935   3.978
  378   HG12  ILE  47          2HG1      ILE  47   2.636   5.852   1.232
  379   HG13  ILE  47          3HG1      ILE  47   3.275   4.260   1.615
  380   HG21  ILE  47          1HG2      ILE  47   3.277   7.282   4.708
  381   HG22  ILE  47          2HG2      ILE  47   1.759   6.525   4.230
  382   HG23  ILE  47          3HG2      ILE  47   2.556   7.662   3.141
  383   HD11  ILE  47          3HD1      ILE  47   0.882   4.192   1.421
  384   HD12  ILE  47          1HD1      ILE  47   0.703   5.443   2.653
  385   HD13  ILE  47          2HD1      ILE  47   1.353   3.860   3.087
  386    H    THR  48           H        THR  48   5.867   8.506   3.085
  387    HA   THR  48           HA       THR  48   7.553   7.869   5.432
  388    HB   THR  48           HB       THR  48   7.935  10.041   3.309
  389    HG1  THR  48           HG1      THR  48   9.467   7.656   3.501
  390   HG21  THR  48          3HG2      THR  48   9.931   8.977   5.351
  391   HG22  THR  48          1HG2      THR  48   9.076  10.516   5.484
  392   HG23  THR  48          2HG2      THR  48  10.215  10.251   4.164
  393    H    GLY  49           H        GLY  49   7.666   9.458   7.109
  394    HA2  GLY  49           2HA      GLY  49   7.260  11.499   8.176
  395    HA3  GLY  49           3HA      GLY  49   6.040  11.899   6.982
  396    H    VAL  50           H        VAL  50   4.615   9.357   7.247
  397    HA   VAL  50           HA       VAL  50   2.858  10.006   9.381
  398    HB   VAL  50           HB       VAL  50   1.696   7.857   8.829
  399   HG11  VAL  50          1HG1      VAL  50   2.401   9.546   6.391
  400   HG12  VAL  50          2HG1      VAL  50   1.139   9.898   7.574
  401   HG13  VAL  50          3HG1      VAL  50   0.999   8.479   6.538
  402   HG21  VAL  50          3HG2      VAL  50   2.458   6.449   6.948
  403   HG22  VAL  50          1HG2      VAL  50   3.648   6.460   8.251
  404   HG23  VAL  50          2HG2      VAL  50   3.925   7.420   6.798
  405    HA   PRO  51           HA       PRO  51   5.303   8.091  12.690
  406    HB2  PRO  51           2HB      PRO  51   3.468   8.271  14.731
  407    HB3  PRO  51           3HB      PRO  51   4.344   9.681  14.105
  408    HG2  PRO  51           2HG      PRO  51   1.572   8.750  13.432
  409    HG3  PRO  51           3HG      PRO  51   2.139  10.389  13.826
  410    HD2  PRO  51           2HD      PRO  51   1.730   9.617  11.267
  411    HD3  PRO  51           3HD      PRO  51   3.051  10.731  11.701
  412    H    GLU  52           H        GLU  52   5.021   6.300  14.398
  413    HA   GLU  52           HA       GLU  52   4.620   3.899  13.040
  414    HB2  GLU  52           2HB      GLU  52   6.157   4.095  14.926
  415    HB3  GLU  52           3HB      GLU  52   4.829   4.444  16.025
  416    HG2  GLU  52           2HG      GLU  52   5.671   2.157  16.313
  417    HG3  GLU  52           3HG      GLU  52   3.989   2.173  15.800
  418    H    GLN  53           H        GLN  53   2.494   5.471  15.436
  419    HA   GLN  53           HA       GLN  53   0.453   3.612  15.646
  420    HB2  GLN  53           2HB      GLN  53  -1.045   5.576  16.173
  421    HB3  GLN  53           3HB      GLN  53   0.460   5.534  17.084
  422    HG2  GLN  53           2HG      GLN  53   1.432   7.256  15.666
  423    HG3  GLN  53           3HG      GLN  53   0.012   7.244  14.621
  424   HE21  GLN  53          1HE2      GLN  53  -1.881   8.281  15.327
  425   HE22  GLN  53          2HE2      GLN  53  -1.904   9.350  16.681
  426    H    VAL  54           H        VAL  54   0.915   6.032  13.095
  427    HA   VAL  54           HA       VAL  54  -1.574   5.480  11.735
  428    HB   VAL  54           HB       VAL  54   0.849   7.143  10.902
  429   HG11  VAL  54          1HG1      VAL  54  -0.639   8.196   9.229
  430   HG12  VAL  54          2HG1      VAL  54  -1.907   7.035   9.626
  431   HG13  VAL  54          3HG1      VAL  54  -0.395   6.479   8.908
  432   HG21  VAL  54          3HG2      VAL  54  -0.502   9.093  11.531
  433   HG22  VAL  54          1HG2      VAL  54  -0.279   8.011  12.908
  434   HG23  VAL  54          2HG2      VAL  54  -1.820   8.034  12.045
  435    H    ARG  55           H        ARG  55   1.827   4.577  11.363
  436    HA   ARG  55           HA       ARG  55   1.767   3.410   8.800
  437    HB2  ARG  55           2HB      ARG  55   3.537   2.878  11.221
  438    HB3  ARG  55           3HB      ARG  55   3.826   2.144   9.645
  439    HG2  ARG  55           2HG      ARG  55   4.335   4.225   8.629
  440    HG3  ARG  55           3HG      ARG  55   3.649   5.144   9.973
  441    HD2  ARG  55           2HD      ARG  55   6.094   5.232   9.994
  442    HD3  ARG  55           3HD      ARG  55   5.473   4.421  11.431
  443    HE   ARG  55           HE       ARG  55   6.383   2.801   9.157
  444   HH11  ARG  55          1HH1      ARG  55   6.930   3.887  12.457
  445   HH12  ARG  55          2HH1      ARG  55   8.126   2.678  12.782
  446   HH21  ARG  55          1HH2      ARG  55   8.004   1.272   9.582
  447   HH22  ARG  55          2HH2      ARG  55   8.732   1.209  11.155
  448    H    LYS  56           H        LYS  56   0.963   2.112  11.989
  449    HA   LYS  56           HA       LYS  56   0.478  -0.572  11.301
  450    HB2  LYS  56           2HB      LYS  56  -0.997   1.134  13.356
  451    HB3  LYS  56           3HB      LYS  56  -1.000  -0.631  13.295
  452    HG2  LYS  56           2HG      LYS  56   1.444  -0.638  13.688
  453    HG3  LYS  56           3HG      LYS  56   1.420   1.123  13.786
  454    HD2  LYS  56           2HD      LYS  56  -0.181   0.913  15.735
  455    HD3  LYS  56           3HD      LYS  56   0.081  -0.837  15.683
  456    HE2  LYS  56           2HE      LYS  56   2.116   1.327  16.271
  457    HE3  LYS  56           3HE      LYS  56   1.555   0.051  17.349
  458    HZ1  LYS  56           3HZ      LYS  56   3.239  -0.272  14.924
  459    HZ2  LYS  56           1HZ      LYS  56   2.583  -1.561  15.798
  460    HZ3  LYS  56           2HZ      LYS  56   3.699  -0.528  16.531
  461    H    GLU  57           H        GLU  57  -1.620   2.293  11.152
  462    HA   GLU  57           HA       GLU  57  -4.015   0.951  10.447
  463    HB2  GLU  57           2HB      GLU  57  -3.279   3.863   9.905
  464    HB3  GLU  57           3HB      GLU  57  -4.902   3.187   9.957
  465    HG2  GLU  57           2HG      GLU  57  -2.982   3.419  12.283
  466    HG3  GLU  57           3HG      GLU  57  -4.424   4.389  12.020
  467    H    LEU  58           H        LEU  58  -1.435   2.442   8.484
  468    HA   LEU  58           HA       LEU  58  -2.535   1.962   5.924
  469    HB2  LEU  58           2HB      LEU  58   0.308   2.309   6.905
  470    HB3  LEU  58           3HB      LEU  58   0.022   1.818   5.251
  471    HG   LEU  58           HG       LEU  58   0.376   4.133   5.128
  472   HD11  LEU  58          1HD1      LEU  58  -1.725   5.116   4.345
  473   HD12  LEU  58          2HD1      LEU  58  -2.632   3.789   5.075
  474   HD13  LEU  58          3HD1      LEU  58  -1.502   3.471   3.757
  475   HD21  LEU  58          3HD2      LEU  58  -0.710   5.837   6.501
  476   HD22  LEU  58          1HD2      LEU  58   0.223   4.707   7.478
  477   HD23  LEU  58          2HD2      LEU  58  -1.537   4.582   7.427
  478    H    ALA  59           H        ALA  59  -0.875  -0.182   8.181
  479    HA   ALA  59           HA       ALA  59  -0.408  -2.338   6.373
  480    HB1  ALA  59           3HB      ALA  59   0.029  -3.671   8.383
  481    HB2  ALA  59           1HB      ALA  59  -0.645  -2.392   9.400
  482    HB3  ALA  59           2HB      ALA  59   0.832  -2.106   8.481
  483    H    LYS  60           H        LYS  60  -3.105  -1.522   8.572
  484    HA   LYS  60           HA       LYS  60  -4.648  -3.884   8.177
  485    HB2  LYS  60           2HB      LYS  60  -5.431  -1.071   9.028
  486    HB3  LYS  60           3HB      LYS  60  -6.652  -2.312   8.796
  487    HG2  LYS  60           2HG      LYS  60  -6.171  -2.114  11.145
  488    HG3  LYS  60           3HG      LYS  60  -5.561  -3.674  10.583
  489    HD2  LYS  60           2HD      LYS  60  -3.291  -2.866  10.591
  490    HD3  LYS  60           3HD      LYS  60  -3.826  -1.207  10.863
  491    HE2  LYS  60           2HE      LYS  60  -4.160  -3.478  12.841
  492    HE3  LYS  60           3HE      LYS  60  -2.879  -2.269  12.890
  493    HZ1  LYS  60           3HZ      LYS  60  -4.684  -1.726  14.395
  494    HZ2  LYS  60           1HZ      LYS  60  -5.787  -1.687  13.114
  495    HZ3  LYS  60           2HZ      LYS  60  -4.538  -0.550  13.191
  496    H    GLU  61           H        GLU  61  -4.422  -0.803   6.448
  497    HA   GLU  61           HA       GLU  61  -6.584  -1.336   4.627
  498    HB2  GLU  61           2HB      GLU  61  -4.383   0.775   4.517
  499    HB3  GLU  61           3HB      GLU  61  -5.814   0.736   3.480
  500    HG2  GLU  61           2HG      GLU  61  -7.255   0.871   5.520
  501    HG3  GLU  61           3HG      GLU  61  -5.798   1.013   6.494
  502    H    ALA  62           H        ALA  62  -3.070  -1.725   4.519
  503    HA   ALA  62           HA       ALA  62  -2.720  -2.579   1.883
  504    HB1  ALA  62           3HB      ALA  62  -0.857  -2.137   3.439
  505    HB2  ALA  62           1HB      ALA  62  -0.713  -3.741   2.728
  506    HB3  ALA  62           2HB      ALA  62  -1.288  -3.564   4.386
  507    H    GLU  63           H        GLU  63  -3.652  -4.390   4.786
  508    HA   GLU  63           HA       GLU  63  -3.852  -6.961   3.586
  509    HB2  GLU  63           2HB      GLU  63  -4.932  -5.836   6.199
  510    HB3  GLU  63           3HB      GLU  63  -5.033  -7.538   5.759
  511    HG2  GLU  63           2HG      GLU  63  -2.604  -7.735   5.735
  512    HG3  GLU  63           3HG      GLU  63  -2.428  -6.004   6.013
  513    H    ARG  64           H        ARG  64  -6.267  -4.374   4.171
  514    HA   ARG  64           HA       ARG  64  -8.526  -6.010   3.567
  515    HB2  ARG  64           2HB      ARG  64  -9.892  -4.071   3.679
  516    HB3  ARG  64           3HB      ARG  64  -8.628  -3.817   4.870
  517    HG2  ARG  64           2HG      ARG  64  -7.477  -2.289   3.326
  518    HG3  ARG  64           3HG      ARG  64  -8.726  -2.554   2.116
  519    HD2  ARG  64           2HD      ARG  64  -9.225  -1.349   4.864
  520    HD3  ARG  64           3HD      ARG  64  -8.984  -0.410   3.387
  521    HE   ARG  64           HE       ARG  64 -11.123  -2.345   3.183
  522   HH11  ARG  64          1HH1      ARG  64 -10.357   0.953   4.213
  523   HH12  ARG  64          2HH1      ARG  64 -11.997   1.500   4.059
  524   HH21  ARG  64          1HH2      ARG  64 -13.253  -1.599   2.986
  525   HH22  ARG  64          2HH2      ARG  64 -13.641   0.050   3.362
  526    H    LEU  65           H        LEU  65  -6.352  -4.023   1.631
  527    HA   LEU  65           HA       LEU  65  -7.833  -4.333  -0.846
  528    HB2  LEU  65           2HB      LEU  65  -4.971  -3.416  -0.345
  529    HB3  LEU  65           3HB      LEU  65  -5.827  -3.283  -1.877
  530    HG   LEU  65           HG       LEU  65  -6.675  -1.875   0.684
  531   HD11  LEU  65          1HD1      LEU  65  -4.526  -1.022  -0.123
  532   HD12  LEU  65          2HD1      LEU  65  -5.807   0.173  -0.287
  533   HD13  LEU  65          3HD1      LEU  65  -5.234  -0.704  -1.709
  534   HD21  LEU  65          3HD2      LEU  65  -8.562  -2.300  -0.812
  535   HD22  LEU  65          1HD2      LEU  65  -7.696  -1.543  -2.154
  536   HD23  LEU  65          2HD2      LEU  65  -8.182  -0.581  -0.755
  537    H    ALA  66           H        ALA  66  -5.264  -6.048   0.825
  538    HA   ALA  66           HA       ALA  66  -4.355  -7.699  -1.281
  539    HB1  ALA  66           3HB      ALA  66  -3.157  -7.450   0.859
  540    HB2  ALA  66           1HB      ALA  66  -3.448  -9.146   0.470
  541    HB3  ALA  66           2HB      ALA  66  -4.440  -8.334   1.687
  542    H    LYS  67           H        LYS  67  -6.921  -8.232   1.165
  543    HA   LYS  67           HA       LYS  67  -7.771 -10.743  -0.013
  544    HB2  LYS  67           2HB      LYS  67  -9.509 -10.743   1.735
  545    HB3  LYS  67           3HB      LYS  67  -7.926 -10.398   2.421
  546    HG2  LYS  67           2HG      LYS  67  -8.487  -7.984   2.473
  547    HG3  LYS  67           3HG      LYS  67 -10.089  -8.351   1.843
  548    HD2  LYS  67           2HD      LYS  67  -8.975  -9.322   4.506
  549    HD3  LYS  67           3HD      LYS  67 -10.107  -7.990   4.295
  550    HE2  LYS  67           2HE      LYS  67 -11.728  -9.640   3.277
  551    HE3  LYS  67           3HE      LYS  67 -10.616 -10.928   3.741
  552    HZ1  LYS  67           3HZ      LYS  67 -11.911  -9.010   5.614
  553    HZ2  LYS  67           1HZ      LYS  67 -10.865 -10.260   6.054
  554    HZ3  LYS  67           2HZ      LYS  67 -12.376 -10.621   5.386
  555    H    GLU  68           H        GLU  68  -8.532  -7.400  -0.498
  556    HA   GLU  68           HA       GLU  68 -11.154  -7.654  -1.621
  557    HB2  GLU  68           2HB      GLU  68 -10.174  -5.501  -0.778
  558    HB3  GLU  68           3HB      GLU  68  -9.038  -5.510  -2.120
  559    HG2  GLU  68           2HG      GLU  68 -10.808  -3.954  -2.604
  560    HG3  GLU  68           3HG      GLU  68 -10.956  -5.325  -3.696
  561    H    PHE  69           H        PHE  69  -7.914  -7.303  -3.046
  562    HA   PHE  69           HA       PHE  69  -8.936  -7.934  -5.739
  563    HB2  PHE  69           2HB      PHE  69  -6.225  -6.785  -4.919
  564    HB3  PHE  69           3HB      PHE  69  -6.865  -6.899  -6.555
  565    HD1  PHE  69           HD1      PHE  69  -9.328  -5.716  -6.797
  566    HD2  PHE  69           HD2      PHE  69  -6.328  -4.654  -3.939
  567    HE1  PHE  69           HE1      PHE  69 -10.355  -3.499  -6.524
  568    HE2  PHE  69           HE2      PHE  69  -7.364  -2.437  -3.680
  569    HZ   PHE  69           HZ       PHE  69  -9.380  -1.862  -4.966
  570    H    ASN  70           H        ASN  70  -7.818  -9.668  -3.245
  571    HA   ASN  70           HA       ASN  70  -6.906 -11.690  -2.885
  572    HB2  ASN  70           2HB      ASN  70  -8.747 -12.264  -4.549
  573    HB3  ASN  70           3HB      ASN  70  -7.518 -12.293  -5.814
  574   HD21  ASN  70          1HD2      ASN  70  -7.981 -14.496  -6.226
  575   HD22  ASN  70          2HD2      ASN  70  -7.471 -15.761  -5.170
  576    H    ILE  71           H        ILE  71  -5.118  -9.642  -3.504
  577    HA   ILE  71           HA       ILE  71  -2.842 -11.000  -4.842
  578    HB   ILE  71           HB       ILE  71  -1.784  -8.692  -4.925
  579   HG12  ILE  71          2HG1      ILE  71  -4.571  -7.777  -4.064
  580   HG13  ILE  71          3HG1      ILE  71  -3.081  -7.574  -3.153
  581   HG21  ILE  71          1HG2      ILE  71  -4.397  -8.986  -6.446
  582   HG22  ILE  71          2HG2      ILE  71  -2.840  -9.676  -6.914
  583   HG23  ILE  71          3HG2      ILE  71  -3.055  -7.926  -6.884
  584   HD11  ILE  71          3HD1      ILE  71  -3.802  -6.218  -5.749
  585   HD12  ILE  71          1HD1      ILE  71  -2.247  -6.060  -4.922
  586   HD13  ILE  71          2HD1      ILE  71  -3.724  -5.492  -4.145
  587    H    THR  72           H        THR  72  -0.732 -10.790  -3.819
  588    HA   THR  72           HA       THR  72  -0.915 -11.129  -0.912
  589    HB   THR  72           HB       THR  72   1.593 -11.844  -1.299
  590    HG1  THR  72           HG1      THR  72   1.350 -10.925  -3.583
  591   HG21  THR  72          3HG2      THR  72  -0.638 -13.529  -2.498
  592   HG22  THR  72          1HG2      THR  72  -0.187 -13.475  -0.791
  593   HG23  THR  72          2HG2      THR  72   0.941 -14.123  -1.982
  594    H    VAL  73           H        VAL  73  -0.587  -9.330   0.320
  595    HA   VAL  73           HA       VAL  73   1.421  -7.338  -0.556
  596    HB   VAL  73           HB       VAL  73  -0.875  -6.527   0.181
  597   HG11  VAL  73          1HG1      VAL  73  -1.384  -6.323   2.581
  598   HG12  VAL  73          2HG1      VAL  73   0.051  -7.271   2.974
  599   HG13  VAL  73          3HG1      VAL  73  -1.280  -8.017   2.089
  600   HG21  VAL  73          3HG2      VAL  73   1.115  -5.051   0.071
  601   HG22  VAL  73          1HG2      VAL  73   1.469  -5.409   1.763
  602   HG23  VAL  73          2HG2      VAL  73  -0.012  -4.549   1.329
  603    H    THR  74           H        THR  74   3.164  -6.843   0.692
  604    HA   THR  74           HA       THR  74   3.594  -8.153   3.274
  605    HB   THR  74           HB       THR  74   4.911  -9.526   1.756
  606    HG1  THR  74           HG1      THR  74   5.860  -8.697   3.811
  607   HG21  THR  74          3HG2      THR  74   6.244  -6.978   0.763
  608   HG22  THR  74          1HG2      THR  74   5.136  -7.994  -0.166
  609   HG23  THR  74          2HG2      THR  74   6.710  -8.622   0.325
  610    H    TYR  75           H        TYR  75   4.174  -6.674   4.755
  611    HA   TYR  75           HA       TYR  75   5.037  -3.999   3.826
  612    HB2  TYR  75           2HB      TYR  75   3.575  -2.974   5.607
  613    HB3  TYR  75           3HB      TYR  75   2.704  -3.691   4.263
  614    HD1  TYR  75           HD1      TYR  75   3.686  -4.294   7.841
  615    HD2  TYR  75           HD2      TYR  75   1.009  -5.348   4.673
  616    HE1  TYR  75           HE1      TYR  75   2.298  -5.554   9.428
  617    HE2  TYR  75           HE2      TYR  75  -0.372  -6.610   6.269
  618    HH   TYR  75           HH       TYR  75  -0.196  -7.679   8.443
  619    H    THR  76           H        THR  76   6.455  -2.926   5.114
  620    HA   THR  76           HA       THR  76   7.661  -4.436   7.344
  621    HB   THR  76           HB       THR  76   9.055  -2.319   5.626
  622    HG1  THR  76           HG1      THR  76   8.635  -3.889   4.153
  623   HG21  THR  76          3HG2      THR  76  10.131  -2.872   7.808
  624   HG22  THR  76          1HG2      THR  76  11.119  -3.389   6.434
  625   HG23  THR  76          2HG2      THR  76  10.180  -4.573   7.342
  626    H    ILE  77           H        ILE  77   7.275  -3.527   9.270
  627    HA   ILE  77           HA       ILE  77   7.565  -0.627   9.620
  628    HB   ILE  77           HB       ILE  77   5.741  -0.814  11.500
  629   HG12  ILE  77          2HG1      ILE  77   4.916  -3.195   9.773
  630   HG13  ILE  77          3HG1      ILE  77   5.366  -3.238  11.473
  631   HG21  ILE  77          1HG2      ILE  77   3.942  -0.139   9.983
  632   HG22  ILE  77          2HG2      ILE  77   4.848  -0.767   8.606
  633   HG23  ILE  77          3HG2      ILE  77   5.476   0.604   9.523
  634   HD11  ILE  77          3HD1      ILE  77   3.351  -1.932  12.022
  635   HD12  ILE  77          1HD1      ILE  77   2.975  -3.451  11.210
  636   HD13  ILE  77          2HD1      ILE  77   2.898  -1.933  10.314
  637    H    ARG  78           H        ARG  78   9.265  -0.375  10.909
  638    HA   ARG  78           HA       ARG  78   9.380  -1.970  13.395
  639    HB2  ARG  78           2HB      ARG  78  11.807  -1.887  13.414
  640    HB3  ARG  78           3HB      ARG  78  11.257  -2.659  11.931
  641    HG2  ARG  78           2HG      ARG  78  11.715  -0.602  10.667
  642    HG3  ARG  78           3HG      ARG  78  12.212   0.215  12.149
  643    HD2  ARG  78           2HD      ARG  78  14.060  -1.466  12.389
  644    HD3  ARG  78           3HD      ARG  78  13.591  -2.146  10.825
  645    HE   ARG  78           HE       ARG  78  14.031   0.628  10.548
  646   HH11  ARG  78          1HH1      ARG  78  15.891  -2.325  11.076
  647   HH12  ARG  78          2HH1      ARG  78  17.329  -1.696  10.338
  648   HH21  ARG  78          1HH2      ARG  78  15.897   1.440   9.571
  649   HH22  ARG  78          2HH2      ARG  78  17.327   0.461   9.476
  650    H    GLY  79           H        GLY  79  10.483  -0.778  15.184
  651    HA2  GLY  79           2HA      GLY  79  10.667   1.339  16.342
  652    HA3  GLY  79           3HA      GLY  79   9.581   2.059  15.157
  653    H    SER  80           H        SER  80   8.189  -0.787  15.488
  654    HA   SER  80           HA       SER  80   6.294  -0.172  17.549
  655    HB2  SER  80           2HB      SER  80   6.831  -2.818  16.135
  656    HB3  SER  80           3HB      SER  80   5.409  -2.439  17.109
  657    HG   SER  80           HG       SER  80   6.067  -0.817  14.906
  658    H    LEU  81           H        LEU  81   9.473  -1.196  17.681
  659    HA   LEU  81           HA       LEU  81   9.389  -3.005  19.917
  660    HB2  LEU  81           2HB      LEU  81  11.718  -1.463  18.678
  661    HB3  LEU  81           3HB      LEU  81  11.870  -2.774  19.834
  662    HG   LEU  81           HG       LEU  81  10.859  -2.999  16.978
  663   HD11  LEU  81          1HD1      LEU  81  12.834  -4.402  16.601
  664   HD12  LEU  81          2HD1      LEU  81  13.365  -4.123  18.262
  665   HD13  LEU  81          3HD1      LEU  81  13.285  -2.779  17.121
  666   HD21  LEU  81          3HD2      LEU  81  11.031  -5.172  19.088
  667   HD22  LEU  81          1HD2      LEU  81  10.670  -5.430  17.377
  668   HD23  LEU  81          2HD2      LEU  81   9.558  -4.504  18.380
  669    H    GLU  82           H        GLU  82   8.019  -0.521  20.421
  670    HA   GLU  82           HA       GLU  82   9.249   1.391  21.991
  671    HB2  GLU  82           2HB      GLU  82   6.996   1.711  23.029
  672    HB3  GLU  82           3HB      GLU  82   6.909   1.561  21.281
  673    HG2  GLU  82           2HG      GLU  82   6.169  -0.782  21.486
  674    HG3  GLU  82           3HG      GLU  82   6.308  -0.682  23.240
  675    H    HIS  83           H        HIS  83   8.218  -1.834  22.775
  676    HA   HIS  83           HA       HIS  83   9.684  -1.832  25.326
  677    HB2  HIS  83           2HB      HIS  83   7.083  -1.555  25.569
  678    HB3  HIS  83           3HB      HIS  83   6.970  -3.208  24.981
  679    HD1  HIS  83           HD1      HIS  83   7.428  -1.232  28.001
  680    HD2  HIS  83           HD2      HIS  83   8.257  -5.137  26.835
  681    HE1  HIS  83           HE1      HIS  83   7.756  -2.521  30.131
  682    HE2  HIS  83           HE2      HIS  83   8.142  -4.895  29.397
  683    H    HIS  84           H        HIS  84  11.253  -2.720  23.772
  684    HA   HIS  84           HA       HIS  84  10.704  -5.153  22.332
  685    HB2  HIS  84           2HB      HIS  84  13.191  -5.072  21.779
  686    HB3  HIS  84           3HB      HIS  84  12.238  -3.696  21.257
  687    HD1  HIS  84           HD1      HIS  84  12.998  -1.422  22.004
  688    HD2  HIS  84           HD2      HIS  84  14.952  -4.487  24.026
  689    HE1  HIS  84           HE1      HIS  84  14.844  -0.319  23.299
  690    HE2  HIS  84           HE2      HIS  84  16.132  -2.212  24.323
  691    H    HIS  85           H        HIS  85   9.945  -6.298  24.123
  692    HA   HIS  85           HA       HIS  85  11.442  -8.136  25.551
  693    HB2  HIS  85           2HB      HIS  85  12.374  -6.063  26.702
  694    HB3  HIS  85           3HB      HIS  85  10.749  -5.647  27.225
  695    HD1  HIS  85           HD1      HIS  85  13.616  -7.935  27.968
  696    HD2  HIS  85           HD2      HIS  85   9.820  -7.119  29.452
  697    HE1  HIS  85           HE1      HIS  85  13.527  -9.015  30.235
  698    HE2  HIS  85           HE2      HIS  85  11.220  -8.510  31.115
  699    H    HIS  86           H        HIS  86   9.908  -9.440  26.828
  700    HA   HIS  86           HA       HIS  86   7.180  -9.212  26.050
  701    HB2  HIS  86           2HB      HIS  86   8.530 -10.894  28.193
  702    HB3  HIS  86           3HB      HIS  86   6.808 -11.015  27.850
  703    HD1  HIS  86           HD1      HIS  86   9.068 -13.259  27.434
  704    HD2  HIS  86           HD2      HIS  86   7.225 -10.992  24.482
  705    HE1  HIS  86           HE1      HIS  86   9.215 -14.638  25.342
  706    HE2  HIS  86           HE2      HIS  86   8.146 -13.216  23.558
  707    H    HIS  87           H        HIS  87   5.348  -9.223  27.741
  708    HA   HIS  87           HA       HIS  87   5.542  -6.895  29.483
  709    HB2  HIS  87           2HB      HIS  87   3.109  -7.320  29.912
  710    HB3  HIS  87           3HB      HIS  87   3.505  -7.151  28.208
  711    HD1  HIS  87           HD1      HIS  87   2.234  -9.594  30.717
  712    HD2  HIS  87           HD2      HIS  87   3.074  -9.479  26.647
  713    HE1  HIS  87           HE1      HIS  87   1.189 -11.657  29.750
  714    HE2  HIS  87           HE2      HIS  87   1.816 -11.625  27.317
  715    H    HIS  88           H        HIS  88   7.355  -8.408  30.376
  716    HA   HIS  88           HA       HIS  88   7.014  -9.077  33.034
  717    HB2  HIS  88           2HB      HIS  88   5.703 -11.037  32.326
  718    HB3  HIS  88           3HB      HIS  88   6.944 -11.502  31.167
  719    HD1  HIS  88           HD1      HIS  88   7.918 -13.629  32.055
  720    HD2  HIS  88           HD2      HIS  88   7.333 -10.842  35.082
  721    HE1  HIS  88           HE1      HIS  88   8.845 -14.687  34.142
  722    HE2  HIS  88           HE2      HIS  88   8.542 -12.954  35.933
  Start of MODEL    2
    1    H1   MET   1           1H       MET   1   9.857   4.768  16.591
    2    H2   MET   1           2H       MET   1  11.229   5.342  15.793
    3    H3   MET   1           3H       MET   1  11.008   3.678  15.990
    4    HA   MET   1           HA       MET   1   9.048   3.748  14.603
    5    HB2  MET   1           2HB      MET   1   8.343   6.056  14.998
    6    HB3  MET   1           3HB      MET   1   9.836   6.679  14.317
    7    HG2  MET   1           2HG      MET   1   9.152   5.839  12.087
    8    HG3  MET   1           3HG      MET   1   7.648   5.244  12.782
    9    HE1  MET   1           3HE      MET   1   9.488   8.636  13.679
   10    HE2  MET   1           1HE      MET   1   8.727   9.735  12.527
   11    HE3  MET   1           2HE      MET   1   9.790   8.453  11.949
   12    H    GLY   2           H        GLY   2   9.612   2.666  12.790
   13    HA2  GLY   2           2HA      GLY   2  12.113   3.243  11.335
   14    HA3  GLY   2           3HA      GLY   2  11.066   1.846  11.121
   15    H    GLU   3           H        GLU   3  11.409   2.496   8.798
   16    HA   GLU   3           HA       GLU   3   9.255   4.355   7.948
   17    HB2  GLU   3           2HB      GLU   3  10.448   4.486   5.749
   18    HB3  GLU   3           3HB      GLU   3  11.378   5.142   7.091
   19    HG2  GLU   3           2HG      GLU   3  12.668   2.985   7.181
   20    HG3  GLU   3           3HG      GLU   3  11.803   2.460   5.736
   21    H    MET   4           H        MET   4   7.920   3.605   6.142
   22    HA   MET   4           HA       MET   4   7.553   0.668   6.296
   23    HB2  MET   4           2HB      MET   4   5.795   1.951   7.528
   24    HB3  MET   4           3HB      MET   4   5.377   2.800   6.042
   25    HG2  MET   4           2HG      MET   4   4.688   0.658   5.022
   26    HG3  MET   4           3HG      MET   4   5.139  -0.188   6.506
   27    HE1  MET   4           3HE      MET   4   1.370  -0.560   7.018
   28    HE2  MET   4           1HE      MET   4   2.956  -1.291   7.255
   29    HE3  MET   4           2HE      MET   4   2.383  -0.931   5.625
   30    H    ASP   5           H        ASP   5   7.564  -0.415   4.403
   31    HA   ASP   5           HA       ASP   5   6.740   1.005   1.962
   32    HB2  ASP   5           2HB      ASP   5   8.236  -0.273   0.596
   33    HB3  ASP   5           3HB      ASP   5   9.207   0.360   1.914
   34    H    ILE   6           H        ILE   6   4.985   0.159   1.115
   35    HA   ILE   6           HA       ILE   6   3.819  -2.319   2.187
   36    HB   ILE   6           HB       ILE   6   2.424   0.080   0.890
   37   HG12  ILE   6          2HG1      ILE   6   2.626  -0.670   3.844
   38   HG13  ILE   6          3HG1      ILE   6   3.503   0.646   3.074
   39   HG21  ILE   6          1HG2      ILE   6   0.339  -0.949   1.746
   40   HG22  ILE   6          2HG2      ILE   6   1.266  -2.324   2.350
   41   HG23  ILE   6          3HG2      ILE   6   1.170  -2.020   0.614
   42   HD11  ILE   6          3HD1      ILE   6   0.533   0.443   3.465
   43   HD12  ILE   6          1HD1      ILE   6   1.351   1.724   2.563
   44   HD13  ILE   6          2HD1      ILE   6   1.665   1.517   4.285
   45    H    ARG   7           H        ARG   7   4.020  -3.937   0.752
   46    HA   ARG   7           HA       ARG   7   4.575  -3.269  -2.071
   47    HB2  ARG   7           2HB      ARG   7   6.557  -4.001  -0.742
   48    HB3  ARG   7           3HB      ARG   7   5.749  -5.529  -0.400
   49    HG2  ARG   7           2HG      ARG   7   5.754  -6.065  -2.823
   50    HG3  ARG   7           3HG      ARG   7   6.562  -4.527  -3.154
   51    HD2  ARG   7           2HD      ARG   7   7.660  -6.859  -1.558
   52    HD3  ARG   7           3HD      ARG   7   8.223  -6.289  -3.131
   53    HE   ARG   7           HE       ARG   7   8.632  -4.976  -0.521
   54   HH11  ARG   7          1HH1      ARG   7   9.340  -5.028  -3.974
   55   HH12  ARG   7          2HH1      ARG   7  10.660  -3.908  -3.832
   56   HH21  ARG   7          1HH2      ARG   7  10.309  -3.496  -0.359
   57   HH22  ARG   7          2HH2      ARG   7  11.210  -3.038  -1.771
   58    H    PHE   8           H        PHE   8   3.028  -3.970  -3.379
   59    HA   PHE   8           HA       PHE   8   1.381  -6.321  -2.663
   60    HB2  PHE   8           2HB      PHE   8   0.835  -3.961  -4.516
   61    HB3  PHE   8           3HB      PHE   8  -0.184  -5.395  -4.471
   62    HD1  PHE   8           HD2      PHE   8  -1.477  -5.950  -2.395
   63    HD2  PHE   8           HD1      PHE   8   0.642  -2.252  -2.804
   64    HE1  PHE   8           HE2      PHE   8  -2.783  -4.993  -0.545
   65    HE2  PHE   8           HE1      PHE   8  -0.667  -1.312  -0.954
   66    HZ   PHE   8           HZ       PHE   8  -2.380  -2.675   0.177
   67    H    ARG   9           H        ARG   9   1.409  -8.055  -3.944
   68    HA   ARG   9           HA       ARG   9   2.861  -8.037  -6.525
   69    HB2  ARG   9           2HB      ARG   9   3.102 -10.048  -4.236
   70    HB3  ARG   9           3HB      ARG   9   3.637 -10.393  -5.879
   71    HG2  ARG   9           2HG      ARG   9   5.235  -8.499  -5.739
   72    HG3  ARG   9           3HG      ARG   9   4.733  -8.216  -4.067
   73    HD2  ARG   9           2HD      ARG   9   5.575 -10.381  -3.381
   74    HD3  ARG   9           3HD      ARG   9   5.881 -10.850  -5.060
   75    HE   ARG   9           HE       ARG   9   7.308  -8.504  -4.466
   76   HH11  ARG   9          1HH1      ARG   9   7.418 -11.935  -3.657
   77   HH12  ARG   9          2HH1      ARG   9   9.133 -11.930  -3.399
   78   HH21  ARG   9          1HH2      ARG   9   9.529  -8.540  -4.234
   79   HH22  ARG   9          2HH2      ARG   9  10.334  -9.996  -3.728
   80    H    GLY  10           H        GLY  10   1.496  -8.734  -8.074
   81    HA2  GLY  10           2HA      GLY  10  -0.577 -10.762  -7.494
   82    HA3  GLY  10           3HA      GLY  10  -1.091  -9.191  -8.109
   83    H    ASP  11           H        ASP  11  -1.452 -11.749  -9.364
   84    HA   ASP  11           HA       ASP  11   0.362 -12.296 -11.469
   85    HB2  ASP  11           2HB      ASP  11  -1.371 -13.895 -10.680
   86    HB3  ASP  11           3HB      ASP  11  -2.639 -12.840 -11.288
   87    H    ASP  12           H        ASP  12  -2.074  -9.945 -11.034
   88    HA   ASP  12           HA       ASP  12  -1.986  -8.999 -13.837
   89    HB2  ASP  12           2HB      ASP  12  -4.216  -9.813 -13.431
   90    HB3  ASP  12           3HB      ASP  12  -4.283  -9.076 -11.834
   91    H    LEU  13           H        LEU  13  -1.158  -7.045 -14.073
   92    HA   LEU  13           HA       LEU  13  -0.011  -5.526 -11.996
   93    HB2  LEU  13           2HB      LEU  13   0.875  -5.543 -14.287
   94    HB3  LEU  13           3HB      LEU  13  -0.594  -4.791 -14.884
   95    HG   LEU  13           HG       LEU  13  -0.032  -2.725 -13.540
   96   HD11  LEU  13          1HD1      LEU  13   2.237  -2.425 -12.661
   97   HD12  LEU  13          2HD1      LEU  13   2.612  -4.114 -13.021
   98   HD13  LEU  13          3HD1      LEU  13   1.382  -3.716 -11.817
   99   HD21  LEU  13          3HD2      LEU  13   2.036  -3.585 -15.579
  100   HD22  LEU  13          1HD2      LEU  13   1.730  -1.924 -15.057
  101   HD23  LEU  13          2HD2      LEU  13   0.480  -2.823 -15.914
  102    H    GLU  14           H        GLU  14  -3.197  -5.403 -13.460
  103    HA   GLU  14           HA       GLU  14  -3.736  -2.633 -12.898
  104    HB2  GLU  14           2HB      GLU  14  -5.725  -4.841 -13.583
  105    HB3  GLU  14           3HB      GLU  14  -6.073  -3.109 -13.560
  106    HG2  GLU  14           2HG      GLU  14  -4.372  -2.784 -15.359
  107    HG3  GLU  14           3HG      GLU  14  -4.152  -4.534 -15.433
  108    H    ALA  15           H        ALA  15  -4.429  -5.710 -11.279
  109    HA   ALA  15           HA       ALA  15  -6.108  -4.802  -9.212
  110    HB1  ALA  15           3HB      ALA  15  -5.415  -6.852  -8.020
  111    HB2  ALA  15           1HB      ALA  15  -4.081  -7.072  -9.158
  112    HB3  ALA  15           2HB      ALA  15  -5.751  -7.189  -9.719
  113    H    LEU  16           H        LEU  16  -2.619  -4.765  -9.605
  114    HA   LEU  16           HA       LEU  16  -1.900  -3.861  -7.008
  115    HB2  LEU  16           2HB      LEU  16  -0.371  -3.432  -9.605
  116    HB3  LEU  16           3HB      LEU  16   0.289  -3.354  -7.977
  117    HG   LEU  16           HG       LEU  16  -0.727  -5.853  -9.387
  118   HD11  LEU  16          1HD1      LEU  16   1.417  -5.079 -10.254
  119   HD12  LEU  16          2HD1      LEU  16   1.610  -6.581  -9.353
  120   HD13  LEU  16          3HD1      LEU  16   2.092  -5.045  -8.623
  121   HD21  LEU  16          3HD2      LEU  16   0.072  -7.105  -7.436
  122   HD22  LEU  16          1HD2      LEU  16  -1.220  -5.993  -6.999
  123   HD23  LEU  16          2HD2      LEU  16   0.456  -5.597  -6.605
  124    H    GLU  17           H        GLU  17  -2.836  -2.249 -10.025
  125    HA   GLU  17           HA       GLU  17  -2.096   0.412  -9.277
  126    HB2  GLU  17           2HB      GLU  17  -4.061  -0.492 -11.436
  127    HB3  GLU  17           3HB      GLU  17  -3.390   1.132 -11.271
  128    HG2  GLU  17           2HG      GLU  17  -1.113   0.217 -11.663
  129    HG3  GLU  17           3HG      GLU  17  -1.811  -1.387 -11.884
  130    H    LYS  18           H        LYS  18  -5.146  -1.431  -9.019
  131    HA   LYS  18           HA       LYS  18  -6.718   0.784  -8.078
  132    HB2  LYS  18           2HB      LYS  18  -7.202  -2.217  -7.991
  133    HB3  LYS  18           3HB      LYS  18  -8.287  -1.091  -7.193
  134    HG2  LYS  18           2HG      LYS  18  -9.343  -1.506  -9.234
  135    HG3  LYS  18           3HG      LYS  18  -8.548   0.049  -9.490
  136    HD2  LYS  18           2HD      LYS  18  -6.720  -1.085 -10.698
  137    HD3  LYS  18           3HD      LYS  18  -7.487  -2.648 -10.407
  138    HE2  LYS  18           2HE      LYS  18  -7.958  -1.942 -12.675
  139    HE3  LYS  18           3HE      LYS  18  -9.458  -1.876 -11.745
  140    HZ1  LYS  18           3HZ      LYS  18  -9.116   0.067 -13.178
  141    HZ2  LYS  18           1HZ      LYS  18  -7.712   0.459 -12.324
  142    HZ3  LYS  18           2HZ      LYS  18  -9.214   0.499 -11.547
  143    H    ALA  19           H        ALA  19  -4.925  -1.872  -6.491
  144    HA   ALA  19           HA       ALA  19  -5.414  -1.221  -3.792
  145    HB1  ALA  19           3HB      ALA  19  -4.329  -3.329  -4.482
  146    HB2  ALA  19           1HB      ALA  19  -3.340  -2.471  -3.295
  147    HB3  ALA  19           2HB      ALA  19  -2.902  -2.434  -5.005
  148    H    LEU  20           H        LEU  20  -2.894  -0.158  -6.023
  149    HA   LEU  20           HA       LEU  20  -1.353   1.511  -4.435
  150    HB2  LEU  20           2HB      LEU  20  -0.680   0.766  -6.665
  151    HB3  LEU  20           3HB      LEU  20  -1.995   1.659  -7.404
  152    HG   LEU  20           HG       LEU  20  -0.923   3.799  -6.810
  153   HD11  LEU  20          1HD1      LEU  20   1.295   3.907  -5.819
  154   HD12  LEU  20          2HD1      LEU  20   1.316   2.155  -5.603
  155   HD13  LEU  20          3HD1      LEU  20   0.154   3.145  -4.715
  156   HD21  LEU  20          3HD2      LEU  20  -0.353   2.758  -8.960
  157   HD22  LEU  20          1HD2      LEU  20   1.006   1.915  -8.207
  158   HD23  LEU  20          2HD2      LEU  20   1.003   3.679  -8.313
  159    H    LYS  21           H        LYS  21  -4.169   2.334  -6.479
  160    HA   LYS  21           HA       LYS  21  -4.304   5.083  -6.149
  161    HB2  LYS  21           2HB      LYS  21  -5.745   3.804  -7.720
  162    HB3  LYS  21           3HB      LYS  21  -6.622   3.111  -6.361
  163    HG2  LYS  21           2HG      LYS  21  -7.208   5.576  -5.738
  164    HG3  LYS  21           3HG      LYS  21  -6.663   5.968  -7.369
  165    HD2  LYS  21           2HD      LYS  21  -9.095   5.701  -7.343
  166    HD3  LYS  21           3HD      LYS  21  -8.370   4.402  -8.297
  167    HE2  LYS  21           2HE      LYS  21  -8.681   2.816  -6.491
  168    HE3  LYS  21           3HE      LYS  21  -9.169   4.096  -5.380
  169    HZ1  LYS  21           3HZ      LYS  21 -10.675   3.193  -7.774
  170    HZ2  LYS  21           1HZ      LYS  21 -11.140   4.461  -6.756
  171    HZ3  LYS  21           2HZ      LYS  21 -11.074   2.879  -6.165
  172    H    GLU  22           H        GLU  22  -5.744   2.526  -4.161
  173    HA   GLU  22           HA       GLU  22  -7.095   4.242  -2.335
  174    HB2  GLU  22           2HB      GLU  22  -6.356   1.300  -2.160
  175    HB3  GLU  22           3HB      GLU  22  -7.422   2.120  -1.022
  176    HG2  GLU  22           2HG      GLU  22  -7.979   1.940  -4.000
  177    HG3  GLU  22           3HG      GLU  22  -8.554   0.753  -2.834
  178    H    MET  23           H        MET  23  -3.907   2.576  -2.224
  179    HA   MET  23           HA       MET  23  -3.355   3.238   0.509
  180    HB2  MET  23           2HB      MET  23  -1.410   2.467  -1.706
  181    HB3  MET  23           3HB      MET  23  -1.002   2.570   0.006
  182    HG2  MET  23           2HG      MET  23  -2.895   0.620  -1.312
  183    HG3  MET  23           3HG      MET  23  -1.355   0.264  -0.539
  184    HE1  MET  23           3HE      MET  23  -0.989   0.371   2.104
  185    HE2  MET  23           1HE      MET  23  -2.256   0.805   3.252
  186    HE3  MET  23           2HE      MET  23  -1.591   2.030   2.174
  187    H    ILE  24           H        ILE  24  -2.594   4.854  -2.561
  188    HA   ILE  24           HA       ILE  24  -1.042   6.993  -1.527
  189    HB   ILE  24           HB       ILE  24  -2.836   6.891  -4.008
  190   HG12  ILE  24          2HG1      ILE  24   0.199   6.635  -3.721
  191   HG13  ILE  24          3HG1      ILE  24  -0.912   5.326  -4.100
  192   HG21  ILE  24          1HG2      ILE  24  -2.569   9.240  -3.325
  193   HG22  ILE  24          2HG2      ILE  24  -1.666   8.930  -4.807
  194   HG23  ILE  24          3HG2      ILE  24  -0.818   9.043  -3.265
  195   HD11  ILE  24          3HD1      ILE  24   0.260   6.058  -6.079
  196   HD12  ILE  24          1HD1      ILE  24  -0.313   7.711  -5.853
  197   HD13  ILE  24          2HD1      ILE  24  -1.458   6.420  -6.230
  198    H    ARG  25           H        ARG  25  -4.512   6.612  -2.168
  199    HA   ARG  25           HA       ARG  25  -5.573   9.048  -1.372
  200    HB2  ARG  25           2HB      ARG  25  -6.846   7.344  -2.556
  201    HB3  ARG  25           3HB      ARG  25  -6.672   6.215  -1.226
  202    HG2  ARG  25           2HG      ARG  25  -8.156   7.673   0.162
  203    HG3  ARG  25           3HG      ARG  25  -8.371   8.733  -1.236
  204    HD2  ARG  25           2HD      ARG  25  -9.348   6.863  -2.521
  205    HD3  ARG  25           3HD      ARG  25  -9.102   5.778  -1.149
  206    HE   ARG  25           HE       ARG  25 -10.696   8.001  -0.382
  207   HH11  ARG  25          1HH1      ARG  25 -10.930   4.990  -2.229
  208   HH12  ARG  25          2HH1      ARG  25 -12.640   4.833  -1.956
  209   HH21  ARG  25          1HH2      ARG  25 -12.930   7.753  -0.049
  210   HH22  ARG  25          2HH2      ARG  25 -13.767   6.391  -0.727
  211    H    GLN  26           H        GLN  26  -4.704   6.223   0.609
  212    HA   GLN  26           HA       GLN  26  -5.668   7.212   3.105
  213    HB2  GLN  26           2HB      GLN  26  -3.529   5.119   2.538
  214    HB3  GLN  26           3HB      GLN  26  -4.252   5.423   4.118
  215    HG2  GLN  26           2HG      GLN  26  -5.701   4.426   1.656
  216    HG3  GLN  26           3HG      GLN  26  -5.258   3.467   3.062
  217   HE21  GLN  26          1HE2      GLN  26  -7.894   4.053   1.854
  218   HE22  GLN  26          2HE2      GLN  26  -8.853   4.707   3.131
  219    H    ALA  27           H        ALA  27  -2.393   7.135   1.662
  220    HA   ALA  27           HA       ALA  27  -1.082   8.502   3.767
  221    HB1  ALA  27           3HB      ALA  27   0.112   7.147   2.113
  222    HB2  ALA  27           1HB      ALA  27   0.766   8.786   2.173
  223    HB3  ALA  27           2HB      ALA  27  -0.296   8.304   0.844
  224    H    ARG  28           H        ARG  28  -3.109   9.679   1.205
  225    HA   ARG  28           HA       ARG  28  -2.254  12.441   1.362
  226    HB2  ARG  28           2HB      ARG  28  -4.680  11.173   0.027
  227    HB3  ARG  28           3HB      ARG  28  -4.271  12.885  -0.074
  228    HG2  ARG  28           2HG      ARG  28  -2.069  12.203  -1.141
  229    HG3  ARG  28           3HG      ARG  28  -2.686  10.556  -1.200
  230    HD2  ARG  28           2HD      ARG  28  -3.008  11.676  -3.353
  231    HD3  ARG  28           3HD      ARG  28  -4.565  11.295  -2.610
  232    HE   ARG  28           HE       ARG  28  -3.610  13.966  -2.044
  233   HH11  ARG  28          1HH1      ARG  28  -5.454  12.046  -4.366
  234   HH12  ARG  28          2HH1      ARG  28  -6.317  13.425  -4.976
  235   HH21  ARG  28          1HH2      ARG  28  -4.742  15.732  -2.858
  236   HH22  ARG  28          2HH2      ARG  28  -5.915  15.514  -4.121
  237    H    LYS  29           H        LYS  29  -5.027  10.505   2.639
  238    HA   LYS  29           HA       LYS  29  -6.313  12.761   3.869
  239    HB2  LYS  29           2HB      LYS  29  -7.777  11.183   5.012
  240    HB3  LYS  29           3HB      LYS  29  -7.597  10.708   3.331
  241    HG2  LYS  29           2HG      LYS  29  -6.109   8.898   3.936
  242    HG3  LYS  29           3HG      LYS  29  -6.075   9.422   5.619
  243    HD2  LYS  29           2HD      LYS  29  -8.533   8.383   4.143
  244    HD3  LYS  29           3HD      LYS  29  -7.546   7.453   5.273
  245    HE2  LYS  29           2HE      LYS  29  -8.131   9.094   7.072
  246    HE3  LYS  29           3HE      LYS  29  -9.193   9.920   5.930
  247    HZ1  LYS  29           3HZ      LYS  29 -10.487   7.878   5.739
  248    HZ2  LYS  29           1HZ      LYS  29 -10.429   8.417   7.341
  249    HZ3  LYS  29           2HZ      LYS  29  -9.476   7.109   6.849
  250    H    PHE  30           H        PHE  30  -3.876  10.468   4.935
  251    HA   PHE  30           HA       PHE  30  -3.733  11.531   7.636
  252    HB2  PHE  30           2HB      PHE  30  -1.931   9.562   6.154
  253    HB3  PHE  30           3HB      PHE  30  -1.763   9.984   7.856
  254    HD1  PHE  30           HD1      PHE  30  -4.332   9.834   9.061
  255    HD2  PHE  30           HD2      PHE  30  -2.804   7.393   5.897
  256    HE1  PHE  30           HE1      PHE  30  -5.859   8.015   9.706
  257    HE2  PHE  30           HE2      PHE  30  -4.344   5.586   6.546
  258    HZ   PHE  30           HZ       PHE  30  -5.869   5.897   8.452
  259    H    ALA  31           H        ALA  31  -2.656  12.518   4.609
  260    HA   ALA  31           HA       ALA  31  -1.533  14.320   3.872
  261    HB1  ALA  31           3HB      ALA  31  -2.698  15.512   5.695
  262    HB2  ALA  31           1HB      ALA  31  -1.105  16.207   5.377
  263    HB3  ALA  31           2HB      ALA  31  -1.353  15.166   6.782
  264    H    GLY  32           H        GLY  32  -0.088  11.832   4.860
  265    HA2  GLY  32           2HA      GLY  32   2.628  12.713   5.443
  266    HA3  GLY  32           3HA      GLY  32   2.067  11.064   5.211
  267    H    THR  33           H        THR  33   4.176  10.966   3.956
  268    HA   THR  33           HA       THR  33   3.944  12.050   1.213
  269    HB   THR  33           HB       THR  33   6.432  10.961   2.615
  270    HG1  THR  33           HG1      THR  33   5.771  12.918   3.569
  271   HG21  THR  33          3HG2      THR  33   6.514  10.806   0.130
  272   HG22  THR  33          1HG2      THR  33   7.680  11.982   0.751
  273   HG23  THR  33          2HG2      THR  33   6.172  12.534   0.020
  274    H    VAL  34           H        VAL  34   3.778  10.578  -0.483
  275    HA   VAL  34           HA       VAL  34   4.012   7.691   0.120
  276    HB   VAL  34           HB       VAL  34   1.627   8.271  -0.007
  277   HG11  VAL  34          1HG1      VAL  34   1.698  10.270  -1.398
  278   HG12  VAL  34          2HG1      VAL  34   0.552   9.103  -2.055
  279   HG13  VAL  34          3HG1      VAL  34   2.136   9.303  -2.809
  280   HG21  VAL  34          3HG2      VAL  34   2.300   6.051  -0.815
  281   HG22  VAL  34          1HG2      VAL  34   2.494   6.688  -2.452
  282   HG23  VAL  34          2HG2      VAL  34   0.895   6.643  -1.703
  283    H    THR  35           H        THR  35   5.193   6.574  -1.276
  284    HA   THR  35           HA       THR  35   5.971   7.683  -3.924
  285    HB   THR  35           HB       THR  35   7.690   5.954  -2.061
  286    HG1  THR  35           HG1      THR  35   7.598   7.934  -1.099
  287   HG21  THR  35          3HG2      THR  35   8.266   5.721  -4.478
  288   HG22  THR  35          1HG2      THR  35   9.560   6.499  -3.554
  289   HG23  THR  35          2HG2      THR  35   8.501   7.469  -4.577
  290    H    TYR  36           H        TYR  36   6.251   5.952  -5.571
  291    HA   TYR  36           HA       TYR  36   5.712   3.207  -4.785
  292    HB2  TYR  36           2HB      TYR  36   3.888   2.829  -6.394
  293    HB3  TYR  36           3HB      TYR  36   3.428   4.001  -5.171
  294    HD1  TYR  36           HD2      TYR  36   3.162   6.420  -5.779
  295    HD2  TYR  36           HD1      TYR  36   4.003   3.467  -8.770
  296    HE1  TYR  36           HE2      TYR  36   2.454   7.989  -7.535
  297    HE2  TYR  36           HE1      TYR  36   3.294   5.048 -10.515
  298    HH   TYR  36           HH       TYR  36   2.807   8.365  -9.924
  299    H    THR  37           H        THR  37   6.465   1.722  -6.174
  300    HA   THR  37           HA       THR  37   7.769   2.577  -8.682
  301    HB   THR  37           HB       THR  37   8.867   0.573  -6.656
  302    HG1  THR  37           HG1      THR  37   9.131   3.306  -6.911
  303   HG21  THR  37          3HG2      THR  37  10.927   0.656  -8.045
  304   HG22  THR  37          1HG2      THR  37  10.104   1.687  -9.205
  305   HG23  THR  37          2HG2      THR  37   9.556   0.023  -8.964
  306    H    LEU  38           H        LEU  38   6.506   1.719 -10.180
  307    HA   LEU  38           HA       LEU  38   5.352  -0.969  -9.989
  308    HB2  LEU  38           2HB      LEU  38   5.092   1.279 -12.033
  309    HB3  LEU  38           3HB      LEU  38   4.332  -0.291 -12.246
  310    HG   LEU  38           HG       LEU  38   3.742   1.528  -9.877
  311   HD11  LEU  38          1HD1      LEU  38   3.065   2.694 -11.904
  312   HD12  LEU  38          2HD1      LEU  38   1.657   2.158 -10.992
  313   HD13  LEU  38          3HD1      LEU  38   2.152   1.281 -12.444
  314   HD21  LEU  38          3HD2      LEU  38   3.249  -0.824  -9.474
  315   HD22  LEU  38          1HD2      LEU  38   2.272  -0.899 -10.947
  316   HD23  LEU  38          2HD2      LEU  38   1.762   0.113  -9.591
  317    H    ASP  39           H        ASP  39   6.677  -2.600 -10.554
  318    HA   ASP  39           HA       ASP  39   8.067  -2.597 -13.119
  319    HB2  ASP  39           2HB      ASP  39   9.828  -1.712 -11.611
  320    HB3  ASP  39           3HB      ASP  39   9.593  -3.057 -10.500
  321    H    GLY  40           H        GLY  40   7.332  -4.420 -14.024
  322    HA2  GLY  40           2HA      GLY  40   6.627  -6.568 -14.377
  323    HA3  GLY  40           3HA      GLY  40   7.524  -7.027 -12.932
  324    H    ASN  41           H        ASN  41   6.168  -8.150 -11.655
  325    HA   ASN  41           HA       ASN  41   3.404  -7.179 -11.182
  326    HB2  ASN  41           2HB      ASN  41   4.624  -9.932 -10.710
  327    HB3  ASN  41           3HB      ASN  41   2.987  -9.473 -10.258
  328   HD21  ASN  41          1HD2      ASN  41   1.503  -8.887 -11.977
  329   HD22  ASN  41          2HD2      ASN  41   1.694  -9.585 -13.546
  330    H    ASP  42           H        ASP  42   6.210  -6.482  -9.949
  331    HA   ASP  42           HA       ASP  42   5.424  -6.649  -7.098
  332    HB2  ASP  42           2HB      ASP  42   7.698  -7.515  -7.749
  333    HB3  ASP  42           3HB      ASP  42   8.119  -5.915  -8.323
  334    H    LEU  43           H        LEU  43   4.741  -4.862  -6.139
  335    HA   LEU  43           HA       LEU  43   5.241  -2.166  -7.278
  336    HB2  LEU  43           2HB      LEU  43   2.919  -2.586  -7.664
  337    HB3  LEU  43           3HB      LEU  43   2.719  -3.400  -6.122
  338    HG   LEU  43           HG       LEU  43   2.925  -1.216  -4.938
  339   HD11  LEU  43          1HD1      LEU  43   2.834   0.912  -6.133
  340   HD12  LEU  43          2HD1      LEU  43   2.999   0.069  -7.671
  341   HD13  LEU  43          3HD1      LEU  43   4.314   0.027  -6.500
  342   HD21  LEU  43          3HD2      LEU  43   0.762  -1.277  -7.053
  343   HD22  LEU  43          1HD2      LEU  43   0.732  -0.329  -5.561
  344   HD23  LEU  43          2HD2      LEU  43   0.725  -2.089  -5.485
  345    H    GLU  44           H        GLU  44   6.838  -1.437  -5.937
  346    HA   GLU  44           HA       GLU  44   6.607  -1.782  -3.023
  347    HB2  GLU  44           2HB      GLU  44   8.849  -2.109  -4.065
  348    HB3  GLU  44           3HB      GLU  44   8.805  -0.456  -4.677
  349    HG2  GLU  44           2HG      GLU  44   8.614   0.302  -2.222
  350    HG3  GLU  44           3HG      GLU  44   9.003  -1.365  -1.786
  351    H    ILE  45           H        ILE  45   4.994  -0.414  -2.347
  352    HA   ILE  45           HA       ILE  45   5.019   2.462  -3.009
  353    HB   ILE  45           HB       ILE  45   3.268   0.942  -0.998
  354   HG12  ILE  45          2HG1      ILE  45   2.525   1.755  -3.840
  355   HG13  ILE  45          3HG1      ILE  45   2.957   0.122  -3.349
  356   HG21  ILE  45          1HG2      ILE  45   2.867   3.710  -2.182
  357   HG22  ILE  45          2HG2      ILE  45   3.381   3.358  -0.531
  358   HG23  ILE  45          3HG2      ILE  45   1.765   2.893  -1.069
  359   HD11  ILE  45          3HD1      ILE  45   1.006   0.057  -1.869
  360   HD12  ILE  45          1HD1      ILE  45   0.574   0.349  -3.552
  361   HD13  ILE  45          2HD1      ILE  45   0.557   1.682  -2.399
  362    H    ARG  46           H        ARG  46   6.125   3.934  -1.612
  363    HA   ARG  46           HA       ARG  46   6.950   2.919   1.059
  364    HB2  ARG  46           2HB      ARG  46   8.533   4.827  -0.724
  365    HB3  ARG  46           3HB      ARG  46   8.982   4.349   0.913
  366    HG2  ARG  46           2HG      ARG  46   9.027   1.941   0.057
  367    HG3  ARG  46           3HG      ARG  46   8.889   2.612  -1.570
  368    HD2  ARG  46           2HD      ARG  46  11.144   3.056   0.415
  369    HD3  ARG  46           3HD      ARG  46  11.220   2.146  -1.096
  370    HE   ARG  46           HE       ARG  46  10.850   5.082  -0.912
  371   HH11  ARG  46          1HH1      ARG  46  12.198   2.308  -2.613
  372   HH12  ARG  46          2HH1      ARG  46  12.960   3.286  -3.831
  373   HH21  ARG  46          1HH2      ARG  46  11.834   6.333  -2.530
  374   HH22  ARG  46          2HH2      ARG  46  12.751   5.549  -3.779
  375    H    ILE  47           H        ILE  47   5.716   3.818   2.491
  376    HA   ILE  47           HA       ILE  47   4.805   6.624   2.202
  377    HB   ILE  47           HB       ILE  47   3.465   4.391   3.805
  378   HG12  ILE  47          2HG1      ILE  47   2.666   5.745   1.183
  379   HG13  ILE  47          3HG1      ILE  47   3.177   4.074   1.374
  380   HG21  ILE  47          1HG2      ILE  47   1.637   6.033   4.189
  381   HG22  ILE  47          2HG2      ILE  47   2.580   7.274   3.358
  382   HG23  ILE  47          3HG2      ILE  47   3.162   6.597   4.880
  383   HD11  ILE  47          3HD1      ILE  47   1.144   3.634   2.689
  384   HD12  ILE  47          1HD1      ILE  47   0.808   4.186   1.051
  385   HD13  ILE  47          2HD1      ILE  47   0.622   5.296   2.408
  386    H    THR  48           H        THR  48   5.842   7.968   3.436
  387    HA   THR  48           HA       THR  48   6.979   7.232   6.050
  388    HB   THR  48           HB       THR  48   8.566   8.577   3.799
  389    HG1  THR  48           HG1      THR  48   8.886   6.585   3.183
  390   HG21  THR  48          3HG2      THR  48   9.317   9.275   6.065
  391   HG22  THR  48          1HG2      THR  48  10.532   8.292   5.245
  392   HG23  THR  48          2HG2      THR  48   9.525   7.578   6.509
  393    H    GLY  49           H        GLY  49   7.591   9.262   7.283
  394    HA2  GLY  49           2HA      GLY  49   7.378  11.580   7.711
  395    HA3  GLY  49           3HA      GLY  49   6.206  11.722   6.405
  396    H    VAL  50           H        VAL  50   4.471   9.618   7.051
  397    HA   VAL  50           HA       VAL  50   2.904  10.486   9.240
  398    HB   VAL  50           HB       VAL  50   1.700   8.284   9.029
  399   HG11  VAL  50          1HG1      VAL  50   2.189   9.631   6.349
  400   HG12  VAL  50          2HG1      VAL  50   1.039  10.161   7.579
  401   HG13  VAL  50          3HG1      VAL  50   0.804   8.614   6.766
  402   HG21  VAL  50          3HG2      VAL  50   2.333   6.664   7.271
  403   HG22  VAL  50          1HG2      VAL  50   3.616   6.829   8.474
  404   HG23  VAL  50          2HG2      VAL  50   3.776   7.614   6.901
  405    HA   PRO  51           HA       PRO  51   5.241   8.599  12.649
  406    HB2  PRO  51           2HB      PRO  51   3.239   8.498  14.564
  407    HB3  PRO  51           3HB      PRO  51   4.111   9.986  14.142
  408    HG2  PRO  51           2HG      PRO  51   1.413   9.063  13.223
  409    HG3  PRO  51           3HG      PRO  51   1.934  10.690  13.715
  410    HD2  PRO  51           2HD      PRO  51   1.682   9.983  11.101
  411    HD3  PRO  51           3HD      PRO  51   2.908  11.150  11.645
  412    H    GLU  52           H        GLU  52   5.213   6.647  13.969
  413    HA   GLU  52           HA       GLU  52   4.833   4.354  12.441
  414    HB2  GLU  52           2HB      GLU  52   6.513   4.699  14.292
  415    HB3  GLU  52           3HB      GLU  52   5.222   4.467  15.461
  416    HG2  GLU  52           2HG      GLU  52   6.536   2.434  15.217
  417    HG3  GLU  52           3HG      GLU  52   4.887   2.174  14.653
  418    H    GLN  53           H        GLN  53   2.797   5.707  14.996
  419    HA   GLN  53           HA       GLN  53   0.967   3.623  15.340
  420    HB2  GLN  53           2HB      GLN  53  -0.617   5.401  16.134
  421    HB3  GLN  53           3HB      GLN  53   0.974   5.491  16.880
  422    HG2  GLN  53           2HG      GLN  53   1.592   7.396  15.544
  423    HG3  GLN  53           3HG      GLN  53   0.163   7.228  14.530
  424   HE21  GLN  53          1HE2      GLN  53  -1.865   7.853  15.366
  425   HE22  GLN  53          2HE2      GLN  53  -1.997   8.914  16.729
  426    H    VAL  54           H        VAL  54   1.031   6.227  12.930
  427    HA   VAL  54           HA       VAL  54  -1.503   5.572  11.738
  428    HB   VAL  54           HB       VAL  54   0.768   7.388  10.813
  429   HG11  VAL  54          1HG1      VAL  54  -0.483   6.669   8.828
  430   HG12  VAL  54          2HG1      VAL  54  -0.834   8.359   9.188
  431   HG13  VAL  54          3HG1      VAL  54  -2.008   7.107   9.602
  432   HG21  VAL  54          3HG2      VAL  54  -1.933   8.023  12.060
  433   HG22  VAL  54          1HG2      VAL  54  -0.744   9.216  11.521
  434   HG23  VAL  54          2HG2      VAL  54  -0.366   8.136  12.866
  435    H    ARG  55           H        ARG  55   1.890   4.730  11.118
  436    HA   ARG  55           HA       ARG  55   1.671   3.489   8.604
  437    HB2  ARG  55           2HB      ARG  55   3.488   2.725  10.928
  438    HB3  ARG  55           3HB      ARG  55   3.695   2.175   9.265
  439    HG2  ARG  55           2HG      ARG  55   4.025   4.552   8.563
  440    HG3  ARG  55           3HG      ARG  55   3.878   5.046  10.252
  441    HD2  ARG  55           2HD      ARG  55   5.861   3.437  10.698
  442    HD3  ARG  55           3HD      ARG  55   6.085   3.428   8.947
  443    HE   ARG  55           HE       ARG  55   6.522   5.659  10.788
  444   HH11  ARG  55          1HH1      ARG  55   6.557   4.565   7.453
  445   HH12  ARG  55          2HH1      ARG  55   7.521   5.892   6.902
  446   HH21  ARG  55          1HH2      ARG  55   7.790   7.368  10.086
  447   HH22  ARG  55          2HH2      ARG  55   8.232   7.498   8.417
  448    H    LYS  56           H        LYS  56   0.918   2.296  11.846
  449    HA   LYS  56           HA       LYS  56   0.395  -0.410  11.235
  450    HB2  LYS  56           2HB      LYS  56  -0.927   1.265  13.413
  451    HB3  LYS  56           3HB      LYS  56  -0.846  -0.496  13.362
  452    HG2  LYS  56           2HG      LYS  56   1.502   1.397  13.645
  453    HG3  LYS  56           3HG      LYS  56   0.801   0.419  14.934
  454    HD2  LYS  56           2HD      LYS  56   1.613  -1.611  13.992
  455    HD3  LYS  56           3HD      LYS  56   1.924  -0.871  12.420
  456    HE2  LYS  56           2HE      LYS  56   4.019  -1.298  13.596
  457    HE3  LYS  56           3HE      LYS  56   3.771   0.436  13.400
  458    HZ1  LYS  56           3HZ      LYS  56   3.354  -1.153  15.870
  459    HZ2  LYS  56           1HZ      LYS  56   2.963   0.485  15.708
  460    HZ3  LYS  56           2HZ      LYS  56   4.568  -0.014  15.582
  461    H    GLU  57           H        GLU  57  -1.673   2.464  11.109
  462    HA   GLU  57           HA       GLU  57  -4.099   1.128  10.423
  463    HB2  GLU  57           2HB      GLU  57  -3.315   4.015   9.794
  464    HB3  GLU  57           3HB      GLU  57  -4.949   3.357   9.826
  465    HG2  GLU  57           2HG      GLU  57  -3.083   3.760  12.175
  466    HG3  GLU  57           3HG      GLU  57  -4.583   4.625  11.844
  467    H    LEU  58           H        LEU  58  -1.422   2.503   8.543
  468    HA   LEU  58           HA       LEU  58  -2.442   1.996   5.948
  469    HB2  LEU  58           2HB      LEU  58   0.318   2.503   7.060
  470    HB3  LEU  58           3HB      LEU  58   0.185   1.890   5.430
  471    HG   LEU  58           HG       LEU  58   0.448   4.260   5.271
  472   HD11  LEU  58          1HD1      LEU  58  -1.552   4.981   4.075
  473   HD12  LEU  58          2HD1      LEU  58  -2.466   3.627   4.745
  474   HD13  LEU  58          3HD1      LEU  58  -1.108   3.328   3.655
  475   HD21  LEU  58          3HD2      LEU  58  -0.194   4.931   7.522
  476   HD22  LEU  58          1HD2      LEU  58  -1.894   4.617   7.162
  477   HD23  LEU  58          2HD2      LEU  58  -1.032   5.909   6.320
  478    H    ALA  59           H        ALA  59  -0.832  -0.093   8.318
  479    HA   ALA  59           HA       ALA  59  -0.420  -2.331   6.619
  480    HB1  ALA  59           3HB      ALA  59   0.723  -2.100   8.782
  481    HB2  ALA  59           1HB      ALA  59  -0.156  -3.628   8.683
  482    HB3  ALA  59           2HB      ALA  59  -0.812  -2.289   9.631
  483    H    LYS  60           H        LYS  60  -3.181  -1.324   8.680
  484    HA   LYS  60           HA       LYS  60  -4.824  -3.573   8.223
  485    HB2  LYS  60           2HB      LYS  60  -5.239  -0.829   9.296
  486    HB3  LYS  60           3HB      LYS  60  -6.662  -1.495   8.520
  487    HG2  LYS  60           2HG      LYS  60  -6.888  -2.028  10.803
  488    HG3  LYS  60           3HG      LYS  60  -6.413  -3.530  10.012
  489    HD2  LYS  60           2HD      LYS  60  -5.185  -3.389  12.064
  490    HD3  LYS  60           3HD      LYS  60  -4.034  -3.062  10.763
  491    HE2  LYS  60           2HE      LYS  60  -3.733  -1.530  12.673
  492    HE3  LYS  60           3HE      LYS  60  -4.181  -0.659  11.211
  493    HZ1  LYS  60           3HZ      LYS  60  -5.992  -1.346  13.468
  494    HZ2  LYS  60           1HZ      LYS  60  -6.464  -0.534  12.060
  495    HZ3  LYS  60           2HZ      LYS  60  -5.363   0.181  13.123
  496    H    GLU  61           H        GLU  61  -4.354  -0.570   6.395
  497    HA   GLU  61           HA       GLU  61  -6.393  -1.021   4.468
  498    HB2  GLU  61           2HB      GLU  61  -3.911   0.731   4.371
  499    HB3  GLU  61           3HB      GLU  61  -5.191   0.761   3.159
  500    HG2  GLU  61           2HG      GLU  61  -5.470   1.467   6.091
  501    HG3  GLU  61           3HG      GLU  61  -5.463   2.597   4.739
  502    H    ALA  62           H        ALA  62  -2.921  -1.693   4.556
  503    HA   ALA  62           HA       ALA  62  -2.461  -2.726   2.034
  504    HB1  ALA  62           3HB      ALA  62  -1.258  -3.655   4.668
  505    HB2  ALA  62           1HB      ALA  62  -0.722  -2.257   3.731
  506    HB3  ALA  62           2HB      ALA  62  -0.555  -3.878   3.065
  507    H    GLU  63           H        GLU  63  -3.498  -4.453   4.966
  508    HA   GLU  63           HA       GLU  63  -3.691  -7.032   3.823
  509    HB2  GLU  63           2HB      GLU  63  -4.848  -5.866   6.380
  510    HB3  GLU  63           3HB      GLU  63  -4.877  -7.584   5.980
  511    HG2  GLU  63           2HG      GLU  63  -2.439  -7.678   5.988
  512    HG3  GLU  63           3HG      GLU  63  -2.344  -5.935   6.248
  513    H    ARG  64           H        ARG  64  -6.232  -4.531   4.397
  514    HA   ARG  64           HA       ARG  64  -8.404  -6.252   3.689
  515    HB2  ARG  64           2HB      ARG  64  -9.813  -4.217   3.534
  516    HB3  ARG  64           3HB      ARG  64  -8.905  -4.291   5.038
  517    HG2  ARG  64           2HG      ARG  64  -7.460  -2.546   4.404
  518    HG3  ARG  64           3HG      ARG  64  -7.889  -2.666   2.699
  519    HD2  ARG  64           2HD      ARG  64  -9.837  -1.768   4.853
  520    HD3  ARG  64           3HD      ARG  64  -8.824  -0.655   3.932
  521    HE   ARG  64           HE       ARG  64 -10.964  -2.370   2.814
  522   HH11  ARG  64          1HH1      ARG  64  -8.918   0.493   2.526
  523   HH12  ARG  64          2HH1      ARG  64  -9.739   1.074   1.113
  524   HH21  ARG  64          1HH2      ARG  64 -11.982  -1.630   0.935
  525   HH22  ARG  64          2HH2      ARG  64 -11.484  -0.137   0.205
  526    H    LEU  65           H        LEU  65  -6.288  -4.113   1.829
  527    HA   LEU  65           HA       LEU  65  -7.806  -4.352  -0.628
  528    HB2  LEU  65           2HB      LEU  65  -5.017  -3.276  -0.087
  529    HB3  LEU  65           3HB      LEU  65  -5.809  -3.211  -1.656
  530    HG   LEU  65           HG       LEU  65  -6.838  -1.851   0.863
  531   HD11  LEU  65          1HD1      LEU  65  -5.463  -0.632  -1.540
  532   HD12  LEU  65          2HD1      LEU  65  -4.759  -0.852   0.064
  533   HD13  LEU  65          3HD1      LEU  65  -6.127   0.235  -0.150
  534   HD21  LEU  65          3HD2      LEU  65  -8.422  -0.697  -0.637
  535   HD22  LEU  65          1HD2      LEU  65  -8.679  -2.440  -0.635
  536   HD23  LEU  65          2HD2      LEU  65  -7.857  -1.673  -1.997
  537    H    ALA  66           H        ALA  66  -5.080  -5.985   0.867
  538    HA   ALA  66           HA       ALA  66  -4.094  -7.463  -1.302
  539    HB1  ALA  66           3HB      ALA  66  -3.190  -9.015   0.371
  540    HB2  ALA  66           1HB      ALA  66  -4.247  -8.324   1.608
  541    HB3  ALA  66           2HB      ALA  66  -2.969  -7.343   0.890
  542    H    LYS  67           H        LYS  67  -6.609  -8.321   1.089
  543    HA   LYS  67           HA       LYS  67  -7.312 -10.769  -0.259
  544    HB2  LYS  67           2HB      LYS  67  -8.992 -11.036   1.466
  545    HB3  LYS  67           3HB      LYS  67  -7.484 -10.503   2.200
  546    HG2  LYS  67           2HG      LYS  67  -8.407  -8.177   2.311
  547    HG3  LYS  67           3HG      LYS  67  -9.941  -8.787   1.685
  548    HD2  LYS  67           2HD      LYS  67  -8.617  -9.542   4.323
  549    HD3  LYS  67           3HD      LYS  67 -10.076  -8.576   4.113
  550    HE2  LYS  67           2HE      LYS  67 -11.271 -10.534   3.222
  551    HE3  LYS  67           3HE      LYS  67  -9.805 -11.507   3.350
  552    HZ1  LYS  67           3HZ      LYS  67 -11.270 -10.277   5.623
  553    HZ2  LYS  67           1HZ      LYS  67  -9.851 -11.178   5.749
  554    HZ3  LYS  67           2HZ      LYS  67 -11.272 -11.915   5.213
  555    H    GLU  68           H        GLU  68  -8.388  -7.453  -0.426
  556    HA   GLU  68           HA       GLU  68 -10.959  -7.744  -1.545
  557    HB2  GLU  68           2HB      GLU  68 -10.026  -5.598  -0.685
  558    HB3  GLU  68           3HB      GLU  68  -8.891  -5.549  -2.025
  559    HG2  GLU  68           2HG      GLU  68 -10.743  -4.007  -2.393
  560    HG3  GLU  68           3HG      GLU  68 -10.739  -5.280  -3.611
  561    H    PHE  69           H        PHE  69  -7.781  -7.372  -3.096
  562    HA   PHE  69           HA       PHE  69  -8.882  -8.010  -5.744
  563    HB2  PHE  69           2HB      PHE  69  -6.085  -7.039  -5.009
  564    HB3  PHE  69           3HB      PHE  69  -6.775  -7.119  -6.630
  565    HD1  PHE  69           HD1      PHE  69  -9.108  -5.794  -6.885
  566    HD2  PHE  69           HD2      PHE  69  -6.125  -4.933  -3.941
  567    HE1  PHE  69           HE1      PHE  69 -10.030  -3.533  -6.589
  568    HE2  PHE  69           HE2      PHE  69  -7.057  -2.677  -3.656
  569    HZ   PHE  69           HZ       PHE  69  -9.011  -1.977  -4.975
  570    H    ASN  70           H        ASN  70  -7.789  -9.767  -3.235
  571    HA   ASN  70           HA       ASN  70  -6.914 -11.798  -2.840
  572    HB2  ASN  70           2HB      ASN  70  -8.754 -12.373  -4.519
  573    HB3  ASN  70           3HB      ASN  70  -7.517 -12.438  -5.765
  574   HD21  ASN  70          1HD2      ASN  70  -8.714 -13.952  -2.837
  575   HD22  ASN  70          2HD2      ASN  70  -7.934 -15.477  -3.073
  576    H    ILE  71           H        ILE  71  -5.179  -9.655  -3.737
  577    HA   ILE  71           HA       ILE  71  -2.879 -11.033  -4.982
  578    HB   ILE  71           HB       ILE  71  -1.862  -8.765  -5.170
  579   HG12  ILE  71          2HG1      ILE  71  -4.491  -7.747  -3.979
  580   HG13  ILE  71          3HG1      ILE  71  -2.903  -7.643  -3.228
  581   HG21  ILE  71          1HG2      ILE  71  -4.655  -8.909  -6.367
  582   HG22  ILE  71          2HG2      ILE  71  -3.198  -9.643  -7.040
  583   HG23  ILE  71          3HG2      ILE  71  -3.333  -7.887  -6.943
  584   HD11  ILE  71          3HD1      ILE  71  -2.167  -6.130  -5.025
  585   HD12  ILE  71          1HD1      ILE  71  -3.552  -5.507  -4.129
  586   HD13  ILE  71          2HD1      ILE  71  -3.786  -6.202  -5.731
  587    H    THR  72           H        THR  72  -0.775 -10.617  -4.054
  588    HA   THR  72           HA       THR  72  -0.722 -11.274  -1.238
  589    HB   THR  72           HB       THR  72   1.612 -10.925  -3.168
  590    HG1  THR  72           HG1      THR  72  -0.364 -12.727  -3.280
  591   HG21  THR  72          3HG2      THR  72   2.258 -11.108  -0.789
  592   HG22  THR  72          1HG2      THR  72   2.775 -12.519  -1.718
  593   HG23  THR  72          2HG2      THR  72   1.357 -12.620  -0.674
  594    H    VAL  73           H        VAL  73   0.339 -10.032   0.339
  595    HA   VAL  73           HA       VAL  73   1.519  -7.432  -0.395
  596    HB   VAL  73           HB       VAL  73  -0.876  -7.124   0.462
  597   HG11  VAL  73          1HG1      VAL  73  -1.316  -7.266   2.882
  598   HG12  VAL  73          2HG1      VAL  73   0.286  -7.963   3.143
  599   HG13  VAL  73          3HG1      VAL  73  -0.920  -8.849   2.207
  600   HG21  VAL  73          3HG2      VAL  73  -0.345  -5.162   1.842
  601   HG22  VAL  73          1HG2      VAL  73   0.748  -5.269   0.463
  602   HG23  VAL  73          2HG2      VAL  73   1.306  -5.740   2.072
  603    H    THR  74           H        THR  74   3.164  -6.742   0.953
  604    HA   THR  74           HA       THR  74   3.684  -7.978   3.525
  605    HB   THR  74           HB       THR  74   4.986  -9.432   1.984
  606    HG1  THR  74           HG1      THR  74   5.803  -8.987   4.075
  607   HG21  THR  74          3HG2      THR  74   6.941  -8.580   0.749
  608   HG22  THR  74          1HG2      THR  74   6.531  -6.926   1.214
  609   HG23  THR  74          2HG2      THR  74   5.456  -7.835   0.150
  610    H    TYR  75           H        TYR  75   4.808  -6.522   4.886
  611    HA   TYR  75           HA       TYR  75   5.576  -3.910   3.860
  612    HB2  TYR  75           2HB      TYR  75   3.974  -2.755   5.511
  613    HB3  TYR  75           3HB      TYR  75   3.256  -3.435   4.058
  614    HD1  TYR  75           HD1      TYR  75   3.781  -4.106   7.710
  615    HD2  TYR  75           HD2      TYR  75   1.477  -5.054   4.228
  616    HE1  TYR  75           HE1      TYR  75   2.211  -5.390   9.089
  617    HE2  TYR  75           HE2      TYR  75  -0.091  -6.339   5.622
  618    HH   TYR  75           HH       TYR  75  -0.205  -7.430   7.741
  619    H    THR  76           H        THR  76   6.668  -2.582   5.397
  620    HA   THR  76           HA       THR  76   7.905  -4.107   7.627
  621    HB   THR  76           HB       THR  76   9.027  -1.719   6.078
  622    HG1  THR  76           HG1      THR  76   9.143  -3.447   4.707
  623   HG21  THR  76          3HG2      THR  76  11.168  -2.259   7.209
  624   HG22  THR  76          1HG2      THR  76  10.369  -3.524   8.133
  625   HG23  THR  76          2HG2      THR  76   9.921  -1.834   8.386
  626    H    ILE  77           H        ILE  77   7.179  -3.433   9.607
  627    HA   ILE  77           HA       ILE  77   7.071  -0.575  10.257
  628    HB   ILE  77           HB       ILE  77   4.909  -1.061  11.658
  629   HG12  ILE  77          2HG1      ILE  77   4.692  -3.318   9.610
  630   HG13  ILE  77          3HG1      ILE  77   4.753  -3.481  11.362
  631   HG21  ILE  77          1HG2      ILE  77   3.432  -0.339   9.852
  632   HG22  ILE  77          2HG2      ILE  77   4.652  -0.783   8.657
  633   HG23  ILE  77          3HG2      ILE  77   4.970   0.526   9.797
  634   HD11  ILE  77          3HD1      ILE  77   2.587  -2.433  11.565
  635   HD12  ILE  77          1HD1      ILE  77   2.508  -3.803  10.464
  636   HD13  ILE  77          2HD1      ILE  77   2.521  -2.156   9.822
  637    H    ARG  78           H        ARG  78   7.381  -0.120  12.444
  638    HA   ARG  78           HA       ARG  78   8.289  -2.332  14.188
  639    HB2  ARG  78           2HB      ARG  78   9.853   0.199  13.514
  640    HB3  ARG  78           3HB      ARG  78  10.269  -0.887  14.841
  641    HG2  ARG  78           2HG      ARG  78  10.538  -2.744  13.183
  642    HG3  ARG  78           3HG      ARG  78  10.231  -1.594  11.883
  643    HD2  ARG  78           2HD      ARG  78  12.247  -0.338  12.503
  644    HD3  ARG  78           3HD      ARG  78  12.534  -1.438  13.857
  645    HE   ARG  78           HE       ARG  78  12.377  -2.983  11.530
  646   HH11  ARG  78          1HH1      ARG  78  14.541  -0.569  12.903
  647   HH12  ARG  78          2HH1      ARG  78  15.940  -1.184  12.088
  648   HH21  ARG  78          1HH2      ARG  78  14.216  -3.772  10.463
  649   HH22  ARG  78          2HH2      ARG  78  15.756  -3.004  10.699
  650    H    GLY  79           H        GLY  79   9.201  -0.391  16.275
  651    HA2  GLY  79           2HA      GLY  79   8.037   1.605  17.268
  652    HA3  GLY  79           3HA      GLY  79   6.546   0.696  17.098
  653    H    SER  80           H        SER  80   6.523  -1.444  18.212
  654    HA   SER  80           HA       SER  80   7.017  -0.915  21.001
  655    HB2  SER  80           2HB      SER  80   4.859  -1.815  20.209
  656    HB3  SER  80           3HB      SER  80   5.657  -3.284  19.652
  657    HG   SER  80           HG       SER  80   5.906  -3.941  21.694
  658    H    LEU  81           H        LEU  81   8.235  -3.203  18.593
  659    HA   LEU  81           HA       LEU  81   9.785  -4.842  20.277
  660    HB2  LEU  81           2HB      LEU  81  11.144  -5.432  18.280
  661    HB3  LEU  81           3HB      LEU  81   9.421  -5.648  18.059
  662    HG   LEU  81           HG       LEU  81  10.566  -3.027  17.109
  663   HD11  LEU  81          1HD1      LEU  81  11.009  -5.577  15.534
  664   HD12  LEU  81          2HD1      LEU  81  12.266  -4.604  16.304
  665   HD13  LEU  81          3HD1      LEU  81  11.317  -3.926  14.983
  666   HD21  LEU  81          3HD2      LEU  81   8.484  -4.936  16.017
  667   HD22  LEU  81          1HD2      LEU  81   8.904  -3.373  15.318
  668   HD23  LEU  81          2HD2      LEU  81   8.187  -3.454  16.921
  669    H    GLU  82           H        GLU  82  10.412  -1.679  18.927
  670    HA   GLU  82           HA       GLU  82  13.157  -1.421  19.680
  671    HB2  GLU  82           2HB      GLU  82  11.012   0.756  19.424
  672    HB3  GLU  82           3HB      GLU  82  12.751   1.036  19.472
  673    HG2  GLU  82           2HG      GLU  82  13.040  -0.110  17.337
  674    HG3  GLU  82           3HG      GLU  82  11.334  -0.544  17.293
  675    H    HIS  83           H        HIS  83  13.360  -2.322  21.705
  676    HA   HIS  83           HA       HIS  83  11.442  -2.126  23.770
  677    HB2  HIS  83           2HB      HIS  83  13.243  -3.335  25.156
  678    HB3  HIS  83           3HB      HIS  83  12.679  -4.142  23.700
  679    HD1  HIS  83           HD1      HIS  83  14.502  -5.117  22.346
  680    HD2  HIS  83           HD2      HIS  83  15.831  -1.834  24.524
  681    HE1  HIS  83           HE1      HIS  83  16.958  -4.930  21.863
  682    HE2  HIS  83           HE2      HIS  83  17.753  -2.995  23.259
  683    H    HIS  84           H        HIS  84  11.439  -1.134  25.716
  684    HA   HIS  84           HA       HIS  84  13.458   0.957  26.314
  685    HB2  HIS  84           2HB      HIS  84  10.431   1.169  26.748
  686    HB3  HIS  84           3HB      HIS  84  11.626   2.393  27.178
  687    HD1  HIS  84           HD1      HIS  84   9.346   1.487  24.542
  688    HD2  HIS  84           HD2      HIS  84  13.031   3.397  24.710
  689    HE1  HIS  84           HE1      HIS  84   9.580   2.689  22.352
  690    HE2  HIS  84           HE2      HIS  84  11.908   3.636  22.403
  691    H    HIS  85           H        HIS  85  14.098   1.024  28.424
  692    HA   HIS  85           HA       HIS  85  13.727  -1.166  30.187
  693    HB2  HIS  85           2HB      HIS  85  14.776   1.647  30.812
  694    HB3  HIS  85           3HB      HIS  85  14.928   0.256  31.880
  695    HD1  HIS  85           HD1      HIS  85  17.005  -1.081  31.635
  696    HD2  HIS  85           HD2      HIS  85  16.310   1.317  28.319
  697    HE1  HIS  85           HE1      HIS  85  19.070  -1.263  30.222
  698    HE2  HIS  85           HE2      HIS  85  18.540   0.048  28.149
  699    H    HIS  86           H        HIS  86  11.928  -1.581  31.391
  700    HA   HIS  86           HA       HIS  86   9.833   0.377  31.789
  701    HB2  HIS  86           2HB      HIS  86  10.108  -2.466  32.880
  702    HB3  HIS  86           3HB      HIS  86   8.674  -1.462  33.054
  703    HD1  HIS  86           HD1      HIS  86   6.920  -2.121  31.449
  704    HD2  HIS  86           HD2      HIS  86  10.714  -2.719  29.851
  705    HE1  HIS  86           HE1      HIS  86   6.547  -3.090  29.168
  706    HE2  HIS  86           HE2      HIS  86   8.850  -3.518  28.258
  707    H    HIS  87           H        HIS  87  10.162   1.968  33.242
  708    HA   HIS  87           HA       HIS  87  11.093   1.452  35.948
  709    HB2  HIS  87           2HB      HIS  87  13.095   2.808  35.859
  710    HB3  HIS  87           3HB      HIS  87  13.220   1.659  34.535
  711    HD1  HIS  87           HD1      HIS  87  11.761   3.034  32.291
  712    HD2  HIS  87           HD2      HIS  87  14.220   5.117  34.915
  713    HE1  HIS  87           HE1      HIS  87  12.415   5.124  31.080
  714    HE2  HIS  87           HE2      HIS  87  13.679   6.468  32.789
  715    H    HIS  88           H        HIS  88  11.387   3.704  37.083
  716    HA   HIS  88           HA       HIS  88   9.503   5.737  36.017
  717    HB2  HIS  88           2HB      HIS  88  10.028   4.962  38.927
  718    HB3  HIS  88           3HB      HIS  88   9.158   6.414  38.448
  719    HD1  HIS  88           HD1      HIS  88   8.671   2.843  39.114
  720    HD2  HIS  88           HD2      HIS  88   6.646   5.846  37.067
  721    HE1  HIS  88           HE1      HIS  88   6.340   1.973  38.755
  722    HE2  HIS  88           HE2      HIS  88   5.102   3.873  37.681
  Start of MODEL    3
    1    H1   MET   1           1H       MET   1  13.776   5.527  12.110
    2    H2   MET   1           2H       MET   1  12.147   5.102  12.254
    3    H3   MET   1           3H       MET   1  12.619   6.718  12.424
    4    HA   MET   1           HA       MET   1  13.259   6.870  10.171
    5    HB2  MET   1           2HB      MET   1  14.039   4.497   9.943
    6    HB3  MET   1           3HB      MET   1  12.366   3.952   9.925
    7    HG2  MET   1           2HG      MET   1  13.294   4.004   7.662
    8    HG3  MET   1           3HG      MET   1  11.998   5.193   7.815
    9    HE1  MET   1           3HE      MET   1  15.943   4.697   7.682
   10    HE2  MET   1           1HE      MET   1  15.727   5.573   9.200
   11    HE3  MET   1           2HE      MET   1  16.495   6.365   7.824
   12    H    GLY   2           H        GLY   2  11.715   8.069   9.192
   13    HA2  GLY   2           2HA      GLY   2   8.945   7.812  10.101
   14    HA3  GLY   2           3HA      GLY   2   9.655   9.163   9.233
   15    H    GLU   3           H        GLU   3   9.541   5.673   8.425
   16    HA   GLU   3           HA       GLU   3   8.037   6.173   5.978
   17    HB2  GLU   3           2HB      GLU   3  10.321   6.876   5.381
   18    HB3  GLU   3           3HB      GLU   3  10.988   5.357   5.940
   19    HG2  GLU   3           2HG      GLU   3   8.971   5.311   3.689
   20    HG3  GLU   3           3HG      GLU   3  10.612   5.849   3.346
   21    H    MET   4           H        MET   4   6.925   4.429   5.404
   22    HA   MET   4           HA       MET   4   7.465   1.764   6.594
   23    HB2  MET   4           2HB      MET   4   5.362   2.668   7.479
   24    HB3  MET   4           3HB      MET   4   4.811   3.111   5.866
   25    HG2  MET   4           2HG      MET   4   4.700   0.710   5.266
   26    HG3  MET   4           3HG      MET   4   5.220   0.290   6.903
   27    HE1  MET   4           3HE      MET   4   2.683  -1.055   5.855
   28    HE2  MET   4           1HE      MET   4   1.518  -0.764   7.145
   29    HE3  MET   4           2HE      MET   4   3.182  -1.187   7.544
   30    H    ASP   5           H        ASP   5   7.536   0.003   5.086
   31    HA   ASP   5           HA       ASP   5   7.144   0.651   2.242
   32    HB2  ASP   5           2HB      ASP   5   9.349  -0.325   2.895
   33    HB3  ASP   5           3HB      ASP   5   8.545  -1.696   3.648
   34    H    ILE   6           H        ILE   6   5.299  -0.122   1.352
   35    HA   ILE   6           HA       ILE   6   4.085  -2.631   2.349
   36    HB   ILE   6           HB       ILE   6   2.578  -0.303   1.010
   37   HG12  ILE   6          2HG1      ILE   6   2.515  -1.089   3.967
   38   HG13  ILE   6          3HG1      ILE   6   3.333   0.324   3.315
   39   HG21  ILE   6          1HG2      ILE   6   1.532  -2.854   2.311
   40   HG22  ILE   6          2HG2      ILE   6   1.597  -2.523   0.579
   41   HG23  ILE   6          3HG2      ILE   6   0.542  -1.568   1.618
   42   HD11  ILE   6          3HD1      ILE   6   1.182   1.229   2.580
   43   HD12  ILE   6          1HD1      ILE   6   1.239   0.937   4.317
   44   HD13  ILE   6          2HD1      ILE   6   0.364  -0.178   3.270
   45    H    ARG   7           H        ARG   7   4.798  -4.063   0.826
   46    HA   ARG   7           HA       ARG   7   4.800  -3.284  -2.021
   47    HB2  ARG   7           2HB      ARG   7   6.978  -4.068  -1.063
   48    HB3  ARG   7           3HB      ARG   7   6.249  -5.634  -0.717
   49    HG2  ARG   7           2HG      ARG   7   5.858  -6.006  -3.124
   50    HG3  ARG   7           3HG      ARG   7   6.533  -4.416  -3.495
   51    HD2  ARG   7           2HD      ARG   7   8.015  -6.776  -2.285
   52    HD3  ARG   7           3HD      ARG   7   8.187  -6.145  -3.926
   53    HE   ARG   7           HE       ARG   7   9.049  -4.795  -1.447
   54   HH11  ARG   7          1HH1      ARG   7   9.320  -5.113  -4.957
   55   HH12  ARG   7          2HH1      ARG   7  10.681  -4.039  -5.056
   56   HH21  ARG   7          1HH2      ARG   7  10.801  -3.420  -1.593
   57   HH22  ARG   7          2HH2      ARG   7  11.520  -3.075  -3.134
   58    H    PHE   8           H        PHE   8   3.338  -4.126  -3.310
   59    HA   PHE   8           HA       PHE   8   1.669  -6.438  -2.510
   60    HB2  PHE   8           2HB      PHE   8   1.169  -4.133  -4.462
   61    HB3  PHE   8           3HB      PHE   8   0.164  -5.574  -4.425
   62    HD1  PHE   8           HD2      PHE   8  -1.378  -5.996  -2.545
   63    HD2  PHE   8           HD1      PHE   8   0.994  -2.437  -2.676
   64    HE1  PHE   8           HE2      PHE   8  -2.824  -4.969  -0.840
   65    HE2  PHE   8           HE1      PHE   8  -0.457  -1.424  -0.972
   66    HZ   PHE   8           HZ       PHE   8  -2.366  -2.678  -0.052
   67    H    ARG   9           H        ARG   9   1.698  -8.227  -3.822
   68    HA   ARG   9           HA       ARG   9   3.010  -8.094  -6.470
   69    HB2  ARG   9           2HB      ARG   9   4.304  -9.352  -4.515
   70    HB3  ARG   9           3HB      ARG   9   3.120 -10.623  -4.751
   71    HG2  ARG   9           2HG      ARG   9   4.913  -9.560  -6.968
   72    HG3  ARG   9           3HG      ARG   9   5.321 -10.943  -5.957
   73    HD2  ARG   9           2HD      ARG   9   3.456 -12.223  -6.840
   74    HD3  ARG   9           3HD      ARG   9   2.839 -10.813  -7.705
   75    HE   ARG   9           HE       ARG   9   4.845 -10.892  -9.101
   76   HH11  ARG   9          1HH1      ARG   9   4.005 -13.851  -7.390
   77   HH12  ARG   9          2HH1      ARG   9   4.842 -14.870  -8.517
   78   HH21  ARG   9          1HH2      ARG   9   5.897 -12.221 -10.563
   79   HH22  ARG   9          2HH2      ARG   9   5.920 -13.940 -10.324
   80    H    GLY  10           H        GLY  10   1.749  -8.917  -8.083
   81    HA2  GLY  10           2HA      GLY  10  -0.596 -10.593  -7.423
   82    HA3  GLY  10           3HA      GLY  10  -0.859  -9.051  -8.237
   83    H    ASP  11           H        ASP  11  -1.628 -11.498  -9.290
   84    HA   ASP  11           HA       ASP  11   0.150 -12.286 -11.419
   85    HB2  ASP  11           2HB      ASP  11  -1.541 -13.833 -10.471
   86    HB3  ASP  11           3HB      ASP  11  -2.838 -12.781 -11.019
   87    H    ASP  12           H        ASP  12  -2.345  -9.875 -10.973
   88    HA   ASP  12           HA       ASP  12  -1.965  -8.957 -13.750
   89    HB2  ASP  12           2HB      ASP  12  -4.214  -8.102 -13.750
   90    HB3  ASP  12           3HB      ASP  12  -4.262  -9.806 -13.381
   91    H    LEU  13           H        LEU  13  -1.232  -6.974 -14.008
   92    HA   LEU  13           HA       LEU  13  -0.152  -5.391 -11.948
   93    HB2  LEU  13           2HB      LEU  13   0.366  -5.565 -14.520
   94    HB3  LEU  13           3HB      LEU  13  -0.840  -4.315 -14.717
   95    HG   LEU  13           HG       LEU  13   1.658  -3.949 -12.992
   96   HD11  LEU  13          1HD1      LEU  13   1.303  -3.232 -15.928
   97   HD12  LEU  13          2HD1      LEU  13   2.386  -4.457 -15.261
   98   HD13  LEU  13          3HD1      LEU  13   2.669  -2.756 -14.910
   99   HD21  LEU  13          3HD2      LEU  13  -0.128  -2.309 -12.534
  100   HD22  LEU  13          1HD2      LEU  13  -0.167  -1.864 -14.241
  101   HD23  LEU  13          2HD2      LEU  13   1.277  -1.547 -13.274
  102    H    GLU  14           H        GLU  14  -3.349  -5.500 -13.287
  103    HA   GLU  14           HA       GLU  14  -4.207  -2.828 -12.860
  104    HB2  GLU  14           2HB      GLU  14  -5.781  -5.420 -13.123
  105    HB3  GLU  14           3HB      GLU  14  -6.553  -3.844 -12.966
  106    HG2  GLU  14           2HG      GLU  14  -6.519  -4.531 -15.288
  107    HG3  GLU  14           3HG      GLU  14  -5.503  -3.108 -15.068
  108    H    ALA  15           H        ALA  15  -4.565  -5.797 -10.905
  109    HA   ALA  15           HA       ALA  15  -6.122  -4.707  -8.826
  110    HB1  ALA  15           3HB      ALA  15  -5.462  -6.734  -7.587
  111    HB2  ALA  15           1HB      ALA  15  -4.208  -7.059  -8.793
  112    HB3  ALA  15           2HB      ALA  15  -5.908  -7.111  -9.256
  113    H    LEU  16           H        LEU  16  -2.651  -4.773  -9.389
  114    HA   LEU  16           HA       LEU  16  -1.744  -3.826  -6.875
  115    HB2  LEU  16           2HB      LEU  16  -0.480  -3.325  -9.605
  116    HB3  LEU  16           3HB      LEU  16   0.329  -3.215  -8.050
  117    HG   LEU  16           HG       LEU  16  -0.692  -5.774  -9.358
  118   HD11  LEU  16          1HD1      LEU  16   1.307  -4.861 -10.458
  119   HD12  LEU  16          2HD1      LEU  16   1.677  -6.361  -9.614
  120   HD13  LEU  16          3HD1      LEU  16   2.158  -4.814  -8.910
  121   HD21  LEU  16          3HD2      LEU  16  -0.900  -5.923  -6.924
  122   HD22  LEU  16          1HD2      LEU  16   0.788  -5.438  -6.729
  123   HD23  LEU  16          2HD2      LEU  16   0.388  -6.972  -7.509
  124    H    GLU  17           H        GLU  17  -2.807  -2.194  -9.857
  125    HA   GLU  17           HA       GLU  17  -2.208   0.478  -9.128
  126    HB2  GLU  17           2HB      GLU  17  -4.332  -0.501 -11.095
  127    HB3  GLU  17           3HB      GLU  17  -3.679   1.134 -11.003
  128    HG2  GLU  17           2HG      GLU  17  -1.452   0.290 -11.644
  129    HG3  GLU  17           3HG      GLU  17  -2.099  -1.346 -11.731
  130    H    LYS  18           H        LYS  18  -5.218  -1.433  -8.769
  131    HA   LYS  18           HA       LYS  18  -6.794   0.766  -7.799
  132    HB2  LYS  18           2HB      LYS  18  -7.241  -2.242  -7.754
  133    HB3  LYS  18           3HB      LYS  18  -8.355  -1.142  -6.960
  134    HG2  LYS  18           2HG      LYS  18  -9.312  -1.672  -9.073
  135    HG3  LYS  18           3HG      LYS  18  -8.723  -0.013  -9.202
  136    HD2  LYS  18           2HD      LYS  18  -6.708  -0.839 -10.390
  137    HD3  LYS  18           3HD      LYS  18  -7.306  -2.493 -10.244
  138    HE2  LYS  18           2HE      LYS  18  -7.779  -1.729 -12.468
  139    HE3  LYS  18           3HE      LYS  18  -9.313  -1.811 -11.601
  140    HZ1  LYS  18           3HZ      LYS  18  -9.099   0.204 -12.931
  141    HZ2  LYS  18           1HZ      LYS  18  -7.725   0.659 -12.058
  142    HZ3  LYS  18           2HZ      LYS  18  -9.228   0.575 -11.287
  143    H    ALA  19           H        ALA  19  -4.960  -1.870  -6.197
  144    HA   ALA  19           HA       ALA  19  -5.465  -1.132  -3.514
  145    HB1  ALA  19           3HB      ALA  19  -3.421  -2.416  -2.992
  146    HB2  ALA  19           1HB      ALA  19  -2.994  -2.433  -4.709
  147    HB3  ALA  19           2HB      ALA  19  -4.441  -3.273  -4.149
  148    H    LEU  20           H        LEU  20  -2.888  -0.193  -5.752
  149    HA   LEU  20           HA       LEU  20  -1.298   1.483  -4.226
  150    HB2  LEU  20           2HB      LEU  20  -0.684   0.737  -6.486
  151    HB3  LEU  20           3HB      LEU  20  -1.987   1.672  -7.188
  152    HG   LEU  20           HG       LEU  20  -0.839   3.776  -6.572
  153   HD11  LEU  20          1HD1      LEU  20   1.435   3.792  -5.672
  154   HD12  LEU  20          2HD1      LEU  20   1.384   2.039  -5.460
  155   HD13  LEU  20          3HD1      LEU  20   0.296   3.078  -4.534
  156   HD21  LEU  20          3HD2      LEU  20   0.978   1.871  -8.099
  157   HD22  LEU  20          1HD2      LEU  20   1.040   3.637  -8.149
  158   HD23  LEU  20          2HD2      LEU  20  -0.371   2.790  -8.773
  159    H    LYS  21           H        LYS  21  -4.186   2.265  -6.109
  160    HA   LYS  21           HA       LYS  21  -4.241   5.046  -5.868
  161    HB2  LYS  21           2HB      LYS  21  -5.678   3.834  -7.439
  162    HB3  LYS  21           3HB      LYS  21  -6.514   3.028  -6.118
  163    HG2  LYS  21           2HG      LYS  21  -7.478   5.204  -5.398
  164    HG3  LYS  21           3HG      LYS  21  -6.627   6.011  -6.718
  165    HD2  LYS  21           2HD      LYS  21  -8.979   5.629  -7.308
  166    HD3  LYS  21           3HD      LYS  21  -7.919   4.699  -8.369
  167    HE2  LYS  21           2HE      LYS  21  -9.805   3.323  -7.736
  168    HE3  LYS  21           3HE      LYS  21  -8.368   2.675  -6.944
  169    HZ1  LYS  21           3HZ      LYS  21  -9.045   3.804  -4.905
  170    HZ2  LYS  21           1HZ      LYS  21 -10.256   2.753  -5.438
  171    HZ3  LYS  21           2HZ      LYS  21 -10.417   4.417  -5.674
  172    H    GLU  22           H        GLU  22  -5.567   2.515  -3.770
  173    HA   GLU  22           HA       GLU  22  -6.774   4.311  -1.893
  174    HB2  GLU  22           2HB      GLU  22  -6.149   1.342  -1.717
  175    HB3  GLU  22           3HB      GLU  22  -7.079   2.234  -0.515
  176    HG2  GLU  22           2HG      GLU  22  -7.848   1.892  -3.430
  177    HG3  GLU  22           3HG      GLU  22  -8.509   0.962  -2.089
  178    H    MET  23           H        MET  23  -3.662   2.487  -1.903
  179    HA   MET  23           HA       MET  23  -2.769   3.213   0.645
  180    HB2  MET  23           2HB      MET  23  -1.156   2.713  -1.884
  181    HB3  MET  23           3HB      MET  23  -0.486   2.737  -0.259
  182    HG2  MET  23           2HG      MET  23  -2.694   0.794  -0.848
  183    HG3  MET  23           3HG      MET  23  -1.091   0.469  -1.486
  184    HE1  MET  23           3HE      MET  23  -2.492   1.874   1.991
  185    HE2  MET  23           1HE      MET  23  -2.223   0.442   2.984
  186    HE3  MET  23           2HE      MET  23  -3.382   0.387   1.657
  187    H    ILE  24           H        ILE  24  -2.421   4.882  -2.470
  188    HA   ILE  24           HA       ILE  24  -0.871   7.097  -1.639
  189    HB   ILE  24           HB       ILE  24  -2.803   6.715  -3.985
  190   HG12  ILE  24          2HG1      ILE  24   0.258   6.778  -3.873
  191   HG13  ILE  24          3HG1      ILE  24  -0.739   5.349  -4.112
  192   HG21  ILE  24          1HG2      ILE  24  -2.760   9.112  -3.479
  193   HG22  ILE  24          2HG2      ILE  24  -1.920   8.789  -4.993
  194   HG23  ILE  24          3HG2      ILE  24  -0.995   9.112  -3.525
  195   HD11  ILE  24          3HD1      ILE  24  -1.507   6.269  -6.266
  196   HD12  ILE  24          1HD1      ILE  24   0.240   6.049  -6.195
  197   HD13  ILE  24          2HD1      ILE  24  -0.447   7.663  -6.028
  198    H    ARG  25           H        ARG  25  -4.334   6.579  -1.976
  199    HA   ARG  25           HA       ARG  25  -5.400   9.060  -1.347
  200    HB2  ARG  25           2HB      ARG  25  -6.684   7.193  -2.302
  201    HB3  ARG  25           3HB      ARG  25  -6.465   6.249  -0.837
  202    HG2  ARG  25           2HG      ARG  25  -7.864   7.936   0.394
  203    HG3  ARG  25           3HG      ARG  25  -8.148   8.754  -1.146
  204    HD2  ARG  25           2HD      ARG  25  -9.190   6.704  -2.050
  205    HD3  ARG  25           3HD      ARG  25  -8.885   5.874  -0.519
  206    HE   ARG  25           HE       ARG  25 -10.453   8.281  -0.276
  207   HH11  ARG  25          1HH1      ARG  25 -10.619   4.800  -0.849
  208   HH12  ARG  25          2HH1      ARG  25 -12.274   4.680  -0.337
  209   HH21  ARG  25          1HH2      ARG  25 -12.635   8.111   0.363
  210   HH22  ARG  25          2HH2      ARG  25 -13.414   6.562   0.348
  211    H    GLN  26           H        GLN  26  -4.673   6.324   0.829
  212    HA   GLN  26           HA       GLN  26  -5.571   7.543   3.229
  213    HB2  GLN  26           2HB      GLN  26  -3.505   5.322   2.902
  214    HB3  GLN  26           3HB      GLN  26  -4.324   5.749   4.399
  215    HG2  GLN  26           2HG      GLN  26  -5.580   4.519   1.933
  216    HG3  GLN  26           3HG      GLN  26  -5.270   3.719   3.465
  217   HE21  GLN  26          1HE2      GLN  26  -7.768   3.986   2.016
  218   HE22  GLN  26          2HE2      GLN  26  -8.869   4.797   3.068
  219    H    ALA  27           H        ALA  27  -2.329   7.141   1.798
  220    HA   ALA  27           HA       ALA  27  -0.761   8.321   3.765
  221    HB1  ALA  27           3HB      ALA  27   0.934   8.597   2.004
  222    HB2  ALA  27           1HB      ALA  27  -0.304   8.320   0.769
  223    HB3  ALA  27           2HB      ALA  27   0.135   7.028   1.886
  224    H    ARG  28           H        ARG  28  -2.472   9.834   1.058
  225    HA   ARG  28           HA       ARG  28  -1.369  12.451   1.401
  226    HB2  ARG  28           2HB      ARG  28  -3.798  11.479  -0.167
  227    HB3  ARG  28           3HB      ARG  28  -3.229  13.145  -0.182
  228    HG2  ARG  28           2HG      ARG  28  -1.008  12.253  -1.073
  229    HG3  ARG  28           3HG      ARG  28  -1.809  10.698  -1.282
  230    HD2  ARG  28           2HD      ARG  28  -3.361  11.611  -2.869
  231    HD3  ARG  28           3HD      ARG  28  -2.863  13.268  -2.512
  232    HE   ARG  28           HE       ARG  28  -0.571  12.294  -3.408
  233   HH11  ARG  28          1HH1      ARG  28  -3.793  11.828  -4.758
  234   HH12  ARG  28          2HH1      ARG  28  -3.220  11.676  -6.392
  235   HH21  ARG  28          1HH2      ARG  28   0.168  12.144  -5.550
  236   HH22  ARG  28          2HH2      ARG  28  -0.961  11.856  -6.832
  237    H    LYS  29           H        LYS  29  -4.456  10.905   2.423
  238    HA   LYS  29           HA       LYS  29  -5.609  13.337   3.441
  239    HB2  LYS  29           2HB      LYS  29  -7.405  11.979   4.356
  240    HB3  LYS  29           3HB      LYS  29  -7.027  11.419   2.731
  241    HG2  LYS  29           2HG      LYS  29  -5.757   9.526   3.698
  242    HG3  LYS  29           3HG      LYS  29  -6.181  10.076   5.318
  243    HD2  LYS  29           2HD      LYS  29  -8.151   9.142   3.184
  244    HD3  LYS  29           3HD      LYS  29  -7.616   8.200   4.576
  245    HE2  LYS  29           2HE      LYS  29  -8.611   9.973   6.069
  246    HE3  LYS  29           3HE      LYS  29  -9.269  10.747   4.627
  247    HZ1  LYS  29           3HZ      LYS  29  -9.890   7.991   5.552
  248    HZ2  LYS  29           1HZ      LYS  29 -10.524   8.728   4.167
  249    HZ3  LYS  29           2HZ      LYS  29 -10.900   9.337   5.699
  250    H    PHE  30           H        PHE  30  -3.586  10.822   4.849
  251    HA   PHE  30           HA       PHE  30  -3.777  11.810   7.573
  252    HB2  PHE  30           2HB      PHE  30  -1.961   9.764   6.241
  253    HB3  PHE  30           3HB      PHE  30  -1.813  10.193   7.939
  254    HD1  PHE  30           HD1      PHE  30  -4.271  10.104   9.210
  255    HD2  PHE  30           HD2      PHE  30  -3.068   7.740   5.858
  256    HE1  PHE  30           HE1      PHE  30  -5.872   8.346   9.853
  257    HE2  PHE  30           HE2      PHE  30  -4.676   6.002   6.498
  258    HZ   PHE  30           HZ       PHE  30  -6.070   6.292   8.492
  259    H    ALA  31           H        ALA  31  -2.403  13.194   4.949
  260    HA   ALA  31           HA       ALA  31  -1.075  14.972   4.620
  261    HB1  ALA  31           3HB      ALA  31  -0.849  15.125   7.643
  262    HB2  ALA  31           1HB      ALA  31  -2.095  15.895   6.659
  263    HB3  ALA  31           2HB      ALA  31  -0.411  16.399   6.502
  264    H    GLY  32           H        GLY  32  -0.020  12.262   4.767
  265    HA2  GLY  32           2HA      GLY  32   2.865  12.837   5.117
  266    HA3  GLY  32           3HA      GLY  32   2.128  11.243   4.998
  267    H    THR  33           H        THR  33   4.096  11.357   3.402
  268    HA   THR  33           HA       THR  33   3.201  12.122   0.686
  269    HB   THR  33           HB       THR  33   6.035  11.572   1.736
  270    HG1  THR  33           HG1      THR  33   4.636  14.002   1.194
  271   HG21  THR  33          3HG2      THR  33   5.833  11.096  -0.682
  272   HG22  THR  33          1HG2      THR  33   6.805  12.541  -0.396
  273   HG23  THR  33          2HG2      THR  33   5.136  12.698  -0.946
  274    H    VAL  34           H        VAL  34   3.651  10.496  -1.029
  275    HA   VAL  34           HA       VAL  34   4.078   7.732  -0.144
  276    HB   VAL  34           HB       VAL  34   1.664   7.959  -0.136
  277   HG11  VAL  34          1HG1      VAL  34   0.331   8.629  -2.088
  278   HG12  VAL  34          2HG1      VAL  34   1.810   8.979  -2.985
  279   HG13  VAL  34          3HG1      VAL  34   1.400   9.929  -1.556
  280   HG21  VAL  34          3HG2      VAL  34   1.017   6.207  -1.762
  281   HG22  VAL  34          1HG2      VAL  34   2.533   5.816  -0.946
  282   HG23  VAL  34          2HG2      VAL  34   2.553   6.420  -2.604
  283    H    THR  35           H        THR  35   5.431   6.741  -1.428
  284    HA   THR  35           HA       THR  35   5.974   7.655  -4.201
  285    HB   THR  35           HB       THR  35   7.944   6.290  -2.278
  286    HG1  THR  35           HG1      THR  35   7.225   8.507  -1.685
  287   HG21  THR  35          3HG2      THR  35   9.672   7.069  -3.847
  288   HG22  THR  35          1HG2      THR  35   8.440   7.792  -4.886
  289   HG23  THR  35          2HG2      THR  35   8.512   6.038  -4.682
  290    H    TYR  36           H        TYR  36   6.467   5.864  -5.704
  291    HA   TYR  36           HA       TYR  36   6.050   3.139  -4.792
  292    HB2  TYR  36           2HB      TYR  36   4.168   2.660  -6.327
  293    HB3  TYR  36           3HB      TYR  36   3.738   3.842  -5.101
  294    HD1  TYR  36           HD2      TYR  36   3.326   6.217  -5.731
  295    HD2  TYR  36           HD1      TYR  36   4.227   3.272  -8.697
  296    HE1  TYR  36           HE2      TYR  36   2.540   7.742  -7.485
  297    HE2  TYR  36           HE1      TYR  36   3.440   4.799 -10.448
  298    HH   TYR  36           HH       TYR  36   1.935   6.757 -10.669
  299    H    THR  37           H        THR  37   6.854   1.596  -6.110
  300    HA   THR  37           HA       THR  37   8.108   2.354  -8.677
  301    HB   THR  37           HB       THR  37   8.919   0.004  -6.874
  302    HG1  THR  37           HG1      THR  37   9.904   1.436  -5.691
  303   HG21  THR  37          3HG2      THR  37   9.567  -0.206  -9.273
  304   HG22  THR  37          1HG2      THR  37  10.978  -0.010  -8.232
  305   HG23  THR  37          2HG2      THR  37  10.390   1.354  -9.186
  306    H    LEU  38           H        LEU  38   6.821   1.590 -10.317
  307    HA   LEU  38           HA       LEU  38   5.336  -0.920 -10.021
  308    HB2  LEU  38           2HB      LEU  38   5.356   1.253 -12.138
  309    HB3  LEU  38           3HB      LEU  38   4.605  -0.303 -12.460
  310    HG   LEU  38           HG       LEU  38   3.789   1.561 -10.182
  311   HD11  LEU  38          1HD1      LEU  38   3.227   2.548 -12.361
  312   HD12  LEU  38          2HD1      LEU  38   1.782   2.059 -11.483
  313   HD13  LEU  38          3HD1      LEU  38   2.371   1.073 -12.824
  314   HD21  LEU  38          3HD2      LEU  38   1.832   0.096  -9.950
  315   HD22  LEU  38          1HD2      LEU  38   3.333  -0.782  -9.661
  316   HD23  LEU  38          2HD2      LEU  38   2.473  -0.984 -11.192
  317    H    ASP  39           H        ASP  39   6.077  -2.747 -10.700
  318    HA   ASP  39           HA       ASP  39   8.309  -2.989 -12.634
  319    HB2  ASP  39           2HB      ASP  39   9.121  -3.067 -10.218
  320    HB3  ASP  39           3HB      ASP  39   8.076  -4.449  -9.951
  321    H    GLY  40           H        GLY  40   8.466  -5.535 -13.133
  322    HA2  GLY  40           2HA      GLY  40   6.102  -6.307 -14.403
  323    HA3  GLY  40           3HA      GLY  40   7.495  -7.338 -14.128
  324    H    ASN  41           H        ASN  41   4.393  -6.336 -12.978
  325    HA   ASN  41           HA       ASN  41   2.859  -7.082 -11.529
  326    HB2  ASN  41           2HB      ASN  41   4.269  -9.674 -12.187
  327    HB3  ASN  41           3HB      ASN  41   2.945  -9.653 -11.028
  328   HD21  ASN  41          1HD2      ASN  41   0.898  -8.823 -11.750
  329   HD22  ASN  41          2HD2      ASN  41   0.432  -9.003 -13.405
  330    H    ASP  42           H        ASP  42   5.036  -5.791 -10.429
  331    HA   ASP  42           HA       ASP  42   4.706  -6.623  -7.643
  332    HB2  ASP  42           2HB      ASP  42   6.847  -7.700  -8.450
  333    HB3  ASP  42           3HB      ASP  42   7.497  -6.104  -8.805
  334    H    LEU  43           H        LEU  43   4.678  -4.872  -6.251
  335    HA   LEU  43           HA       LEU  43   5.193  -2.158  -7.307
  336    HB2  LEU  43           2HB      LEU  43   2.852  -2.518  -7.729
  337    HB3  LEU  43           3HB      LEU  43   2.606  -3.273  -6.162
  338    HG   LEU  43           HG       LEU  43   2.986  -1.047  -5.062
  339   HD11  LEU  43          1HD1      LEU  43   4.355   0.065  -6.745
  340   HD12  LEU  43          2HD1      LEU  43   2.922   1.020  -6.371
  341   HD13  LEU  43          3HD1      LEU  43   2.993   0.089  -7.866
  342   HD21  LEU  43          3HD2      LEU  43   0.735  -1.894  -5.518
  343   HD22  LEU  43          1HD2      LEU  43   0.745  -1.102  -7.097
  344   HD23  LEU  43          2HD2      LEU  43   0.796  -0.136  -5.620
  345    H    GLU  44           H        GLU  44   6.812  -1.568  -5.945
  346    HA   GLU  44           HA       GLU  44   6.703  -1.945  -3.043
  347    HB2  GLU  44           2HB      GLU  44   8.889  -2.027  -4.193
  348    HB3  GLU  44           3HB      GLU  44   8.626  -0.436  -4.896
  349    HG2  GLU  44           2HG      GLU  44   8.592   0.470  -2.487
  350    HG3  GLU  44           3HG      GLU  44   9.171  -1.114  -1.985
  351    H    ILE  45           H        ILE  45   5.674  -0.467  -1.718
  352    HA   ILE  45           HA       ILE  45   5.289   2.350  -2.680
  353    HB   ILE  45           HB       ILE  45   3.475   0.762  -0.779
  354   HG12  ILE  45          2HG1      ILE  45   2.908   1.665  -3.650
  355   HG13  ILE  45          3HG1      ILE  45   3.341   0.026  -3.181
  356   HG21  ILE  45          1HG2      ILE  45   3.104   3.586  -1.861
  357   HG22  ILE  45          2HG2      ILE  45   3.484   3.149  -0.195
  358   HG23  ILE  45          3HG2      ILE  45   1.930   2.692  -0.889
  359   HD11  ILE  45          3HD1      ILE  45   1.289  -0.134  -1.855
  360   HD12  ILE  45          1HD1      ILE  45   0.981   0.204  -3.557
  361   HD13  ILE  45          2HD1      ILE  45   0.842   1.497  -2.369
  362    H    ARG  46           H        ARG  46   6.245   3.883  -1.417
  363    HA   ARG  46           HA       ARG  46   7.099   3.199   1.341
  364    HB2  ARG  46           2HB      ARG  46   8.506   5.079  -0.614
  365    HB3  ARG  46           3HB      ARG  46   9.041   4.668   1.017
  366    HG2  ARG  46           2HG      ARG  46   9.282   2.269   0.262
  367    HG3  ARG  46           3HG      ARG  46   8.912   2.806  -1.380
  368    HD2  ARG  46           2HD      ARG  46  11.313   2.629  -1.138
  369    HD3  ARG  46           3HD      ARG  46  10.887   4.340  -1.276
  370    HE   ARG  46           HE       ARG  46  11.186   3.207   1.417
  371   HH11  ARG  46          1HH1      ARG  46  12.589   5.257  -1.106
  372   HH12  ARG  46          2HH1      ARG  46  13.733   5.990  -0.021
  373   HH21  ARG  46          1HH2      ARG  46  12.713   4.150   2.799
  374   HH22  ARG  46          2HH2      ARG  46  13.805   5.362   2.191
  375    H    ILE  47           H        ILE  47   5.669   4.172   2.601
  376    HA   ILE  47           HA       ILE  47   4.605   6.850   1.955
  377    HB   ILE  47           HB       ILE  47   3.656   4.862   4.086
  378   HG12  ILE  47          2HG1      ILE  47   2.455   5.541   1.347
  379   HG13  ILE  47          3HG1      ILE  47   3.249   4.031   1.774
  380   HG21  ILE  47          1HG2      ILE  47   1.673   6.355   4.288
  381   HG22  ILE  47          2HG2      ILE  47   2.415   7.490   3.154
  382   HG23  ILE  47          3HG2      ILE  47   3.167   7.192   4.724
  383   HD11  ILE  47          3HD1      ILE  47   0.866   3.751   1.732
  384   HD12  ILE  47          1HD1      ILE  47   0.646   5.054   2.900
  385   HD13  ILE  47          2HD1      ILE  47   1.453   3.558   3.382
  386    H    THR  48           H        THR  48   5.456   8.551   2.944
  387    HA   THR  48           HA       THR  48   7.089   8.279   5.395
  388    HB   THR  48           HB       THR  48   7.332  10.304   3.099
  389    HG1  THR  48           HG1      THR  48   8.004   8.004   2.731
  390   HG21  THR  48          3HG2      THR  48   9.235   9.821   5.428
  391   HG22  THR  48          1HG2      THR  48   8.180  11.227   5.241
  392   HG23  THR  48          2HG2      THR  48   9.486  10.945   4.090
  393    H    GLY  49           H        GLY  49   6.995  10.338   6.778
  394    HA2  GLY  49           2HA      GLY  49   6.125  12.448   7.355
  395    HA3  GLY  49           3HA      GLY  49   4.814  12.246   6.202
  396    H    VAL  50           H        VAL  50   3.662   9.943   6.886
  397    HA   VAL  50           HA       VAL  50   2.085  10.584   9.123
  398    HB   VAL  50           HB       VAL  50   1.001   8.401   8.786
  399   HG11  VAL  50          1HG1      VAL  50   0.291   8.666   6.434
  400   HG12  VAL  50          2HG1      VAL  50   1.664   9.735   6.127
  401   HG13  VAL  50          3HG1      VAL  50   0.393  10.224   7.251
  402   HG21  VAL  50          3HG2      VAL  50   1.794   6.776   7.100
  403   HG22  VAL  50          1HG2      VAL  50   2.973   6.984   8.395
  404   HG23  VAL  50          2HG2      VAL  50   3.244   7.750   6.830
  405    HA   PRO  51           HA       PRO  51   4.639   8.875  12.491
  406    HB2  PRO  51           2HB      PRO  51   2.637   8.536  14.403
  407    HB3  PRO  51           3HB      PRO  51   3.413  10.087  14.042
  408    HG2  PRO  51           2HG      PRO  51   0.775   9.038  13.105
  409    HG3  PRO  51           3HG      PRO  51   1.217  10.680  13.624
  410    HD2  PRO  51           2HD      PRO  51   0.961  10.019  11.002
  411    HD3  PRO  51           3HD      PRO  51   2.132  11.234  11.560
  412    H    GLU  52           H        GLU  52   4.776   6.884  13.879
  413    HA   GLU  52           HA       GLU  52   4.594   4.598  12.263
  414    HB2  GLU  52           2HB      GLU  52   6.209   5.055  14.209
  415    HB3  GLU  52           3HB      GLU  52   4.918   4.552  15.289
  416    HG2  GLU  52           2HG      GLU  52   6.331   2.667  15.014
  417    HG3  GLU  52           3HG      GLU  52   4.894   2.323  14.050
  418    H    GLN  53           H        GLN  53   2.557   5.712  14.925
  419    HA   GLN  53           HA       GLN  53   0.837   3.582  15.328
  420    HB2  GLN  53           2HB      GLN  53  -0.819   5.276  16.118
  421    HB3  GLN  53           3HB      GLN  53   0.799   5.578  16.749
  422    HG2  GLN  53           2HG      GLN  53   1.147   7.379  15.152
  423    HG3  GLN  53           3HG      GLN  53  -0.381   7.021  14.354
  424   HE21  GLN  53          1HE2      GLN  53  -2.332   7.657  15.364
  425   HE22  GLN  53          2HE2      GLN  53  -2.358   8.829  16.633
  426    H    VAL  54           H        VAL  54   0.744   6.034  12.790
  427    HA   VAL  54           HA       VAL  54  -1.813   5.245  11.698
  428    HB   VAL  54           HB       VAL  54   0.333   7.212  10.776
  429   HG11  VAL  54          1HG1      VAL  54  -0.819   6.395   8.771
  430   HG12  VAL  54          2HG1      VAL  54  -1.260   8.067   9.105
  431   HG13  VAL  54          3HG1      VAL  54  -2.389   6.766   9.493
  432   HG21  VAL  54          3HG2      VAL  54  -2.433   7.691  11.957
  433   HG22  VAL  54          1HG2      VAL  54  -1.303   8.942  11.429
  434   HG23  VAL  54          2HG2      VAL  54  -0.891   7.902  12.793
  435    H    ARG  55           H        ARG  55   1.616   4.731  10.950
  436    HA   ARG  55           HA       ARG  55   1.354   3.426   8.457
  437    HB2  ARG  55           2HB      ARG  55   3.457   2.932  10.615
  438    HB3  ARG  55           3HB      ARG  55   3.592   2.481   8.915
  439    HG2  ARG  55           2HG      ARG  55   3.551   4.851   8.266
  440    HG3  ARG  55           3HG      ARG  55   3.358   5.317   9.955
  441    HD2  ARG  55           2HD      ARG  55   5.636   3.906  10.208
  442    HD3  ARG  55           3HD      ARG  55   5.802   4.354   8.505
  443    HE   ARG  55           HE       ARG  55   5.306   6.714   9.433
  444   HH11  ARG  55          1HH1      ARG  55   7.287   4.276  11.010
  445   HH12  ARG  55          2HH1      ARG  55   8.248   5.450  11.857
  446   HH21  ARG  55          1HH2      ARG  55   6.427   8.218  10.696
  447   HH22  ARG  55          2HH2      ARG  55   7.757   7.685  11.685
  448    H    LYS  56           H        LYS  56   1.201   2.217  11.786
  449    HA   LYS  56           HA       LYS  56   0.934  -0.528  11.287
  450    HB2  LYS  56           2HB      LYS  56  -0.205   1.166  13.554
  451    HB3  LYS  56           3HB      LYS  56  -0.107  -0.595  13.572
  452    HG2  LYS  56           2HG      LYS  56   2.331  -0.520  13.554
  453    HG3  LYS  56           3HG      LYS  56   2.313   1.228  13.327
  454    HD2  LYS  56           2HD      LYS  56   2.830   0.784  15.647
  455    HD3  LYS  56           3HD      LYS  56   1.202   1.462  15.576
  456    HE2  LYS  56           2HE      LYS  56   0.253  -0.799  15.805
  457    HE3  LYS  56           3HE      LYS  56   1.882  -1.481  15.832
  458    HZ1  LYS  56           3HZ      LYS  56   0.934  -1.247  18.055
  459    HZ2  LYS  56           1HZ      LYS  56   0.807   0.426  17.843
  460    HZ3  LYS  56           2HZ      LYS  56   2.328  -0.311  17.870
  461    H    GLU  57           H        GLU  57  -1.400   2.095  11.050
  462    HA   GLU  57           HA       GLU  57  -3.711   0.357  10.735
  463    HB2  GLU  57           2HB      GLU  57  -3.487   3.359  10.232
  464    HB3  GLU  57           3HB      GLU  57  -4.975   2.431  10.402
  465    HG2  GLU  57           2HG      GLU  57  -2.910   2.899  12.571
  466    HG3  GLU  57           3HG      GLU  57  -4.462   3.713  12.439
  467    H    LEU  58           H        LEU  58  -1.470   2.145   8.676
  468    HA   LEU  58           HA       LEU  58  -2.699   1.660   6.166
  469    HB2  LEU  58           2HB      LEU  58   0.045   2.478   7.087
  470    HB3  LEU  58           3HB      LEU  58  -0.047   1.783   5.484
  471    HG   LEU  58           HG       LEU  58  -0.096   4.207   5.338
  472   HD11  LEU  58          1HD1      LEU  58  -1.359   2.935   3.663
  473   HD12  LEU  58          2HD1      LEU  58  -2.060   4.524   3.952
  474   HD13  LEU  58          3HD1      LEU  58  -2.827   3.089   4.640
  475   HD21  LEU  58          3HD2      LEU  58  -1.029   4.773   7.523
  476   HD22  LEU  58          1HD2      LEU  58  -2.610   4.154   7.038
  477   HD23  LEU  58          2HD2      LEU  58  -1.929   5.575   6.238
  478    H    ALA  59           H        ALA  59  -0.815  -0.352   8.299
  479    HA   ALA  59           HA       ALA  59  -0.294  -2.518   6.546
  480    HB1  ALA  59           3HB      ALA  59   0.080  -3.793   8.613
  481    HB2  ALA  59           1HB      ALA  59  -0.656  -2.495   9.560
  482    HB3  ALA  59           2HB      ALA  59   0.851  -2.210   8.691
  483    H    LYS  60           H        LYS  60  -3.073  -1.740   8.651
  484    HA   LYS  60           HA       LYS  60  -4.570  -4.122   8.104
  485    HB2  LYS  60           2HB      LYS  60  -5.396  -1.405   9.181
  486    HB3  LYS  60           3HB      LYS  60  -6.600  -2.632   8.832
  487    HG2  LYS  60           2HG      LYS  60  -6.153  -2.634  11.190
  488    HG3  LYS  60           3HG      LYS  60  -5.502  -4.133  10.517
  489    HD2  LYS  60           2HD      LYS  60  -3.248  -3.288  10.641
  490    HD3  LYS  60           3HD      LYS  60  -3.816  -1.661  11.023
  491    HE2  LYS  60           2HE      LYS  60  -4.136  -4.084  12.824
  492    HE3  LYS  60           3HE      LYS  60  -2.910  -2.831  13.002
  493    HZ1  LYS  60           3HZ      LYS  60  -4.691  -1.205  13.320
  494    HZ2  LYS  60           1HZ      LYS  60  -4.741  -2.429  14.488
  495    HZ3  LYS  60           2HZ      LYS  60  -5.847  -2.436  13.210
  496    H    GLU  61           H        GLU  61  -4.297  -0.948   6.551
  497    HA   GLU  61           HA       GLU  61  -6.382  -1.281   4.642
  498    HB2  GLU  61           2HB      GLU  61  -3.905   0.489   4.583
  499    HB3  GLU  61           3HB      GLU  61  -5.214   0.579   3.411
  500    HG2  GLU  61           2HG      GLU  61  -5.413   1.158   6.377
  501    HG3  GLU  61           3HG      GLU  61  -5.410   2.352   5.082
  502    H    ALA  62           H        ALA  62  -2.883  -1.931   4.589
  503    HA   ALA  62           HA       ALA  62  -2.507  -2.836   2.012
  504    HB1  ALA  62           3HB      ALA  62  -0.576  -4.074   2.902
  505    HB2  ALA  62           1HB      ALA  62  -1.212  -3.909   4.546
  506    HB3  ALA  62           2HB      ALA  62  -0.700  -2.481   3.646
  507    H    GLU  63           H        GLU  63  -3.479  -4.750   4.859
  508    HA   GLU  63           HA       GLU  63  -3.677  -7.290   3.650
  509    HB2  GLU  63           2HB      GLU  63  -5.150  -6.152   6.058
  510    HB3  GLU  63           3HB      GLU  63  -5.090  -7.865   5.649
  511    HG2  GLU  63           2HG      GLU  63  -2.690  -7.929   6.058
  512    HG3  GLU  63           3HG      GLU  63  -2.649  -6.182   6.307
  513    H    ARG  64           H        ARG  64  -6.186  -4.768   4.183
  514    HA   ARG  64           HA       ARG  64  -8.378  -6.454   3.437
  515    HB2  ARG  64           2HB      ARG  64  -9.796  -4.504   3.626
  516    HB3  ARG  64           3HB      ARG  64  -8.623  -4.456   4.937
  517    HG2  ARG  64           2HG      ARG  64  -7.277  -2.825   3.590
  518    HG3  ARG  64           3HG      ARG  64  -8.570  -2.808   2.394
  519    HD2  ARG  64           2HD      ARG  64  -8.908  -2.014   5.302
  520    HD3  ARG  64           3HD      ARG  64  -8.613  -0.885   3.981
  521    HE   ARG  64           HE       ARG  64 -10.947  -2.613   3.733
  522   HH11  ARG  64          1HH1      ARG  64  -9.710   0.568   4.626
  523   HH12  ARG  64          2HH1      ARG  64 -11.267   1.335   4.498
  524   HH21  ARG  64          1HH2      ARG  64 -12.966  -1.599   3.556
  525   HH22  ARG  64          2HH2      ARG  64 -13.112   0.099   3.889
  526    H    LEU  65           H        LEU  65  -6.315  -4.198   1.668
  527    HA   LEU  65           HA       LEU  65  -7.829  -4.219  -0.787
  528    HB2  LEU  65           2HB      LEU  65  -4.915  -3.494  -0.248
  529    HB3  LEU  65           3HB      LEU  65  -5.775  -3.158  -1.743
  530    HG   LEU  65           HG       LEU  65  -6.503  -1.989   0.971
  531   HD11  LEU  65          1HD1      LEU  65  -5.038  -0.660  -1.329
  532   HD12  LEU  65          2HD1      LEU  65  -4.349  -1.128   0.228
  533   HD13  LEU  65          3HD1      LEU  65  -5.578   0.129   0.156
  534   HD21  LEU  65          3HD2      LEU  65  -7.991  -0.478  -0.287
  535   HD22  LEU  65          1HD2      LEU  65  -8.463  -2.169  -0.457
  536   HD23  LEU  65          2HD2      LEU  65  -7.622  -1.352  -1.777
  537    H    ALA  66           H        ALA  66  -5.081  -6.015   0.520
  538    HA   ALA  66           HA       ALA  66  -4.280  -7.439  -1.751
  539    HB1  ALA  66           3HB      ALA  66  -2.959  -7.296   0.323
  540    HB2  ALA  66           1HB      ALA  66  -3.174  -8.969  -0.191
  541    HB3  ALA  66           2HB      ALA  66  -4.132  -8.325   1.146
  542    H    LYS  67           H        LYS  67  -6.584  -8.390   0.808
  543    HA   LYS  67           HA       LYS  67  -7.171 -10.958  -0.350
  544    HB2  LYS  67           2HB      LYS  67  -8.814 -11.197   1.442
  545    HB3  LYS  67           3HB      LYS  67  -7.309 -10.555   2.085
  546    HG2  LYS  67           2HG      LYS  67  -8.348  -8.253   2.026
  547    HG3  LYS  67           3HG      LYS  67  -9.876  -9.015   1.577
  548    HD2  LYS  67           2HD      LYS  67  -8.321  -9.479   4.158
  549    HD3  LYS  67           3HD      LYS  67  -9.812  -8.551   3.992
  550    HE2  LYS  67           2HE      LYS  67 -11.033 -10.597   3.355
  551    HE3  LYS  67           3HE      LYS  67  -9.538 -11.534   3.459
  552    HZ1  LYS  67           3HZ      LYS  67 -10.863 -10.117   5.714
  553    HZ2  LYS  67           1HZ      LYS  67  -9.414 -10.982   5.823
  554    HZ3  LYS  67           2HZ      LYS  67 -10.855 -11.787   5.459
  555    H    GLU  68           H        GLU  68  -8.460  -7.758  -0.764
  556    HA   GLU  68           HA       GLU  68 -11.069  -8.486  -1.746
  557    HB2  GLU  68           2HB      GLU  68 -10.571  -6.301  -0.631
  558    HB3  GLU  68           3HB      GLU  68  -9.550  -5.845  -1.986
  559    HG2  GLU  68           2HG      GLU  68 -11.733  -4.753  -2.125
  560    HG3  GLU  68           3HG      GLU  68 -11.505  -5.852  -3.482
  561    H    PHE  69           H        PHE  69  -8.060  -7.283  -3.226
  562    HA   PHE  69           HA       PHE  69  -9.097  -7.585  -5.942
  563    HB2  PHE  69           2HB      PHE  69  -6.385  -6.562  -4.960
  564    HB3  PHE  69           3HB      PHE  69  -6.981  -6.476  -6.614
  565    HD1  PHE  69           HD1      PHE  69  -9.542  -5.379  -6.658
  566    HD2  PHE  69           HD2      PHE  69  -6.438  -4.492  -3.858
  567    HE1  PHE  69           HE1      PHE  69 -10.575  -3.201  -6.186
  568    HE2  PHE  69           HE2      PHE  69  -7.488  -2.314  -3.387
  569    HZ   PHE  69           HZ       PHE  69  -9.556  -1.669  -4.550
  570    H    ASN  70           H        ASN  70  -7.854  -9.731  -3.826
  571    HA   ASN  70           HA       ASN  70  -6.783 -11.704  -3.845
  572    HB2  ASN  70           2HB      ASN  70  -8.608 -12.280  -5.427
  573    HB3  ASN  70           3HB      ASN  70  -7.626 -11.749  -6.789
  574   HD21  ASN  70          1HD2      ASN  70  -7.608 -13.739  -7.811
  575   HD22  ASN  70          2HD2      ASN  70  -6.806 -15.138  -7.190
  576    H    ILE  71           H        ILE  71  -4.975 -10.081  -3.600
  577    HA   ILE  71           HA       ILE  71  -2.701 -10.991  -5.209
  578    HB   ILE  71           HB       ILE  71  -1.664  -8.679  -5.074
  579   HG12  ILE  71          2HG1      ILE  71  -4.460  -7.842  -4.166
  580   HG13  ILE  71          3HG1      ILE  71  -2.962  -7.681  -3.258
  581   HG21  ILE  71          1HG2      ILE  71  -2.705  -9.452  -7.177
  582   HG22  ILE  71          2HG2      ILE  71  -2.838  -7.705  -6.983
  583   HG23  ILE  71          3HG2      ILE  71  -4.240  -8.736  -6.681
  584   HD11  ILE  71          3HD1      ILE  71  -2.169  -6.036  -4.936
  585   HD12  ILE  71          1HD1      ILE  71  -3.638  -5.539  -4.096
  586   HD13  ILE  71          2HD1      ILE  71  -3.735  -6.153  -5.745
  587    H    THR  72           H        THR  72  -0.685 -10.897  -3.994
  588    HA   THR  72           HA       THR  72  -1.025 -11.248  -1.105
  589    HB   THR  72           HB       THR  72   1.515 -11.828  -1.263
  590    HG1  THR  72           HG1      THR  72   1.937 -10.880  -3.272
  591   HG21  THR  72          3HG2      THR  72  -0.225 -13.597  -1.087
  592   HG22  THR  72          1HG2      THR  72   1.097 -14.098  -2.146
  593   HG23  THR  72          2HG2      THR  72  -0.434 -13.564  -2.840
  594    H    VAL  73           H        VAL  73   0.178 -10.025   0.467
  595    HA   VAL  73           HA       VAL  73   1.645  -7.653  -0.475
  596    HB   VAL  73           HB       VAL  73  -0.761  -7.011   0.142
  597   HG11  VAL  73          1HG1      VAL  73  -1.105  -8.459   2.076
  598   HG12  VAL  73          2HG1      VAL  73  -1.359  -6.770   2.517
  599   HG13  VAL  73          3HG1      VAL  73   0.135  -7.590   2.984
  600   HG21  VAL  73          3HG2      VAL  73  -0.098  -4.941   1.306
  601   HG22  VAL  73          1HG2      VAL  73   1.034  -5.347   0.015
  602   HG23  VAL  73          2HG2      VAL  73   1.472  -5.650   1.699
  603    H    THR  74           H        THR  74   3.175  -6.894   0.946
  604    HA   THR  74           HA       THR  74   3.588  -8.129   3.568
  605    HB   THR  74           HB       THR  74   5.131  -9.381   2.158
  606    HG1  THR  74           HG1      THR  74   6.756  -7.388   3.359
  607   HG21  THR  74          3HG2      THR  74   6.868  -8.333   0.776
  608   HG22  THR  74          1HG2      THR  74   6.234  -6.732   1.168
  609   HG23  THR  74          2HG2      THR  74   5.262  -7.857   0.219
  610    H    TYR  75           H        TYR  75   4.473  -6.659   5.042
  611    HA   TYR  75           HA       TYR  75   5.172  -3.953   4.150
  612    HB2  TYR  75           2HB      TYR  75   3.632  -2.962   5.914
  613    HB3  TYR  75           3HB      TYR  75   2.801  -3.683   4.543
  614    HD1  TYR  75           HD1      TYR  75   3.645  -4.191   8.154
  615    HD2  TYR  75           HD2      TYR  75   1.273  -5.545   4.858
  616    HE1  TYR  75           HE1      TYR  75   2.316  -5.583   9.677
  617    HE2  TYR  75           HE2      TYR  75  -0.056  -6.937   6.391
  618    HH   TYR  75           HH       TYR  75   0.213  -8.008   8.616
  619    H    THR  76           H        THR  76   6.529  -2.848   5.578
  620    HA   THR  76           HA       THR  76   7.523  -4.357   7.931
  621    HB   THR  76           HB       THR  76   9.284  -2.732   6.030
  622    HG1  THR  76           HG1      THR  76   8.601  -5.495   6.082
  623   HG21  THR  76          3HG2      THR  76  10.224  -2.982   8.309
  624   HG22  THR  76          1HG2      THR  76  11.139  -3.948   7.149
  625   HG23  THR  76          2HG2      THR  76   9.981  -4.729   8.229
  626    H    ILE  77           H        ILE  77   7.401  -3.262   9.745
  627    HA   ILE  77           HA       ILE  77   7.715  -0.349   9.897
  628    HB   ILE  77           HB       ILE  77   5.775  -0.298  11.630
  629   HG12  ILE  77          2HG1      ILE  77   5.031  -2.879  10.176
  630   HG13  ILE  77          3HG1      ILE  77   5.412  -2.718  11.887
  631   HG21  ILE  77          1HG2      ILE  77   4.068   0.170   9.940
  632   HG22  ILE  77          2HG2      ILE  77   5.042  -0.642   8.712
  633   HG23  ILE  77          3HG2      ILE  77   5.633   0.840   9.469
  634   HD11  ILE  77          3HD1      ILE  77   3.034  -2.979  11.540
  635   HD12  ILE  77          1HD1      ILE  77   2.995  -1.564  10.487
  636   HD13  ILE  77          2HD1      ILE  77   3.376  -1.382  12.203
  637    H    ARG  78           H        ARG  78   8.207   0.393  12.025
  638    HA   ARG  78           HA       ARG  78   9.424  -1.603  13.853
  639    HB2  ARG  78           2HB      ARG  78  10.692   1.062  13.070
  640    HB3  ARG  78           3HB      ARG  78  11.399  -0.186  14.075
  641    HG2  ARG  78           2HG      ARG  78  12.521  -0.871  12.233
  642    HG3  ARG  78           3HG      ARG  78  10.991  -1.505  11.635
  643    HD2  ARG  78           2HD      ARG  78  12.039   1.294  11.092
  644    HD3  ARG  78           3HD      ARG  78  12.201  -0.068   9.988
  645    HE   ARG  78           HE       ARG  78   9.828  -0.071   9.682
  646   HH11  ARG  78          1HH1      ARG  78  11.030   2.801  11.331
  647   HH12  ARG  78          2HH1      ARG  78   9.631   3.749  10.943
  648   HH21  ARG  78          1HH2      ARG  78   7.981   1.179   9.226
  649   HH22  ARG  78          2HH2      ARG  78   7.911   2.827   9.753
  650    H    GLY  79           H        GLY  79  10.376   0.877  15.465
  651    HA2  GLY  79           2HA      GLY  79   9.047   2.980  16.000
  652    HA3  GLY  79           3HA      GLY  79   7.753   1.876  16.442
  653    H    SER  80           H        SER  80   8.241   0.282  18.120
  654    HA   SER  80           HA       SER  80   9.494   1.346  20.439
  655    HB2  SER  80           2HB      SER  80   8.639  -1.511  19.793
  656    HB3  SER  80           3HB      SER  80   9.039  -0.910  21.403
  657    HG   SER  80           HG       SER  80   7.120   0.559  20.040
  658    H    LEU  81           H        LEU  81  10.526  -0.813  17.874
  659    HA   LEU  81           HA       LEU  81  13.028  -1.673  18.878
  660    HB2  LEU  81           2HB      LEU  81  12.203  -1.186  15.986
  661    HB3  LEU  81           3HB      LEU  81  13.570  -2.160  16.510
  662    HG   LEU  81           HG       LEU  81  10.631  -2.802  16.984
  663   HD11  LEU  81          1HD1      LEU  81  11.288  -3.118  14.649
  664   HD12  LEU  81          2HD1      LEU  81  11.012  -4.676  15.425
  665   HD13  LEU  81          3HD1      LEU  81  12.662  -4.115  15.141
  666   HD21  LEU  81          3HD2      LEU  81  11.954  -3.606  18.870
  667   HD22  LEU  81          1HD2      LEU  81  13.099  -4.391  17.778
  668   HD23  LEU  81          2HD2      LEU  81  11.435  -4.969  17.883
  669    H    GLU  82           H        GLU  82  11.986   1.306  17.357
  670    HA   GLU  82           HA       GLU  82  14.710   2.290  16.912
  671    HB2  GLU  82           2HB      GLU  82  12.079   3.690  16.308
  672    HB3  GLU  82           3HB      GLU  82  13.681   4.126  15.714
  673    HG2  GLU  82           2HG      GLU  82  13.776   1.998  14.456
  674    HG3  GLU  82           3HG      GLU  82  12.158   1.602  15.037
  675    H    HIS  83           H        HIS  83  15.217   2.345  19.153
  676    HA   HIS  83           HA       HIS  83  14.639   4.946  20.379
  677    HB2  HIS  83           2HB      HIS  83  14.032   2.271  21.700
  678    HB3  HIS  83           3HB      HIS  83  14.571   3.609  22.703
  679    HD1  HIS  83           HD1      HIS  83  12.937   5.580  23.045
  680    HD2  HIS  83           HD2      HIS  83  11.382   2.514  20.712
  681    HE1  HIS  83           HE1      HIS  83  10.468   6.010  22.921
  682    HE2  HIS  83           HE2      HIS  83   9.549   4.158  21.487
  683    H    HIS  84           H        HIS  84  16.671   2.144  19.910
  684    HA   HIS  84           HA       HIS  84  18.645   1.383  20.723
  685    HB2  HIS  84           2HB      HIS  84  19.424   3.273  19.237
  686    HB3  HIS  84           3HB      HIS  84  19.439   4.345  20.628
  687    HD1  HIS  84           HD1      HIS  84  21.310   1.426  19.134
  688    HD2  HIS  84           HD2      HIS  84  21.731   4.139  22.251
  689    HE1  HIS  84           HE1      HIS  84  23.647   1.124  19.988
  690    HE2  HIS  84           HE2      HIS  84  23.848   2.705  21.920
  691    H    HIS  85           H        HIS  85  17.048   1.155  22.656
  692    HA   HIS  85           HA       HIS  85  17.353   2.959  24.837
  693    HB2  HIS  85           2HB      HIS  85  15.873   1.449  26.106
  694    HB3  HIS  85           3HB      HIS  85  15.213   1.884  24.540
  695    HD1  HIS  85           HD1      HIS  85  14.675  -0.029  22.941
  696    HD2  HIS  85           HD2      HIS  85  16.533  -1.327  26.417
  697    HE1  HIS  85           HE1      HIS  85  14.425  -2.521  22.948
  698    HE2  HIS  85           HE2      HIS  85  15.351  -3.235  25.166
  699    H    HIS  86           H        HIS  86  19.464   3.062  25.390
  700    HA   HIS  86           HA       HIS  86  20.998   0.919  26.452
  701    HB2  HIS  86           2HB      HIS  86  22.224   2.800  27.700
  702    HB3  HIS  86           3HB      HIS  86  22.189   2.936  25.946
  703    HD1  HIS  86           HD1      HIS  86  21.345   5.102  25.010
  704    HD2  HIS  86           HD2      HIS  86  20.315   4.643  29.011
  705    HE1  HIS  86           HE1      HIS  86  20.346   7.296  25.711
  706    HE2  HIS  86           HE2      HIS  86  19.739   6.993  28.126
  707    H    HIS  87           H        HIS  87  21.026   0.029  28.489
  708    HA   HIS  87           HA       HIS  87  18.577   0.097  29.960
  709    HB2  HIS  87           2HB      HIS  87  21.204  -1.369  30.394
  710    HB3  HIS  87           3HB      HIS  87  19.851  -1.520  31.513
  711    HD1  HIS  87           HD1      HIS  87  21.169  -2.937  28.422
  712    HD2  HIS  87           HD2      HIS  87  17.430  -2.624  30.211
  713    HE1  HIS  87           HE1      HIS  87  19.726  -4.631  27.267
  714    HE2  HIS  87           HE2      HIS  87  17.450  -4.347  28.286
  715    H    HIS  88           H        HIS  88  18.381   2.221  30.629
  716    HA   HIS  88           HA       HIS  88  19.587   2.881  33.197
  717    HB2  HIS  88           2HB      HIS  88  21.124   4.057  31.675
  718    HB3  HIS  88           3HB      HIS  88  19.782   4.754  30.776
  719    HD1  HIS  88           HD1      HIS  88  21.745   5.169  33.942
  720    HD2  HIS  88           HD2      HIS  88  18.558   7.007  32.006
  721    HE1  HIS  88           HE1      HIS  88  21.389   7.349  35.133
  722    HE2  HIS  88           HE2      HIS  88  19.316   8.315  34.100
  Start of MODEL    4
    1    H1   MET   1           1H       MET   1  11.499   1.958  11.821
    2    H2   MET   1           2H       MET   1  10.112   1.957  10.857
    3    H3   MET   1           3H       MET   1   9.992   1.629  12.506
    4    HA   MET   1           HA       MET   1   9.235   3.858  12.006
    5    HB2  MET   1           2HB      MET   1  10.382   3.250  14.199
    6    HB3  MET   1           3HB      MET   1  11.872   3.905  13.545
    7    HG2  MET   1           2HG      MET   1  10.815   6.129  13.392
    8    HG3  MET   1           3HG      MET   1   9.321   5.453  14.043
    9    HE1  MET   1           3HE      MET   1  10.847   7.719  16.951
   10    HE2  MET   1           1HE      MET   1   9.403   7.442  15.977
   11    HE3  MET   1           2HE      MET   1  10.889   8.004  15.212
   12    H    GLY   2           H        GLY   2  10.016   6.137  11.503
   13    HA2  GLY   2           2HA      GLY   2  11.314   7.628  10.218
   14    HA3  GLY   2           3HA      GLY   2  12.153   6.274   9.469
   15    H    GLU   3           H        GLU   3  10.232   4.686   8.561
   16    HA   GLU   3           HA       GLU   3   7.916   5.969   7.482
   17    HB2  GLU   3           2HB      GLU   3   8.400   5.557   5.086
   18    HB3  GLU   3           3HB      GLU   3   9.478   6.759   5.784
   19    HG2  GLU   3           2HG      GLU   3  11.271   5.071   5.928
   20    HG3  GLU   3           3HG      GLU   3  10.188   3.866   5.237
   21    H    MET   4           H        MET   4   6.751   4.371   5.978
   22    HA   MET   4           HA       MET   4   7.121   1.580   6.896
   23    HB2  MET   4           2HB      MET   4   4.946   2.590   7.596
   24    HB3  MET   4           3HB      MET   4   4.577   2.977   5.922
   25    HG2  MET   4           2HG      MET   4   4.426   0.634   5.361
   26    HG3  MET   4           3HG      MET   4   4.970   0.170   6.977
   27    HE1  MET   4           3HE      MET   4   1.310  -0.948   7.335
   28    HE2  MET   4           1HE      MET   4   3.003  -1.347   7.614
   29    HE3  MET   4           2HE      MET   4   2.390  -1.195   5.965
   30    H    ASP   5           H        ASP   5   7.167  -0.042   5.283
   31    HA   ASP   5           HA       ASP   5   7.111   0.820   2.469
   32    HB2  ASP   5           2HB      ASP   5   9.366   0.104   3.182
   33    HB3  ASP   5           3HB      ASP   5   8.720  -1.367   3.893
   34    H    ILE   6           H        ILE   6   5.414  -0.090   1.420
   35    HA   ILE   6           HA       ILE   6   4.212  -2.622   2.377
   36    HB   ILE   6           HB       ILE   6   2.695  -0.330   1.008
   37   HG12  ILE   6          2HG1      ILE   6   2.599  -1.113   3.963
   38   HG13  ILE   6          3HG1      ILE   6   3.400   0.320   3.327
   39   HG21  ILE   6          1HG2      ILE   6   0.672  -1.621   1.594
   40   HG22  ILE   6          2HG2      ILE   6   1.673  -2.888   2.303
   41   HG23  ILE   6          3HG2      ILE   6   1.756  -2.565   0.569
   42   HD11  ILE   6          3HD1      ILE   6   0.442  -0.252   3.228
   43   HD12  ILE   6          1HD1      ILE   6   1.238   1.172   2.548
   44   HD13  ILE   6          2HD1      ILE   6   1.269   0.888   4.288
   45    H    ARG   7           H        ARG   7   4.246  -4.170   0.819
   46    HA   ARG   7           HA       ARG   7   4.571  -3.374  -2.012
   47    HB2  ARG   7           2HB      ARG   7   6.763  -4.152  -0.901
   48    HB3  ARG   7           3HB      ARG   7   6.047  -5.756  -0.793
   49    HG2  ARG   7           2HG      ARG   7   5.917  -5.941  -3.200
   50    HG3  ARG   7           3HG      ARG   7   6.354  -4.247  -3.410
   51    HD2  ARG   7           2HD      ARG   7   8.585  -5.022  -2.149
   52    HD3  ARG   7           3HD      ARG   7   8.100  -6.604  -2.760
   53    HE   ARG   7           HE       ARG   7   8.040  -5.518  -5.029
   54   HH11  ARG   7          1HH1      ARG   7  10.197  -4.254  -2.532
   55   HH12  ARG   7          2HH1      ARG   7  11.310  -3.568  -3.673
   56   HH21  ARG   7          1HH2      ARG   7   9.474  -4.544  -6.500
   57   HH22  ARG   7          2HH2      ARG   7  10.902  -3.736  -5.920
   58    H    PHE   8           H        PHE   8   3.306  -4.385  -3.380
   59    HA   PHE   8           HA       PHE   8   1.627  -6.676  -2.526
   60    HB2  PHE   8           2HB      PHE   8   0.921  -4.356  -4.388
   61    HB3  PHE   8           3HB      PHE   8  -0.075  -5.790  -4.172
   62    HD1  PHE   8           HD2      PHE   8  -1.043  -6.269  -1.863
   63    HD2  PHE   8           HD1      PHE   8   0.697  -2.501  -2.888
   64    HE1  PHE   8           HE2      PHE   8  -2.250  -5.202  -0.010
   65    HE2  PHE   8           HE1      PHE   8  -0.511  -1.444  -1.023
   66    HZ   PHE   8           HZ       PHE   8  -1.989  -2.797   0.414
   67    H    ARG   9           H        ARG   9   1.756  -8.450  -3.889
   68    HA   ARG   9           HA       ARG   9   2.960  -8.047  -6.577
   69    HB2  ARG   9           2HB      ARG   9   4.453  -9.344  -5.001
   70    HB3  ARG   9           3HB      ARG   9   3.191 -10.552  -4.846
   71    HG2  ARG   9           2HG      ARG   9   3.427 -11.305  -7.067
   72    HG3  ARG   9           3HG      ARG   9   4.273  -9.844  -7.579
   73    HD2  ARG   9           2HD      ARG   9   5.399 -11.966  -5.719
   74    HD3  ARG   9           3HD      ARG   9   5.789 -11.778  -7.434
   75    HE   ARG   9           HE       ARG   9   6.238  -9.345  -6.051
   76   HH11  ARG   9          1HH1      ARG   9   7.757 -12.511  -6.466
   77   HH12  ARG   9          2HH1      ARG   9   9.338 -11.894  -6.114
   78   HH21  ARG   9          1HH2      ARG   9   8.272  -8.599  -5.586
   79   HH22  ARG   9          2HH2      ARG   9   9.635  -9.679  -5.619
   80    H    GLY  10           H        GLY  10   1.806  -8.869  -8.287
   81    HA2  GLY  10           2HA      GLY  10  -0.446 -10.653  -7.883
   82    HA3  GLY  10           3HA      GLY  10  -0.896  -8.988  -8.229
   83    H    ASP  11           H        ASP  11  -0.863 -11.757  -9.630
   84    HA   ASP  11           HA       ASP  11   0.519 -11.518 -12.080
   85    HB2  ASP  11           2HB      ASP  11  -0.405 -13.639 -11.123
   86    HB3  ASP  11           3HB      ASP  11  -2.034 -13.059 -11.440
   87    H    ASP  12           H        ASP  12  -2.424 -10.113 -10.897
   88    HA   ASP  12           HA       ASP  12  -3.140  -8.969 -13.524
   89    HB2  ASP  12           2HB      ASP  12  -5.021  -9.979 -12.316
   90    HB3  ASP  12           3HB      ASP  12  -4.667  -9.017 -10.888
   91    H    LEU  13           H        LEU  13  -1.937  -7.228 -13.903
   92    HA   LEU  13           HA       LEU  13  -0.754  -5.450 -12.124
   93    HB2  LEU  13           2HB      LEU  13  -0.094  -5.611 -14.472
   94    HB3  LEU  13           3HB      LEU  13  -1.659  -5.009 -14.989
   95    HG   LEU  13           HG       LEU  13  -1.127  -2.790 -13.964
   96   HD11  LEU  13          1HD1      LEU  13   0.436  -3.474 -12.209
   97   HD12  LEU  13          2HD1      LEU  13   1.157  -2.252 -13.253
   98   HD13  LEU  13          3HD1      LEU  13   1.628  -3.943 -13.427
   99   HD21  LEU  13          3HD2      LEU  13  -0.713  -3.165 -16.344
  100   HD22  LEU  13          1HD2      LEU  13   0.911  -3.765 -15.990
  101   HD23  LEU  13          2HD2      LEU  13   0.498  -2.081 -15.668
  102    H    GLU  14           H        GLU  14  -4.076  -5.487 -13.328
  103    HA   GLU  14           HA       GLU  14  -4.769  -2.780 -12.718
  104    HB2  GLU  14           2HB      GLU  14  -6.426  -5.292 -13.107
  105    HB3  GLU  14           3HB      GLU  14  -7.190  -3.805 -12.541
  106    HG2  GLU  14           2HG      GLU  14  -6.441  -2.627 -14.533
  107    HG3  GLU  14           3HG      GLU  14  -5.626  -4.081 -15.117
  108    H    ALA  15           H        ALA  15  -4.743  -5.761 -10.860
  109    HA   ALA  15           HA       ALA  15  -6.142  -4.935  -8.559
  110    HB1  ALA  15           3HB      ALA  15  -5.022  -6.897  -7.532
  111    HB2  ALA  15           1HB      ALA  15  -3.943  -7.006  -8.928
  112    HB3  ALA  15           2HB      ALA  15  -5.674  -7.282  -9.124
  113    H    LEU  16           H        LEU  16  -2.767  -4.758  -9.533
  114    HA   LEU  16           HA       LEU  16  -1.673  -3.722  -7.119
  115    HB2  LEU  16           2HB      LEU  16  -0.634  -3.466  -9.971
  116    HB3  LEU  16           3HB      LEU  16   0.304  -3.187  -8.513
  117    HG   LEU  16           HG       LEU  16  -0.824  -5.866  -9.417
  118   HD11  LEU  16          1HD1      LEU  16   1.057  -5.097 -10.790
  119   HD12  LEU  16          2HD1      LEU  16   1.506  -6.496  -9.818
  120   HD13  LEU  16          3HD1      LEU  16   2.045  -4.883  -9.341
  121   HD21  LEU  16          3HD2      LEU  16   0.896  -5.246  -6.991
  122   HD22  LEU  16          1HD2      LEU  16   0.448  -6.858  -7.557
  123   HD23  LEU  16          2HD2      LEU  16  -0.794  -5.757  -6.969
  124    H    GLU  17           H        GLU  17  -2.625  -2.174 -10.206
  125    HA   GLU  17           HA       GLU  17  -2.054   0.493  -9.584
  126    HB2  GLU  17           2HB      GLU  17  -4.152  -0.637 -11.485
  127    HB3  GLU  17           3HB      GLU  17  -3.614   1.040 -11.478
  128    HG2  GLU  17           2HG      GLU  17  -1.761  -1.298 -11.963
  129    HG3  GLU  17           3HG      GLU  17  -2.597  -0.463 -13.255
  130    H    LYS  18           H        LYS  18  -4.924  -1.409  -8.898
  131    HA   LYS  18           HA       LYS  18  -6.605   0.788  -8.068
  132    HB2  LYS  18           2HB      LYS  18  -6.863  -2.243  -7.921
  133    HB3  LYS  18           3HB      LYS  18  -8.092  -1.170  -7.261
  134    HG2  LYS  18           2HG      LYS  18  -8.683  -0.334  -9.411
  135    HG3  LYS  18           3HG      LYS  18  -7.232  -0.997 -10.164
  136    HD2  LYS  18           2HD      LYS  18  -8.066  -3.256  -9.957
  137    HD3  LYS  18           3HD      LYS  18  -9.406  -2.735  -8.950
  138    HE2  LYS  18           2HE      LYS  18 -10.143  -3.256 -11.229
  139    HE3  LYS  18           3HE      LYS  18 -10.420  -1.561 -10.842
  140    HZ1  LYS  18           3HZ      LYS  18  -9.524  -1.957 -13.087
  141    HZ2  LYS  18           1HZ      LYS  18  -8.102  -2.553 -12.403
  142    HZ3  LYS  18           2HZ      LYS  18  -8.545  -0.942 -12.157
  143    H    ALA  19           H        ALA  19  -4.725  -1.777  -6.387
  144    HA   ALA  19           HA       ALA  19  -5.364  -1.009  -3.723
  145    HB1  ALA  19           3HB      ALA  19  -4.413  -3.212  -4.285
  146    HB2  ALA  19           1HB      ALA  19  -3.432  -2.395  -3.069
  147    HB3  ALA  19           2HB      ALA  19  -2.891  -2.450  -4.750
  148    H    LEU  20           H        LEU  20  -2.615  -0.225  -5.820
  149    HA   LEU  20           HA       LEU  20  -1.091   1.466  -4.235
  150    HB2  LEU  20           2HB      LEU  20  -0.361   0.628  -6.409
  151    HB3  LEU  20           3HB      LEU  20  -1.609   1.518  -7.239
  152    HG   LEU  20           HG       LEU  20   0.859   2.358  -7.346
  153   HD11  LEU  20          1HD1      LEU  20  -1.308   4.370  -6.758
  154   HD12  LEU  20          2HD1      LEU  20  -0.975   3.614  -8.315
  155   HD13  LEU  20          3HD1      LEU  20   0.219   4.687  -7.592
  156   HD21  LEU  20          3HD2      LEU  20   0.128   3.527  -4.647
  157   HD22  LEU  20          1HD2      LEU  20   1.557   3.935  -5.599
  158   HD23  LEU  20          2HD2      LEU  20   1.367   2.308  -4.954
  159    H    LYS  21           H        LYS  21  -3.779   2.294  -6.414
  160    HA   LYS  21           HA       LYS  21  -3.777   5.058  -6.092
  161    HB2  LYS  21           2HB      LYS  21  -4.995   3.895  -7.863
  162    HB3  LYS  21           3HB      LYS  21  -6.067   3.137  -6.707
  163    HG2  LYS  21           2HG      LYS  21  -6.042   6.138  -6.863
  164    HG3  LYS  21           3HG      LYS  21  -6.809   5.247  -8.171
  165    HD2  LYS  21           2HD      LYS  21  -7.554   5.052  -5.228
  166    HD3  LYS  21           3HD      LYS  21  -8.436   5.963  -6.452
  167    HE2  LYS  21           2HE      LYS  21  -8.071   2.952  -6.377
  168    HE3  LYS  21           3HE      LYS  21  -9.551   3.837  -6.027
  169    HZ1  LYS  21           3HZ      LYS  21  -9.627   2.949  -8.228
  170    HZ2  LYS  21           1HZ      LYS  21  -8.175   3.697  -8.647
  171    HZ3  LYS  21           2HZ      LYS  21  -9.544   4.629  -8.325
  172    H    GLU  22           H        GLU  22  -5.314   2.539  -4.141
  173    HA   GLU  22           HA       GLU  22  -6.701   4.320  -2.366
  174    HB2  GLU  22           2HB      GLU  22  -6.028   1.362  -2.133
  175    HB3  GLU  22           3HB      GLU  22  -7.020   2.230  -0.969
  176    HG2  GLU  22           2HG      GLU  22  -7.669   1.813  -3.896
  177    HG3  GLU  22           3HG      GLU  22  -8.375   0.937  -2.542
  178    H    MET  23           H        MET  23  -3.546   2.569  -2.181
  179    HA   MET  23           HA       MET  23  -2.918   3.285   0.478
  180    HB2  MET  23           2HB      MET  23  -1.085   2.603  -1.853
  181    HB3  MET  23           3HB      MET  23  -0.540   2.751  -0.189
  182    HG2  MET  23           2HG      MET  23  -2.742   0.809  -0.767
  183    HG3  MET  23           3HG      MET  23  -1.115   0.398  -1.281
  184    HE1  MET  23           3HE      MET  23  -2.487   0.773   3.119
  185    HE2  MET  23           1HE      MET  23  -3.580   0.693   1.737
  186    HE3  MET  23           2HE      MET  23  -2.615   2.144   2.018
  187    H    ILE  24           H        ILE  24  -2.348   4.963  -2.597
  188    HA   ILE  24           HA       ILE  24  -0.877   7.186  -1.648
  189    HB   ILE  24           HB       ILE  24  -2.774   6.913  -4.034
  190   HG12  ILE  24          2HG1      ILE  24   0.272   6.904  -3.806
  191   HG13  ILE  24          3HG1      ILE  24  -0.759   5.577  -4.324
  192   HG21  ILE  24          1HG2      ILE  24  -1.908   9.060  -4.905
  193   HG22  ILE  24          2HG2      ILE  24  -0.996   9.298  -3.414
  194   HG23  ILE  24          3HG2      ILE  24  -2.758   9.280  -3.374
  195   HD11  ILE  24          3HD1      ILE  24  -1.358   6.881  -6.334
  196   HD12  ILE  24          1HD1      ILE  24   0.364   6.523  -6.213
  197   HD13  ILE  24          2HD1      ILE  24  -0.228   8.135  -5.819
  198    H    ARG  25           H        ARG  25  -4.334   6.645  -2.107
  199    HA   ARG  25           HA       ARG  25  -5.428   9.078  -1.328
  200    HB2  ARG  25           2HB      ARG  25  -6.578   7.191  -2.475
  201    HB3  ARG  25           3HB      ARG  25  -6.542   6.269  -0.980
  202    HG2  ARG  25           2HG      ARG  25  -8.069   7.941   0.058
  203    HG3  ARG  25           3HG      ARG  25  -8.119   8.816  -1.479
  204    HD2  ARG  25           2HD      ARG  25  -8.994   6.761  -2.588
  205    HD3  ARG  25           3HD      ARG  25  -9.013   5.951  -1.020
  206    HE   ARG  25           HE       ARG  25 -10.548   8.311  -0.861
  207   HH11  ARG  25          1HH1      ARG  25 -10.667   5.092  -2.326
  208   HH12  ARG  25          2HH1      ARG  25 -12.404   5.050  -2.359
  209   HH21  ARG  25          1HH2      ARG  25 -12.827   8.241  -0.948
  210   HH22  ARG  25          2HH2      ARG  25 -13.630   6.835  -1.577
  211    H    GLN  26           H        GLN  26  -4.545   6.268   0.662
  212    HA   GLN  26           HA       GLN  26  -5.542   7.267   3.146
  213    HB2  GLN  26           2HB      GLN  26  -3.375   5.166   2.710
  214    HB3  GLN  26           3HB      GLN  26  -4.269   5.438   4.201
  215    HG2  GLN  26           2HG      GLN  26  -5.331   4.332   1.596
  216    HG3  GLN  26           3HG      GLN  26  -5.144   3.476   3.118
  217   HE21  GLN  26          1HE2      GLN  26  -7.507   3.964   1.360
  218   HE22  GLN  26          2HE2      GLN  26  -8.707   4.633   2.406
  219    H    ALA  27           H        ALA  27  -2.275   7.127   1.704
  220    HA   ALA  27           HA       ALA  27  -0.814   8.323   3.759
  221    HB1  ALA  27           3HB      ALA  27   0.893   8.779   2.054
  222    HB2  ALA  27           1HB      ALA  27  -0.291   8.484   0.777
  223    HB3  ALA  27           2HB      ALA  27   0.200   7.170   1.847
  224    H    ARG  28           H        ARG  28  -2.647   9.835   1.139
  225    HA   ARG  28           HA       ARG  28  -1.719  12.510   1.597
  226    HB2  ARG  28           2HB      ARG  28  -4.173  11.557   0.065
  227    HB3  ARG  28           3HB      ARG  28  -3.515  13.189   0.025
  228    HG2  ARG  28           2HG      ARG  28  -1.407  12.261  -0.976
  229    HG3  ARG  28           3HG      ARG  28  -2.180  10.678  -1.017
  230    HD2  ARG  28           2HD      ARG  28  -2.344  11.773  -3.202
  231    HD3  ARG  28           3HD      ARG  28  -3.946  11.554  -2.495
  232    HE   ARG  28           HE       ARG  28  -2.514  14.141  -2.330
  233   HH11  ARG  28          1HH1      ARG  28  -5.404  12.339  -3.279
  234   HH12  ARG  28          2HH1      ARG  28  -6.297  13.769  -3.682
  235   HH21  ARG  28          1HH2      ARG  28  -3.703  15.995  -2.905
  236   HH22  ARG  28          2HH2      ARG  28  -5.335  15.835  -3.470
  237    H    LYS  29           H        LYS  29  -4.715  10.736   2.489
  238    HA   LYS  29           HA       LYS  29  -6.017  12.975   3.691
  239    HB2  LYS  29           2HB      LYS  29  -7.657  11.439   4.567
  240    HB3  LYS  29           3HB      LYS  29  -7.221  10.883   2.957
  241    HG2  LYS  29           2HG      LYS  29  -5.938   9.062   3.819
  242    HG3  LYS  29           3HG      LYS  29  -5.963   9.726   5.449
  243    HD2  LYS  29           2HD      LYS  29  -7.460   7.815   5.306
  244    HD3  LYS  29           3HD      LYS  29  -8.386   9.285   5.604
  245    HE2  LYS  29           2HE      LYS  29  -8.991   9.356   3.197
  246    HE3  LYS  29           3HE      LYS  29  -8.096   7.851   2.944
  247    HZ1  LYS  29           3HZ      LYS  29 -10.470   7.451   3.244
  248    HZ2  LYS  29           1HZ      LYS  29 -10.425   8.181   4.768
  249    HZ3  LYS  29           2HZ      LYS  29  -9.580   6.743   4.493
  250    H    PHE  30           H        PHE  30  -3.729  10.603   4.900
  251    HA   PHE  30           HA       PHE  30  -3.959  11.433   7.686
  252    HB2  PHE  30           2HB      PHE  30  -2.079   9.476   6.297
  253    HB3  PHE  30           3HB      PHE  30  -2.066   9.787   8.028
  254    HD1  PHE  30           HD1      PHE  30  -4.928   9.809   8.736
  255    HD2  PHE  30           HD2      PHE  30  -2.809   7.267   6.039
  256    HE1  PHE  30           HE1      PHE  30  -6.576   8.018   9.122
  257    HE2  PHE  30           HE2      PHE  30  -4.467   5.479   6.421
  258    HZ   PHE  30           HZ       PHE  30  -6.352   5.855   7.965
  259    H    ALA  31           H        ALA  31  -2.467  12.690   4.994
  260    HA   ALA  31           HA       ALA  31  -1.125  14.446   4.616
  261    HB1  ALA  31           3HB      ALA  31  -1.014  14.827   7.627
  262    HB2  ALA  31           1HB      ALA  31  -2.219  15.525   6.542
  263    HB3  ALA  31           2HB      ALA  31  -0.529  16.007   6.406
  264    H    GLY  32           H        GLY  32   0.195  12.565   3.908
  265    HA2  GLY  32           2HA      GLY  32   2.946  12.936   4.869
  266    HA3  GLY  32           3HA      GLY  32   2.301  11.295   4.871
  267    H    THR  33           H        THR  33   4.331  11.232   3.378
  268    HA   THR  33           HA       THR  33   3.751  12.014   0.588
  269    HB   THR  33           HB       THR  33   6.376  11.083   1.874
  270    HG1  THR  33           HG1      THR  33   5.306  13.669   1.391
  271   HG21  THR  33          3HG2      THR  33   7.466  11.945  -0.154
  272   HG22  THR  33          1HG2      THR  33   5.894  12.367  -0.840
  273   HG23  THR  33          2HG2      THR  33   6.314  10.674  -0.567
  274    H    VAL  34           H        VAL  34   3.924  10.333  -1.071
  275    HA   VAL  34           HA       VAL  34   4.191   7.547  -0.198
  276    HB   VAL  34           HB       VAL  34   1.818   7.865   0.002
  277   HG11  VAL  34          1HG1      VAL  34   0.346   8.681  -1.788
  278   HG12  VAL  34          2HG1      VAL  34   1.753   9.007  -2.801
  279   HG13  VAL  34          3HG1      VAL  34   1.520   9.906  -1.301
  280   HG21  VAL  34          3HG2      VAL  34   2.484   5.723  -0.986
  281   HG22  VAL  34          1HG2      VAL  34   2.354   6.412  -2.609
  282   HG23  VAL  34          2HG2      VAL  34   0.913   6.236  -1.605
  283    H    THR  35           H        THR  35   5.909   7.034  -1.377
  284    HA   THR  35           HA       THR  35   6.104   7.651  -4.247
  285    HB   THR  35           HB       THR  35   8.100   6.146  -2.472
  286    HG1  THR  35           HG1      THR  35   7.647   8.907  -2.852
  287   HG21  THR  35          3HG2      THR  35   8.475   5.873  -4.910
  288   HG22  THR  35          1HG2      THR  35   9.755   6.832  -4.164
  289   HG23  THR  35          2HG2      THR  35   8.493   7.629  -5.103
  290    H    TYR  36           H        TYR  36   6.398   5.890  -5.781
  291    HA   TYR  36           HA       TYR  36   5.954   3.155  -4.930
  292    HB2  TYR  36           2HB      TYR  36   4.051   2.771  -6.492
  293    HB3  TYR  36           3HB      TYR  36   3.646   3.859  -5.173
  294    HD1  TYR  36           HD2      TYR  36   3.471   6.350  -5.636
  295    HD2  TYR  36           HD1      TYR  36   3.799   3.489  -8.793
  296    HE1  TYR  36           HE2      TYR  36   2.612   8.004  -7.228
  297    HE2  TYR  36           HE1      TYR  36   2.929   5.151 -10.380
  298    HH   TYR  36           HH       TYR  36   1.563   7.218 -10.335
  299    H    THR  37           H        THR  37   6.693   1.670  -6.314
  300    HA   THR  37           HA       THR  37   7.934   2.522  -8.873
  301    HB   THR  37           HB       THR  37   8.914   0.305  -6.996
  302    HG1  THR  37           HG1      THR  37   9.887   1.858  -5.970
  303   HG21  THR  37          3HG2      THR  37  10.234   1.550  -9.444
  304   HG22  THR  37          1HG2      THR  37   9.526  -0.065  -9.375
  305   HG23  THR  37          2HG2      THR  37  10.944   0.318  -8.397
  306    H    LEU  38           H        LEU  38   6.581   1.767 -10.441
  307    HA   LEU  38           HA       LEU  38   5.167  -0.750 -10.218
  308    HB2  LEU  38           2HB      LEU  38   5.443   1.213 -12.529
  309    HB3  LEU  38           3HB      LEU  38   4.468  -0.246 -12.603
  310    HG   LEU  38           HG       LEU  38   3.989   2.155 -10.794
  311   HD11  LEU  38          1HD1      LEU  38   1.913   2.443 -12.086
  312   HD12  LEU  38          2HD1      LEU  38   2.349   1.081 -13.118
  313   HD13  LEU  38          3HD1      LEU  38   3.333   2.549 -13.129
  314   HD21  LEU  38          3HD2      LEU  38   1.949   0.992 -10.047
  315   HD22  LEU  38          1HD2      LEU  38   3.415   0.129  -9.582
  316   HD23  LEU  38          2HD2      LEU  38   2.445  -0.448 -10.940
  317    H    ASP  39           H        ASP  39   6.287  -2.546 -10.355
  318    HA   ASP  39           HA       ASP  39   8.397  -2.919 -12.421
  319    HB2  ASP  39           2HB      ASP  39   9.025  -3.104  -9.928
  320    HB3  ASP  39           3HB      ASP  39   7.993  -4.520  -9.849
  321    H    GLY  40           H        GLY  40   8.466  -5.428 -13.047
  322    HA2  GLY  40           2HA      GLY  40   6.136  -5.977 -14.515
  323    HA3  GLY  40           3HA      GLY  40   7.465  -7.096 -14.265
  324    H    ASN  41           H        ASN  41   4.319  -6.070 -13.204
  325    HA   ASN  41           HA       ASN  41   2.665  -6.936 -11.954
  326    HB2  ASN  41           2HB      ASN  41   4.086  -9.545 -12.570
  327    HB3  ASN  41           3HB      ASN  41   2.549  -9.468 -11.707
  328   HD21  ASN  41          1HD2      ASN  41   0.693  -8.741 -12.803
  329   HD22  ASN  41          2HD2      ASN  41   0.598  -8.758 -14.532
  330    H    ASP  42           H        ASP  42   4.950  -5.896 -10.686
  331    HA   ASP  42           HA       ASP  42   4.551  -6.909  -7.967
  332    HB2  ASP  42           2HB      ASP  42   6.593  -8.038  -8.690
  333    HB3  ASP  42           3HB      ASP  42   7.264  -6.538  -9.313
  334    H    LEU  43           H        LEU  43   4.186  -5.212  -6.655
  335    HA   LEU  43           HA       LEU  43   4.598  -2.454  -7.663
  336    HB2  LEU  43           2HB      LEU  43   2.245  -2.983  -7.712
  337    HB3  LEU  43           3HB      LEU  43   2.315  -3.770  -6.144
  338    HG   LEU  43           HG       LEU  43   2.744  -1.506  -5.100
  339   HD11  LEU  43          1HD1      LEU  43   2.186   0.519  -6.348
  340   HD12  LEU  43          2HD1      LEU  43   2.028  -0.422  -7.831
  341   HD13  LEU  43          3HD1      LEU  43   3.596  -0.290  -7.030
  342   HD21  LEU  43          3HD2      LEU  43   0.131  -1.843  -6.590
  343   HD22  LEU  43          1HD2      LEU  43   0.396  -0.804  -5.189
  344   HD23  LEU  43          2HD2      LEU  43   0.544  -2.551  -5.027
  345    H    GLU  44           H        GLU  44   6.051  -1.380  -6.435
  346    HA   GLU  44           HA       GLU  44   6.380  -2.002  -3.558
  347    HB2  GLU  44           2HB      GLU  44   8.416  -2.072  -4.979
  348    HB3  GLU  44           3HB      GLU  44   8.129  -0.418  -5.498
  349    HG2  GLU  44           2HG      GLU  44   8.487   0.368  -3.181
  350    HG3  GLU  44           3HG      GLU  44   8.788  -1.293  -2.667
  351    H    ILE  45           H        ILE  45   5.770  -0.503  -2.062
  352    HA   ILE  45           HA       ILE  45   5.148   2.300  -2.857
  353    HB   ILE  45           HB       ILE  45   3.421   0.610  -0.960
  354   HG12  ILE  45          2HG1      ILE  45   2.721   1.565  -3.777
  355   HG13  ILE  45          3HG1      ILE  45   3.153  -0.086  -3.353
  356   HG21  ILE  45          1HG2      ILE  45   1.869   2.533  -0.951
  357   HG22  ILE  45          2HG2      ILE  45   2.980   3.445  -1.974
  358   HG23  ILE  45          3HG2      ILE  45   3.460   2.989  -0.338
  359   HD11  ILE  45          3HD1      ILE  45   0.779   0.141  -3.613
  360   HD12  ILE  45          1HD1      ILE  45   0.728   1.414  -2.396
  361   HD13  ILE  45          2HD1      ILE  45   1.168  -0.233  -1.935
  362    H    ARG  46           H        ARG  46   6.174   3.727  -1.502
  363    HA   ARG  46           HA       ARG  46   6.834   2.892   1.264
  364    HB2  ARG  46           2HB      ARG  46   8.602   4.412  -0.698
  365    HB3  ARG  46           3HB      ARG  46   8.921   4.343   1.035
  366    HG2  ARG  46           2HG      ARG  46   9.147   1.918   0.948
  367    HG3  ARG  46           3HG      ARG  46   8.731   1.907  -0.764
  368    HD2  ARG  46           2HD      ARG  46  10.793   3.045  -1.329
  369    HD3  ARG  46           3HD      ARG  46  11.171   3.297   0.379
  370    HE   ARG  46           HE       ARG  46  11.179   0.751   0.498
  371   HH11  ARG  46          1HH1      ARG  46  12.121   2.426  -2.450
  372   HH12  ARG  46          2HH1      ARG  46  13.191   1.159  -2.955
  373   HH21  ARG  46          1HH2      ARG  46  12.642  -0.856  -0.137
  374   HH22  ARG  46          2HH2      ARG  46  13.486  -0.702  -1.647
  375    H    ILE  47           H        ILE  47   5.589   3.966   2.533
  376    HA   ILE  47           HA       ILE  47   4.682   6.709   1.921
  377    HB   ILE  47           HB       ILE  47   3.514   4.699   3.911
  378   HG12  ILE  47          2HG1      ILE  47   2.497   5.553   1.158
  379   HG13  ILE  47          3HG1      ILE  47   3.188   3.985   1.548
  380   HG21  ILE  47          1HG2      ILE  47   2.461   7.415   3.027
  381   HG22  ILE  47          2HG2      ILE  47   3.119   7.024   4.616
  382   HG23  ILE  47          3HG2      ILE  47   1.612   6.281   4.084
  383   HD11  ILE  47          3HD1      ILE  47   1.289   3.539   3.037
  384   HD12  ILE  47          1HD1      ILE  47   0.794   3.852   1.373
  385   HD13  ILE  47          2HD1      ILE  47   0.595   5.103   2.599
  386    H    THR  48           H        THR  48   5.640   8.297   2.998
  387    HA   THR  48           HA       THR  48   7.094   7.795   5.532
  388    HB   THR  48           HB       THR  48   7.862   9.873   3.421
  389    HG1  THR  48           HG1      THR  48   9.160   7.358   3.654
  390   HG21  THR  48          3HG2      THR  48  10.082   9.783   4.487
  391   HG22  THR  48          1HG2      THR  48   9.496   8.570   5.636
  392   HG23  THR  48          2HG2      THR  48   8.846  10.208   5.667
  393    H    GLY  49           H        GLY  49   7.306   9.883   6.849
  394    HA2  GLY  49           2HA      GLY  49   6.626  12.017   7.522
  395    HA3  GLY  49           3HA      GLY  49   5.381  12.027   6.285
  396    H    VAL  50           H        VAL  50   4.072   9.637   6.878
  397    HA   VAL  50           HA       VAL  50   2.336  10.347   8.978
  398    HB   VAL  50           HB       VAL  50   1.297   8.095   8.650
  399   HG11  VAL  50          1HG1      VAL  50   0.574   8.429   6.307
  400   HG12  VAL  50          2HG1      VAL  50   1.897   9.570   6.053
  401   HG13  VAL  50          3HG1      VAL  50   0.612   9.950   7.201
  402   HG21  VAL  50          3HG2      VAL  50   3.565   7.583   6.684
  403   HG22  VAL  50          1HG2      VAL  50   2.144   6.554   6.911
  404   HG23  VAL  50          2HG2      VAL  50   3.310   6.752   8.218
  405    HA   PRO  51           HA       PRO  51   4.788   8.937  12.518
  406    HB2  PRO  51           2HB      PRO  51   2.762   8.975  14.422
  407    HB3  PRO  51           3HB      PRO  51   3.619  10.423  13.860
  408    HG2  PRO  51           2HG      PRO  51   0.956   9.360  13.012
  409    HG3  PRO  51           3HG      PRO  51   1.448  11.036  13.346
  410    HD2  PRO  51           2HD      PRO  51   1.225  10.107  10.822
  411    HD3  PRO  51           3HD      PRO  51   2.470  11.294  11.270
  412    H    GLU  52           H        GLU  52   4.568   7.250  14.327
  413    HA   GLU  52           HA       GLU  52   4.573   4.768  12.974
  414    HB2  GLU  52           2HB      GLU  52   6.090   5.437  14.852
  415    HB3  GLU  52           3HB      GLU  52   4.743   5.273  15.970
  416    HG2  GLU  52           2HG      GLU  52   6.171   3.316  16.089
  417    HG3  GLU  52           3HG      GLU  52   4.594   2.877  15.436
  418    H    GLN  53           H        GLN  53   2.261   6.228  15.194
  419    HA   GLN  53           HA       GLN  53   0.552   4.030  15.652
  420    HB2  GLN  53           2HB      GLN  53  -1.168   5.734  16.234
  421    HB3  GLN  53           3HB      GLN  53   0.381   6.053  17.007
  422    HG2  GLN  53           2HG      GLN  53   0.837   7.901  15.595
  423    HG3  GLN  53           3HG      GLN  53  -0.412   7.436  14.440
  424   HE21  GLN  53          1HE2      GLN  53  -2.572   7.907  14.892
  425   HE22  GLN  53          2HE2      GLN  53  -3.030   9.060  16.096
  426    H    VAL  54           H        VAL  54   0.679   6.387  13.034
  427    HA   VAL  54           HA       VAL  54  -1.796   5.579  11.796
  428    HB   VAL  54           HB       VAL  54   0.416   7.456  10.852
  429   HG11  VAL  54          1HG1      VAL  54  -1.167   8.270   9.133
  430   HG12  VAL  54          2HG1      VAL  54  -2.303   6.992   9.573
  431   HG13  VAL  54          3HG1      VAL  54  -0.736   6.579   8.878
  432   HG21  VAL  54          3HG2      VAL  54  -0.801   8.260  12.829
  433   HG22  VAL  54          1HG2      VAL  54  -2.344   8.043  11.994
  434   HG23  VAL  54          2HG2      VAL  54  -1.188   9.250  11.423
  435    H    ARG  55           H        ARG  55   1.625   4.848  11.378
  436    HA   ARG  55           HA       ARG  55   1.510   3.442   8.933
  437    HB2  ARG  55           2HB      ARG  55   3.410   3.172  11.303
  438    HB3  ARG  55           3HB      ARG  55   3.636   2.312   9.783
  439    HG2  ARG  55           2HG      ARG  55   3.601   4.590   8.632
  440    HG3  ARG  55           3HG      ARG  55   3.702   5.305  10.239
  441    HD2  ARG  55           2HD      ARG  55   5.730   3.304   9.219
  442    HD3  ARG  55           3HD      ARG  55   5.887   5.030   8.929
  443    HE   ARG  55           HE       ARG  55   6.101   3.659  11.535
  444   HH11  ARG  55          1HH1      ARG  55   6.489   6.595   9.630
  445   HH12  ARG  55          2HH1      ARG  55   7.411   7.411  10.845
  446   HH21  ARG  55          1HH2      ARG  55   7.336   4.758  13.134
  447   HH22  ARG  55          2HH2      ARG  55   7.890   6.380  12.821
  448    H    LYS  56           H        LYS  56   0.732   2.430  12.221
  449    HA   LYS  56           HA       LYS  56   0.277  -0.315  11.757
  450    HB2  LYS  56           2HB      LYS  56  -1.146   1.535  13.721
  451    HB3  LYS  56           3HB      LYS  56  -1.151  -0.224  13.794
  452    HG2  LYS  56           2HG      LYS  56   1.257   1.578  14.149
  453    HG3  LYS  56           3HG      LYS  56   0.404   0.699  15.420
  454    HD2  LYS  56           2HD      LYS  56   1.058  -1.452  14.370
  455    HD3  LYS  56           3HD      LYS  56   1.906  -0.576  13.094
  456    HE2  LYS  56           2HE      LYS  56   2.597  -0.529  16.045
  457    HE3  LYS  56           3HE      LYS  56   3.465  -1.408  14.788
  458    HZ1  LYS  56           3HZ      LYS  56   4.571   0.645  15.321
  459    HZ2  LYS  56           1HZ      LYS  56   3.178   1.534  14.973
  460    HZ3  LYS  56           2HZ      LYS  56   3.990   0.714  13.738
  461    H    GLU  57           H        GLU  57  -1.761   2.517  11.194
  462    HA   GLU  57           HA       GLU  57  -4.198   1.111  10.639
  463    HB2  GLU  57           2HB      GLU  57  -3.434   3.877   9.594
  464    HB3  GLU  57           3HB      GLU  57  -5.056   3.240   9.830
  465    HG2  GLU  57           2HG      GLU  57  -3.061   4.095  11.919
  466    HG3  GLU  57           3HG      GLU  57  -4.656   4.774  11.605
  467    H    LEU  58           H        LEU  58  -1.564   2.418   8.655
  468    HA   LEU  58           HA       LEU  58  -2.501   1.687   6.104
  469    HB2  LEU  58           2HB      LEU  58   0.236   2.293   7.227
  470    HB3  LEU  58           3HB      LEU  58   0.124   1.614   5.616
  471    HG   LEU  58           HG       LEU  58   0.340   3.984   5.376
  472   HD11  LEU  58          1HD1      LEU  58  -1.201   2.937   3.793
  473   HD12  LEU  58          2HD1      LEU  58  -1.658   4.604   4.119
  474   HD13  LEU  58          3HD1      LEU  58  -2.564   3.283   4.860
  475   HD21  LEU  58          3HD2      LEU  58  -2.022   4.363   7.242
  476   HD22  LEU  58          1HD2      LEU  58  -1.191   5.640   6.347
  477   HD23  LEU  58          2HD2      LEU  58  -0.334   4.740   7.594
  478    H    ALA  59           H        ALA  59  -0.949  -0.260   8.606
  479    HA   ALA  59           HA       ALA  59  -0.294  -2.525   7.073
  480    HB1  ALA  59           3HB      ALA  59  -0.283  -3.753   9.194
  481    HB2  ALA  59           1HB      ALA  59  -1.151  -2.434   9.990
  482    HB3  ALA  59           2HB      ALA  59   0.487  -2.181   9.388
  483    H    LYS  60           H        LYS  60  -3.309  -1.796   8.893
  484    HA   LYS  60           HA       LYS  60  -4.668  -4.181   8.053
  485    HB2  LYS  60           2HB      LYS  60  -5.758  -1.626   9.280
  486    HB3  LYS  60           3HB      LYS  60  -6.772  -2.990   8.871
  487    HG2  LYS  60           2HG      LYS  60  -6.453  -3.512  11.066
  488    HG3  LYS  60           3HG      LYS  60  -4.997  -4.282  10.442
  489    HD2  LYS  60           2HD      LYS  60  -4.419  -2.997  12.405
  490    HD3  LYS  60           3HD      LYS  60  -3.725  -2.192  10.998
  491    HE2  LYS  60           2HE      LYS  60  -5.545  -0.537  11.019
  492    HE3  LYS  60           3HE      LYS  60  -6.319  -1.370  12.371
  493    HZ1  LYS  60           3HZ      LYS  60  -4.445  -0.848  13.764
  494    HZ2  LYS  60           1HZ      LYS  60  -5.011   0.584  13.064
  495    HZ3  LYS  60           2HZ      LYS  60  -3.611  -0.152  12.472
  496    H    GLU  61           H        GLU  61  -4.408  -0.902   6.741
  497    HA   GLU  61           HA       GLU  61  -6.496  -1.107   4.809
  498    HB2  GLU  61           2HB      GLU  61  -3.998   0.647   4.880
  499    HB3  GLU  61           3HB      GLU  61  -5.246   0.782   3.650
  500    HG2  GLU  61           2HG      GLU  61  -5.590   1.254   6.611
  501    HG3  GLU  61           3HG      GLU  61  -5.547   2.488   5.353
  502    H    ALA  62           H        ALA  62  -3.010  -1.761   4.736
  503    HA   ALA  62           HA       ALA  62  -2.738  -2.564   2.080
  504    HB1  ALA  62           3HB      ALA  62  -0.879  -2.082   3.646
  505    HB2  ALA  62           1HB      ALA  62  -0.668  -3.616   2.810
  506    HB3  ALA  62           2HB      ALA  62  -1.207  -3.597   4.492
  507    H    GLU  63           H        GLU  63  -3.582  -4.500   4.949
  508    HA   GLU  63           HA       GLU  63  -3.589  -7.046   3.699
  509    HB2  GLU  63           2HB      GLU  63  -4.920  -6.067   6.253
  510    HB3  GLU  63           3HB      GLU  63  -4.797  -7.763   5.792
  511    HG2  GLU  63           2HG      GLU  63  -2.336  -7.609   5.856
  512    HG3  GLU  63           3HG      GLU  63  -2.458  -5.909   6.301
  513    H    ARG  64           H        ARG  64  -6.218  -4.687   4.262
  514    HA   ARG  64           HA       ARG  64  -8.318  -6.447   3.408
  515    HB2  ARG  64           2HB      ARG  64  -9.800  -4.484   3.397
  516    HB3  ARG  64           3HB      ARG  64  -8.835  -4.520   4.868
  517    HG2  ARG  64           2HG      ARG  64  -7.328  -2.820   3.913
  518    HG3  ARG  64           3HG      ARG  64  -8.309  -2.774   2.452
  519    HD2  ARG  64           2HD      ARG  64  -9.408  -2.098   5.201
  520    HD3  ARG  64           3HD      ARG  64  -8.698  -0.899   4.123
  521    HE   ARG  64           HE       ARG  64 -10.850  -2.448   2.950
  522   HH11  ARG  64          1HH1      ARG  64 -10.083   0.482   4.789
  523   HH12  ARG  64          2HH1      ARG  64 -11.549   1.292   4.323
  524   HH21  ARG  64          1HH2      ARG  64 -12.724  -1.347   2.309
  525   HH22  ARG  64          2HH2      ARG  64 -13.049   0.253   2.910
  526    H    LEU  65           H        LEU  65  -6.266  -4.052   1.759
  527    HA   LEU  65           HA       LEU  65  -7.568  -4.209  -0.797
  528    HB2  LEU  65           2HB      LEU  65  -4.695  -3.425  -0.135
  529    HB3  LEU  65           3HB      LEU  65  -5.492  -3.141  -1.675
  530    HG   LEU  65           HG       LEU  65  -6.279  -1.879   0.973
  531   HD11  LEU  65          1HD1      LEU  65  -5.445   0.223   0.041
  532   HD12  LEU  65          2HD1      LEU  65  -4.902  -0.621  -1.413
  533   HD13  LEU  65          3HD1      LEU  65  -4.167  -0.985   0.150
  534   HD21  LEU  65          3HD2      LEU  65  -7.819  -0.476  -0.322
  535   HD22  LEU  65          1HD2      LEU  65  -8.246  -2.183  -0.416
  536   HD23  LEU  65          2HD2      LEU  65  -7.444  -1.398  -1.779
  537    H    ALA  66           H        ALA  66  -5.023  -6.028   0.779
  538    HA   ALA  66           HA       ALA  66  -3.964  -7.445  -1.405
  539    HB1  ALA  66           3HB      ALA  66  -3.022  -8.960   0.263
  540    HB2  ALA  66           1HB      ALA  66  -4.122  -8.324   1.493
  541    HB3  ALA  66           2HB      ALA  66  -2.874  -7.286   0.801
  542    H    LYS  67           H        LYS  67  -6.456  -8.418   0.940
  543    HA   LYS  67           HA       LYS  67  -6.991 -10.953  -0.311
  544    HB2  LYS  67           2HB      LYS  67  -8.782 -11.156   1.381
  545    HB3  LYS  67           3HB      LYS  67  -7.264 -10.648   2.109
  546    HG2  LYS  67           2HG      LYS  67  -8.110  -8.286   2.088
  547    HG3  LYS  67           3HG      LYS  67  -9.665  -8.889   1.521
  548    HD2  LYS  67           2HD      LYS  67  -8.339  -9.599   4.167
  549    HD3  LYS  67           3HD      LYS  67  -9.677  -8.474   3.953
  550    HE2  LYS  67           2HE      LYS  67 -11.098 -10.328   3.138
  551    HE3  LYS  67           3HE      LYS  67  -9.757 -11.450   3.375
  552    HZ1  LYS  67           3HZ      LYS  67 -11.130  -9.884   5.494
  553    HZ2  LYS  67           1HZ      LYS  67  -9.793 -10.885   5.748
  554    HZ3  LYS  67           2HZ      LYS  67 -11.257 -11.547   5.236
  555    H    GLU  68           H        GLU  68  -8.160  -7.736  -0.766
  556    HA   GLU  68           HA       GLU  68 -10.727  -8.370  -1.907
  557    HB2  GLU  68           2HB      GLU  68 -10.201  -6.187  -0.785
  558    HB3  GLU  68           3HB      GLU  68  -9.090  -5.798  -2.091
  559    HG2  GLU  68           2HG      GLU  68 -11.220  -4.623  -2.342
  560    HG3  GLU  68           3HG      GLU  68 -10.951  -5.737  -3.681
  561    H    PHE  69           H        PHE  69  -7.617  -7.217  -3.224
  562    HA   PHE  69           HA       PHE  69  -8.549  -7.520  -5.982
  563    HB2  PHE  69           2HB      PHE  69  -5.968  -6.362  -4.845
  564    HB3  PHE  69           3HB      PHE  69  -6.444  -6.310  -6.535
  565    HD1  PHE  69           HD1      PHE  69  -8.999  -5.299  -6.832
  566    HD2  PHE  69           HD2      PHE  69  -6.253  -4.361  -3.690
  567    HE1  PHE  69           HE1      PHE  69 -10.155  -3.162  -6.448
  568    HE2  PHE  69           HE2      PHE  69  -7.416  -2.227  -3.316
  569    HZ   PHE  69           HZ       PHE  69  -9.359  -1.624  -4.690
  570    H    ASN  70           H        ASN  70  -7.276  -9.603  -3.816
  571    HA   ASN  70           HA       ASN  70  -6.290 -11.628  -3.881
  572    HB2  ASN  70           2HB      ASN  70  -7.996 -12.026  -5.671
  573    HB3  ASN  70           3HB      ASN  70  -6.843 -11.492  -6.885
  574   HD21  ASN  70          1HD2      ASN  70  -6.917 -13.455  -7.972
  575   HD22  ASN  70          2HD2      ASN  70  -6.205 -14.904  -7.349
  576    H    ILE  71           H        ILE  71  -4.538  -9.872  -3.477
  577    HA   ILE  71           HA       ILE  71  -2.135 -10.583  -5.021
  578    HB   ILE  71           HB       ILE  71  -1.296  -8.211  -4.652
  579   HG12  ILE  71          2HG1      ILE  71  -4.200  -7.728  -3.851
  580   HG13  ILE  71          3HG1      ILE  71  -2.765  -7.429  -2.879
  581   HG21  ILE  71          1HG2      ILE  71  -2.447  -7.242  -6.577
  582   HG22  ILE  71          2HG2      ILE  71  -3.761  -8.407  -6.414
  583   HG23  ILE  71          3HG2      ILE  71  -2.144  -8.957  -6.854
  584   HD11  ILE  71          3HD1      ILE  71  -3.660  -5.348  -3.664
  585   HD12  ILE  71          1HD1      ILE  71  -3.627  -5.907  -5.336
  586   HD13  ILE  71          2HD1      ILE  71  -2.116  -5.639  -4.465
  587    H    THR  72           H        THR  72  -0.223 -10.647  -3.796
  588    HA   THR  72           HA       THR  72  -0.553 -11.281  -0.981
  589    HB   THR  72           HB       THR  72   2.027 -11.726  -1.261
  590    HG1  THR  72           HG1      THR  72   2.738 -11.934  -3.362
  591   HG21  THR  72          3HG2      THR  72   1.641 -13.920  -2.299
  592   HG22  THR  72          1HG2      THR  72   0.061 -13.392  -2.881
  593   HG23  THR  72          2HG2      THR  72   0.357 -13.552  -1.147
  594    H    VAL  73           H        VAL  73   0.014  -9.929   0.702
  595    HA   VAL  73           HA       VAL  73   1.409  -7.397   0.048
  596    HB   VAL  73           HB       VAL  73  -0.900  -7.070   0.944
  597   HG11  VAL  73          1HG1      VAL  73   0.093  -8.334   3.517
  598   HG12  VAL  73          2HG1      VAL  73  -1.124  -9.002   2.427
  599   HG13  VAL  73          3HG1      VAL  73  -1.452  -7.501   3.297
  600   HG21  VAL  73          3HG2      VAL  73  -0.303  -5.389   2.656
  601   HG22  VAL  73          1HG2      VAL  73   0.762  -5.323   1.252
  602   HG23  VAL  73          2HG2      VAL  73   1.321  -6.069   2.752
  603    H    THR  74           H        THR  74   3.278  -6.954   1.080
  604    HA   THR  74           HA       THR  74   3.874  -8.194   3.668
  605    HB   THR  74           HB       THR  74   5.185  -9.518   2.065
  606    HG1  THR  74           HG1      THR  74   7.297  -9.013   2.949
  607   HG21  THR  74          3HG2      THR  74   6.932  -8.539   0.639
  608   HG22  THR  74          1HG2      THR  74   6.458  -6.913   1.147
  609   HG23  THR  74          2HG2      THR  74   5.349  -7.900   0.197
  610    H    TYR  75           H        TYR  75   4.517  -6.664   5.090
  611    HA   TYR  75           HA       TYR  75   5.251  -3.976   4.134
  612    HB2  TYR  75           2HB      TYR  75   3.670  -3.032   5.940
  613    HB3  TYR  75           3HB      TYR  75   2.907  -3.679   4.496
  614    HD1  TYR  75           HD1      TYR  75   3.440  -4.244   8.139
  615    HD2  TYR  75           HD2      TYR  75   1.519  -5.699   4.605
  616    HE1  TYR  75           HE1      TYR  75   2.056  -5.756   9.501
  617    HE2  TYR  75           HE2      TYR  75   0.140  -7.197   5.975
  618    HH   TYR  75           HH       TYR  75   0.155  -8.257   8.110
  619    H    THR  76           H        THR  76   6.762  -2.968   5.377
  620    HA   THR  76           HA       THR  76   7.842  -4.452   7.696
  621    HB   THR  76           HB       THR  76   9.270  -2.386   5.940
  622    HG1  THR  76           HG1      THR  76   8.687  -4.508   4.961
  623   HG21  THR  76          3HG2      THR  76  11.337  -3.222   7.021
  624   HG22  THR  76          1HG2      THR  76  10.378  -4.303   8.040
  625   HG23  THR  76          2HG2      THR  76  10.234  -2.557   8.222
  626    H    ILE  77           H        ILE  77   7.291  -3.606   9.552
  627    HA   ILE  77           HA       ILE  77   7.661  -0.785  10.151
  628    HB   ILE  77           HB       ILE  77   5.479  -0.940  11.663
  629   HG12  ILE  77          2HG1      ILE  77   4.727  -2.884   9.429
  630   HG13  ILE  77          3HG1      ILE  77   4.908  -3.289  11.131
  631   HG21  ILE  77          1HG2      ILE  77   5.239  -0.372   8.700
  632   HG22  ILE  77          2HG2      ILE  77   5.809   0.753   9.933
  633   HG23  ILE  77          3HG2      ILE  77   4.139   0.193   9.960
  634   HD11  ILE  77          3HD1      ILE  77   2.993  -1.830  11.661
  635   HD12  ILE  77          1HD1      ILE  77   2.579  -3.134  10.547
  636   HD13  ILE  77          2HD1      ILE  77   2.796  -1.495   9.938
  637    H    ARG  78           H        ARG  78   8.919  -0.723  11.900
  638    HA   ARG  78           HA       ARG  78   8.653  -2.522  14.129
  639    HB2  ARG  78           2HB      ARG  78  10.996  -3.446  13.939
  640    HB3  ARG  78           3HB      ARG  78   9.873  -4.057  12.736
  641    HG2  ARG  78           2HG      ARG  78  10.848  -2.516  11.048
  642    HG3  ARG  78           3HG      ARG  78  12.003  -1.941  12.251
  643    HD2  ARG  78           2HD      ARG  78  12.977  -4.173  12.433
  644    HD3  ARG  78           3HD      ARG  78  11.762  -4.821  11.324
  645    HE   ARG  78           HE       ARG  78  13.192  -2.721  10.066
  646   HH11  ARG  78          1HH1      ARG  78  13.620  -6.060  11.109
  647   HH12  ARG  78          2HH1      ARG  78  14.827  -6.410   9.913
  648   HH21  ARG  78          1HH2      ARG  78  14.793  -3.210   8.486
  649   HH22  ARG  78          2HH2      ARG  78  15.488  -4.804   8.438
  650    H    GLY  79           H        GLY  79  10.097  -2.001  15.873
  651    HA2  GLY  79           2HA      GLY  79  11.944  -0.157  16.309
  652    HA3  GLY  79           3HA      GLY  79  10.549   0.885  16.006
  653    H    SER  80           H        SER  80  12.167  -1.073  18.278
  654    HA   SER  80           HA       SER  80  11.934  -1.483  20.487
  655    HB2  SER  80           2HB      SER  80   9.835   0.716  20.312
  656    HB3  SER  80           3HB      SER  80  10.452   0.053  21.826
  657    HG   SER  80           HG       SER  80  12.265   1.119  21.579
  658    H    LEU  81           H        LEU  81  10.230  -2.917  18.444
  659    HA   LEU  81           HA       LEU  81   7.789  -3.735  19.647
  660    HB2  LEU  81           2HB      LEU  81   9.528  -5.344  17.732
  661    HB3  LEU  81           3HB      LEU  81   7.846  -5.673  18.122
  662    HG   LEU  81           HG       LEU  81   8.931  -3.316  16.549
  663   HD11  LEU  81          1HD1      LEU  81   7.086  -5.582  15.732
  664   HD12  LEU  81          2HD1      LEU  81   8.776  -5.378  15.262
  665   HD13  LEU  81          3HD1      LEU  81   7.568  -4.219  14.714
  666   HD21  LEU  81          3HD2      LEU  81   6.071  -3.767  17.461
  667   HD22  LEU  81          1HD2      LEU  81   6.593  -2.560  16.282
  668   HD23  LEU  81          2HD2      LEU  81   7.147  -2.454  17.949
  669    H    GLU  82           H        GLU  82  11.090  -4.887  19.896
  670    HA   GLU  82           HA       GLU  82  10.760  -7.175  21.471
  671    HB2  GLU  82           2HB      GLU  82  13.119  -6.768  22.214
  672    HB3  GLU  82           3HB      GLU  82  12.928  -6.660  20.473
  673    HG2  GLU  82           2HG      GLU  82  12.920  -4.180  20.645
  674    HG3  GLU  82           3HG      GLU  82  13.164  -4.320  22.385
  675    H    HIS  83           H        HIS  83  10.550  -7.502  23.670
  676    HA   HIS  83           HA       HIS  83   9.779  -5.175  25.323
  677    HB2  HIS  83           2HB      HIS  83   8.640  -6.757  26.792
  678    HB3  HIS  83           3HB      HIS  83   8.130  -7.051  25.135
  679    HD1  HIS  83           HD1      HIS  83   9.245  -8.796  28.080
  680    HD2  HIS  83           HD2      HIS  83   9.547  -9.421  23.983
  681    HE1  HIS  83           HE1      HIS  83   9.843 -11.220  27.807
  682    HE2  HIS  83           HE2      HIS  83   9.951 -11.591  25.319
  683    H    HIS  84           H        HIS  84  10.731  -4.849  27.377
  684    HA   HIS  84           HA       HIS  84  13.387  -5.841  27.782
  685    HB2  HIS  84           2HB      HIS  84  13.290  -4.656  29.978
  686    HB3  HIS  84           3HB      HIS  84  12.806  -3.629  28.638
  687    HD1  HIS  84           HD1      HIS  84  11.408  -5.388  31.663
  688    HD2  HIS  84           HD2      HIS  84  10.215  -2.596  28.826
  689    HE1  HIS  84           HE1      HIS  84   9.248  -4.438  32.518
  690    HE2  HIS  84           HE2      HIS  84   8.457  -2.897  30.694
  691    H    HIS  85           H        HIS  85  13.727  -7.938  28.233
  692    HA   HIS  85           HA       HIS  85  11.770  -9.664  29.377
  693    HB2  HIS  85           2HB      HIS  85  13.638 -11.389  29.445
  694    HB3  HIS  85           3HB      HIS  85  13.310 -10.695  27.864
  695    HD1  HIS  85           HD1      HIS  85  15.263  -9.731  26.627
  696    HD2  HIS  85           HD2      HIS  85  16.120 -10.324  30.659
  697    HE1  HIS  85           HE1      HIS  85  17.729  -9.339  26.860
  698    HE2  HIS  85           HE2      HIS  85  18.252  -9.820  29.274
  699    H    HIS  86           H        HIS  86  11.330 -10.156  31.411
  700    HA   HIS  86           HA       HIS  86  12.320  -8.594  33.576
  701    HB2  HIS  86           2HB      HIS  86  10.507 -11.046  33.596
  702    HB3  HIS  86           3HB      HIS  86  10.765  -9.975  34.968
  703    HD1  HIS  86           HD1      HIS  86   8.559 -10.472  32.125
  704    HD2  HIS  86           HD2      HIS  86   9.787  -7.221  34.409
  705    HE1  HIS  86           HE1      HIS  86   6.847  -8.683  31.725
  706    HE2  HIS  86           HE2      HIS  86   7.598  -6.731  33.129
  707    H    HIS  87           H        HIS  87  13.325  -9.303  35.513
  708    HA   HIS  87           HA       HIS  87  14.942 -11.774  35.384
  709    HB2  HIS  87           2HB      HIS  87  16.913 -10.515  36.248
  710    HB3  HIS  87           3HB      HIS  87  16.416  -9.929  34.663
  711    HD1  HIS  87           HD1      HIS  87  16.654  -8.915  38.253
  712    HD2  HIS  87           HD2      HIS  87  15.422  -7.261  34.641
  713    HE1  HIS  87           HE1      HIS  87  16.411  -6.456  38.685
  714    HE2  HIS  87           HE2      HIS  87  15.828  -5.456  36.454
  715    H    HIS  88           H        HIS  88  15.642 -12.534  37.474
  716    HA   HIS  88           HA       HIS  88  14.295 -11.413  39.852
  717    HB2  HIS  88           2HB      HIS  88  12.898 -13.304  38.817
  718    HB3  HIS  88           3HB      HIS  88  14.227 -14.398  39.168
  719    HD1  HIS  88           HD1      HIS  88  11.131 -14.119  40.368
  720    HD2  HIS  88           HD2      HIS  88  14.768 -13.596  42.314
  721    HE1  HIS  88           HE1      HIS  88  10.659 -14.527  42.800
  722    HE2  HIS  88           HE2      HIS  88  12.818 -13.976  43.969
  Start of MODEL    5
    1    H1   MET   1           1H       MET   1  12.094   7.269  14.084
    2    H2   MET   1           2H       MET   1  10.882   6.094  14.086
    3    H3   MET   1           3H       MET   1  11.292   6.883  12.647
    4    HA   MET   1           HA       MET   1  13.446   5.898  12.632
    5    HB2  MET   1           2HB      MET   1  14.120   4.237  14.332
    6    HB3  MET   1           3HB      MET   1  13.767   5.778  15.095
    7    HG2  MET   1           2HG      MET   1  11.569   4.926  15.825
    8    HG3  MET   1           3HG      MET   1  11.910   3.379  15.052
    9    HE1  MET   1           3HE      MET   1  14.795   1.960  17.316
   10    HE2  MET   1           1HE      MET   1  15.052   2.917  15.857
   11    HE3  MET   1           2HE      MET   1  13.783   1.692  15.898
   12    H    GLY   2           H        GLY   2  13.661   4.102  11.326
   13    HA2  GLY   2           2HA      GLY   2  13.146   2.245  10.094
   14    HA3  GLY   2           3HA      GLY   2  12.207   1.698  11.473
   15    H    GLU   3           H        GLU   3  12.112   3.498   8.445
   16    HA   GLU   3           HA       GLU   3   9.353   4.298   8.705
   17    HB2  GLU   3           2HB      GLU   3  11.259   5.558   7.491
   18    HB3  GLU   3           3HB      GLU   3  11.046   4.419   6.168
   19    HG2  GLU   3           2HG      GLU   3   9.881   6.537   5.738
   20    HG3  GLU   3           3HG      GLU   3   8.746   5.195   5.839
   21    H    MET   4           H        MET   4   7.879   3.816   6.586
   22    HA   MET   4           HA       MET   4   7.664   0.870   6.627
   23    HB2  MET   4           2HB      MET   4   5.844   2.131   7.773
   24    HB3  MET   4           3HB      MET   4   5.473   2.975   6.271
   25    HG2  MET   4           2HG      MET   4   4.817   0.879   5.219
   26    HG3  MET   4           3HG      MET   4   5.303  -0.027   6.652
   27    HE1  MET   4           3HE      MET   4   2.575  -0.798   5.686
   28    HE2  MET   4           1HE      MET   4   1.548  -0.569   7.100
   29    HE3  MET   4           2HE      MET   4   3.159  -1.260   7.285
   30    H    ASP   5           H        ASP   5   7.708  -0.226   4.811
   31    HA   ASP   5           HA       ASP   5   7.206   1.045   2.192
   32    HB2  ASP   5           2HB      ASP   5   9.583   0.346   2.363
   33    HB3  ASP   5           3HB      ASP   5   9.098  -1.268   2.874
   34    H    ILE   6           H        ILE   6   5.484   0.167   1.246
   35    HA   ILE   6           HA       ILE   6   4.210  -2.291   2.305
   36    HB   ILE   6           HB       ILE   6   2.879   0.135   0.971
   37   HG12  ILE   6          2HG1      ILE   6   2.925  -0.592   3.933
   38   HG13  ILE   6          3HG1      ILE   6   3.890   0.682   3.204
   39   HG21  ILE   6          1HG2      ILE   6   0.754  -0.871   1.737
   40   HG22  ILE   6          2HG2      ILE   6   1.632  -2.246   2.403
   41   HG23  ILE   6          3HG2      ILE   6   1.623  -1.969   0.660
   42   HD11  ILE   6          3HD1      ILE   6   2.016   1.623   4.304
   43   HD12  ILE   6          1HD1      ILE   6   0.901   0.592   3.411
   44   HD13  ILE   6          2HD1      ILE   6   1.824   1.838   2.564
   45    H    ARG   7           H        ARG   7   4.562  -3.867   0.825
   46    HA   ARG   7           HA       ARG   7   4.789  -3.125  -2.034
   47    HB2  ARG   7           2HB      ARG   7   6.951  -3.732  -0.831
   48    HB3  ARG   7           3HB      ARG   7   6.335  -5.373  -0.671
   49    HG2  ARG   7           2HG      ARG   7   6.398  -5.737  -3.039
   50    HG3  ARG   7           3HG      ARG   7   6.559  -4.010  -3.382
   51    HD2  ARG   7           2HD      ARG   7   8.649  -5.834  -2.145
   52    HD3  ARG   7           3HD      ARG   7   8.707  -5.053  -3.731
   53    HE   ARG   7           HE       ARG   7   8.433  -3.087  -1.706
   54   HH11  ARG   7          1HH1      ARG   7  10.907  -5.259  -2.983
   55   HH12  ARG   7          2HH1      ARG   7  12.213  -4.235  -2.473
   56   HH21  ARG   7          1HH2      ARG   7  10.118  -1.823  -1.017
   57   HH22  ARG   7          2HH2      ARG   7  11.761  -2.281  -1.353
   58    H    PHE   8           H        PHE   8   3.366  -4.071  -3.277
   59    HA   PHE   8           HA       PHE   8   1.795  -6.396  -2.318
   60    HB2  PHE   8           2HB      PHE   8   1.170  -4.205  -4.354
   61    HB3  PHE   8           3HB      PHE   8   0.205  -5.664  -4.206
   62    HD1  PHE   8           HD2      PHE   8  -1.284  -6.014  -2.302
   63    HD2  PHE   8           HD1      PHE   8   1.044  -2.436  -2.626
   64    HE1  PHE   8           HE2      PHE   8  -2.703  -4.929  -0.617
   65    HE2  PHE   8           HE1      PHE   8  -0.386  -1.364  -0.936
   66    HZ   PHE   8           HZ       PHE   8  -2.258  -2.608   0.064
   67    H    ARG   9           H        ARG   9   1.783  -8.221  -3.562
   68    HA   ARG   9           HA       ARG   9   2.941  -8.135  -6.281
   69    HB2  ARG   9           2HB      ARG   9   3.373 -10.160  -4.081
   70    HB3  ARG   9           3HB      ARG   9   3.196 -10.797  -5.709
   71    HG2  ARG   9           2HG      ARG   9   5.018  -9.206  -6.441
   72    HG3  ARG   9           3HG      ARG   9   5.270  -8.816  -4.741
   73    HD2  ARG   9           2HD      ARG   9   5.980 -11.058  -4.251
   74    HD3  ARG   9           3HD      ARG   9   5.464 -11.632  -5.843
   75    HE   ARG   9           HE       ARG   9   7.433  -9.539  -5.880
   76   HH11  ARG   9          1HH1      ARG   9   7.010 -13.031  -5.865
   77   HH12  ARG   9          2HH1      ARG   9   8.575 -13.334  -6.557
   78   HH21  ARG   9          1HH2      ARG   9   9.407  -9.925  -6.824
   79   HH22  ARG   9          2HH2      ARG   9   9.939 -11.554  -7.102
   80    H    GLY  10           H        GLY  10   1.647  -8.742  -7.834
   81    HA2  GLY  10           2HA      GLY  10  -0.876 -10.193  -7.210
   82    HA3  GLY  10           3HA      GLY  10  -0.850  -8.747  -8.221
   83    H    ASP  11           H        ASP  11  -1.522 -11.639  -8.731
   84    HA   ASP  11           HA       ASP  11   0.136 -12.505 -10.871
   85    HB2  ASP  11           2HB      ASP  11  -1.563 -13.953  -9.828
   86    HB3  ASP  11           3HB      ASP  11  -2.852 -12.893 -10.372
   87    H    ASP  12           H        ASP  12  -2.172  -9.994 -10.475
   88    HA   ASP  12           HA       ASP  12  -2.127  -9.224 -13.330
   89    HB2  ASP  12           2HB      ASP  12  -4.359 -10.042 -12.675
   90    HB3  ASP  12           3HB      ASP  12  -4.389  -8.948 -11.295
   91    H    LEU  13           H        LEU  13  -1.148  -7.314 -13.653
   92    HA   LEU  13           HA       LEU  13  -0.082  -5.731 -11.551
   93    HB2  LEU  13           2HB      LEU  13   1.019  -6.029 -13.764
   94    HB3  LEU  13           3HB      LEU  13  -0.261  -5.103 -14.523
   95    HG   LEU  13           HG       LEU  13   0.463  -3.072 -13.243
   96   HD11  LEU  13          1HD1      LEU  13   2.760  -4.790 -12.253
   97   HD12  LEU  13          2HD1      LEU  13   1.447  -4.130 -11.273
   98   HD13  LEU  13          3HD1      LEU  13   2.599  -3.043 -12.041
   99   HD21  LEU  13          3HD2      LEU  13   2.694  -4.351 -14.861
  100   HD22  LEU  13          1HD2      LEU  13   2.517  -2.628 -14.511
  101   HD23  LEU  13          2HD2      LEU  13   1.324  -3.449 -15.515
  102    H    GLU  14           H        GLU  14  -3.085  -5.524 -13.350
  103    HA   GLU  14           HA       GLU  14  -3.601  -2.727 -12.871
  104    HB2  GLU  14           2HB      GLU  14  -5.317  -4.992 -13.908
  105    HB3  GLU  14           3HB      GLU  14  -6.098  -3.506 -13.368
  106    HG2  GLU  14           2HG      GLU  14  -4.621  -2.243 -14.986
  107    HG3  GLU  14           3HG      GLU  14  -4.084  -3.798 -15.622
  108    H    ALA  15           H        ALA  15  -4.512  -5.738 -11.229
  109    HA   ALA  15           HA       ALA  15  -6.291  -4.736  -9.307
  110    HB1  ALA  15           3HB      ALA  15  -4.381  -7.095  -9.119
  111    HB2  ALA  15           1HB      ALA  15  -6.014  -7.134  -9.778
  112    HB3  ALA  15           2HB      ALA  15  -5.763  -6.821  -8.061
  113    H    LEU  16           H        LEU  16  -2.785  -4.942  -9.395
  114    HA   LEU  16           HA       LEU  16  -2.140  -3.977  -6.828
  115    HB2  LEU  16           2HB      LEU  16  -0.596  -3.672  -9.436
  116    HB3  LEU  16           3HB      LEU  16   0.072  -3.404  -7.833
  117    HG   LEU  16           HG       LEU  16  -0.903  -6.070  -8.925
  118   HD11  LEU  16          1HD1      LEU  16   1.918  -5.119  -8.347
  119   HD12  LEU  16          2HD1      LEU  16   1.201  -5.342  -9.945
  120   HD13  LEU  16          3HD1      LEU  16   1.452  -6.734  -8.894
  121   HD21  LEU  16          3HD2      LEU  16  -1.315  -5.929  -6.528
  122   HD22  LEU  16          1HD2      LEU  16   0.356  -5.436  -6.246
  123   HD23  LEU  16          2HD2      LEU  16  -0.001  -7.047  -6.866
  124    H    GLU  17           H        GLU  17  -2.723  -2.314  -9.929
  125    HA   GLU  17           HA       GLU  17  -1.917   0.287  -9.091
  126    HB2  GLU  17           2HB      GLU  17  -3.699  -0.540 -11.426
  127    HB3  GLU  17           3HB      GLU  17  -3.017   1.068 -11.195
  128    HG2  GLU  17           2HG      GLU  17  -0.737   0.159 -11.395
  129    HG3  GLU  17           3HG      GLU  17  -1.396  -1.463 -11.583
  130    H    LYS  18           H        LYS  18  -5.063  -1.357  -9.020
  131    HA   LYS  18           HA       LYS  18  -6.589   0.952  -8.234
  132    HB2  LYS  18           2HB      LYS  18  -7.166  -2.024  -8.186
  133    HB3  LYS  18           3HB      LYS  18  -8.251  -0.900  -7.381
  134    HG2  LYS  18           2HG      LYS  18  -9.216  -1.326  -9.489
  135    HG3  LYS  18           3HG      LYS  18  -8.520   0.289  -9.609
  136    HD2  LYS  18           2HD      LYS  18  -6.599  -0.624 -10.855
  137    HD3  LYS  18           3HD      LYS  18  -7.244  -2.258 -10.671
  138    HE2  LYS  18           2HE      LYS  18  -9.258  -1.561 -11.980
  139    HE3  LYS  18           3HE      LYS  18  -8.508   0.015 -12.237
  140    HZ1  LYS  18           3HZ      LYS  18  -7.575  -2.612 -13.225
  141    HZ2  LYS  18           1HZ      LYS  18  -6.622  -1.218 -13.267
  142    HZ3  LYS  18           2HZ      LYS  18  -8.069  -1.274 -14.133
  143    H    ALA  19           H        ALA  19  -5.040  -1.756  -6.452
  144    HA   ALA  19           HA       ALA  19  -5.649  -0.977  -3.812
  145    HB1  ALA  19           3HB      ALA  19  -4.636  -3.150  -4.388
  146    HB2  ALA  19           1HB      ALA  19  -3.698  -2.322  -3.143
  147    HB3  ALA  19           2HB      ALA  19  -3.128  -2.343  -4.817
  148    H    LEU  20           H        LEU  20  -2.955  -0.080  -5.913
  149    HA   LEU  20           HA       LEU  20  -1.443   1.582  -4.287
  150    HB2  LEU  20           2HB      LEU  20  -0.640   0.740  -6.406
  151    HB3  LEU  20           3HB      LEU  20  -1.907   1.537  -7.299
  152    HG   LEU  20           HG       LEU  20   0.530   2.463  -7.408
  153   HD11  LEU  20          1HD1      LEU  20  -1.736   4.410  -6.971
  154   HD12  LEU  20          2HD1      LEU  20  -1.320   3.603  -8.482
  155   HD13  LEU  20          3HD1      LEU  20  -0.198   4.760  -7.770
  156   HD21  LEU  20          3HD2      LEU  20  -0.286   3.762  -4.792
  157   HD22  LEU  20          1HD2      LEU  20   1.170   4.113  -5.724
  158   HD23  LEU  20          2HD2      LEU  20   0.961   2.529  -4.984
  159    H    LYS  21           H        LYS  21  -4.118   2.424  -6.498
  160    HA   LYS  21           HA       LYS  21  -4.096   5.182  -6.209
  161    HB2  LYS  21           2HB      LYS  21  -5.386   3.957  -7.935
  162    HB3  LYS  21           3HB      LYS  21  -6.462   3.307  -6.715
  163    HG2  LYS  21           2HG      LYS  21  -6.266   6.291  -7.188
  164    HG3  LYS  21           3HG      LYS  21  -7.279   5.283  -8.211
  165    HD2  LYS  21           2HD      LYS  21  -7.571   5.631  -5.201
  166    HD3  LYS  21           3HD      LYS  21  -8.583   6.386  -6.428
  167    HE2  LYS  21           2HE      LYS  21  -8.348   3.384  -6.026
  168    HE3  LYS  21           3HE      LYS  21  -9.629   4.387  -5.349
  169    HZ1  LYS  21           3HZ      LYS  21 -10.305   4.976  -7.574
  170    HZ2  LYS  21           1HZ      LYS  21 -10.323   3.298  -7.371
  171    HZ3  LYS  21           2HZ      LYS  21  -9.071   4.035  -8.239
  172    H    GLU  22           H        GLU  22  -5.698   2.681  -4.281
  173    HA   GLU  22           HA       GLU  22  -7.004   4.385  -2.426
  174    HB2  GLU  22           2HB      GLU  22  -6.240   1.449  -2.349
  175    HB3  GLU  22           3HB      GLU  22  -7.101   2.227  -1.028
  176    HG2  GLU  22           2HG      GLU  22  -8.110   2.104  -3.881
  177    HG3  GLU  22           3HG      GLU  22  -8.569   0.974  -2.608
  178    H    MET  23           H        MET  23  -3.788   2.730  -2.331
  179    HA   MET  23           HA       MET  23  -3.196   3.490   0.353
  180    HB2  MET  23           2HB      MET  23  -1.284   2.687  -1.883
  181    HB3  MET  23           3HB      MET  23  -0.847   2.826  -0.181
  182    HG2  MET  23           2HG      MET  23  -2.793   0.855  -1.388
  183    HG3  MET  23           3HG      MET  23  -1.197   0.499  -0.742
  184    HE1  MET  23           3HE      MET  23  -1.763   0.946   3.104
  185    HE2  MET  23           1HE      MET  23  -1.150   2.171   1.995
  186    HE3  MET  23           2HE      MET  23  -0.620   0.495   1.838
  187    H    ILE  24           H        ILE  24  -2.740   5.135  -2.721
  188    HA   ILE  24           HA       ILE  24  -1.131   7.311  -1.786
  189    HB   ILE  24           HB       ILE  24  -3.032   7.083  -4.182
  190   HG12  ILE  24          2HG1      ILE  24   0.014   7.019  -3.944
  191   HG13  ILE  24          3HG1      ILE  24  -1.039   5.708  -4.457
  192   HG21  ILE  24          1HG2      ILE  24  -2.963   9.447  -3.501
  193   HG22  ILE  24          2HG2      ILE  24  -2.123   9.217  -5.034
  194   HG23  ILE  24          3HG2      ILE  24  -1.198   9.423  -3.545
  195   HD11  ILE  24          3HD1      ILE  24   0.110   6.620  -6.352
  196   HD12  ILE  24          1HD1      ILE  24  -0.463   8.246  -5.978
  197   HD13  ILE  24          2HD1      ILE  24  -1.606   7.000  -6.485
  198    H    ARG  25           H        ARG  25  -4.621   6.919  -2.361
  199    HA   ARG  25           HA       ARG  25  -5.732   9.224  -1.351
  200    HB2  ARG  25           2HB      ARG  25  -7.077   7.545  -2.475
  201    HB3  ARG  25           3HB      ARG  25  -6.668   6.330  -1.281
  202    HG2  ARG  25           2HG      ARG  25  -8.025   7.641   0.401
  203    HG3  ARG  25           3HG      ARG  25  -8.543   8.683  -0.924
  204    HD2  ARG  25           2HD      ARG  25  -9.461   6.662  -2.091
  205    HD3  ARG  25           3HD      ARG  25  -9.023   5.696  -0.678
  206    HE   ARG  25           HE       ARG  25 -10.656   7.839   0.152
  207   HH11  ARG  25          1HH1      ARG  25 -10.925   4.828  -1.679
  208   HH12  ARG  25          2HH1      ARG  25 -12.610   4.609  -1.302
  209   HH21  ARG  25          1HH2      ARG  25 -12.891   7.539   0.609
  210   HH22  ARG  25          2HH2      ARG  25 -13.712   6.138  -0.013
  211    H    GLN  26           H        GLN  26  -4.673   6.344   0.439
  212    HA   GLN  26           HA       GLN  26  -5.625   7.152   3.002
  213    HB2  GLN  26           2HB      GLN  26  -3.516   5.076   2.263
  214    HB3  GLN  26           3HB      GLN  26  -4.182   5.293   3.879
  215    HG2  GLN  26           2HG      GLN  26  -5.688   4.410   1.411
  216    HG3  GLN  26           3HG      GLN  26  -5.258   3.413   2.791
  217   HE21  GLN  26          1HE2      GLN  26  -7.868   4.229   1.524
  218   HE22  GLN  26          2HE2      GLN  26  -8.832   4.786   2.845
  219    H    ALA  27           H        ALA  27  -2.324   7.090   1.589
  220    HA   ALA  27           HA       ALA  27  -0.967   8.170   3.787
  221    HB1  ALA  27           3HB      ALA  27   0.867   8.613   2.236
  222    HB2  ALA  27           1HB      ALA  27  -0.227   8.404   0.861
  223    HB3  ALA  27           2HB      ALA  27   0.139   7.040   1.915
  224    H    ARG  28           H        ARG  28  -2.751   9.799   1.219
  225    HA   ARG  28           HA       ARG  28  -1.791  12.461   1.829
  226    HB2  ARG  28           2HB      ARG  28  -4.200  11.586   0.175
  227    HB3  ARG  28           3HB      ARG  28  -3.559  13.227   0.252
  228    HG2  ARG  28           2HG      ARG  28  -1.405  12.383  -0.710
  229    HG3  ARG  28           3HG      ARG  28  -2.140  10.792  -0.870
  230    HD2  ARG  28           2HD      ARG  28  -3.080  13.331  -2.239
  231    HD3  ARG  28           3HD      ARG  28  -2.197  12.001  -2.993
  232    HE   ARG  28           HE       ARG  28  -4.702  11.250  -1.745
  233   HH11  ARG  28          1HH1      ARG  28  -3.210  12.344  -4.748
  234   HH12  ARG  28          2HH1      ARG  28  -4.487  11.725  -5.742
  235   HH21  ARG  28          1HH2      ARG  28  -6.351  10.436  -3.068
  236   HH22  ARG  28          2HH2      ARG  28  -6.266  10.647  -4.785
  237    H    LYS  29           H        LYS  29  -4.743  10.580   2.610
  238    HA   LYS  29           HA       LYS  29  -5.987  12.730   4.080
  239    HB2  LYS  29           2HB      LYS  29  -7.709  11.186   4.694
  240    HB3  LYS  29           3HB      LYS  29  -7.268  10.811   3.037
  241    HG2  LYS  29           2HG      LYS  29  -5.890   8.906   3.890
  242    HG3  LYS  29           3HG      LYS  29  -6.477   9.248   5.513
  243    HD2  LYS  29           2HD      LYS  29  -8.163   8.404   3.127
  244    HD3  LYS  29           3HD      LYS  29  -7.724   7.394   4.504
  245    HE2  LYS  29           2HE      LYS  29  -9.543   9.817   4.520
  246    HE3  LYS  29           3HE      LYS  29  -9.989   8.139   4.805
  247    HZ1  LYS  29           3HZ      LYS  29  -9.863   9.328   6.860
  248    HZ2  LYS  29           1HZ      LYS  29  -8.277   9.813   6.545
  249    HZ3  LYS  29           2HZ      LYS  29  -8.625   8.183   6.810
  250    H    PHE  30           H        PHE  30  -3.542  10.436   4.792
  251    HA   PHE  30           HA       PHE  30  -3.607  10.935   7.688
  252    HB2  PHE  30           2HB      PHE  30  -1.855   9.117   5.967
  253    HB3  PHE  30           3HB      PHE  30  -1.676   9.288   7.708
  254    HD1  PHE  30           HD1      PHE  30  -4.531   9.254   8.615
  255    HD2  PHE  30           HD2      PHE  30  -2.534   6.863   5.687
  256    HE1  PHE  30           HE1      PHE  30  -6.121   7.417   9.004
  257    HE2  PHE  30           HE2      PHE  30  -4.139   5.038   6.084
  258    HZ   PHE  30           HZ       PHE  30  -5.925   5.314   7.746
  259    H    ALA  31           H        ALA  31  -2.580  12.658   5.124
  260    HA   ALA  31           HA       ALA  31  -1.199  14.415   4.772
  261    HB1  ALA  31           3HB      ALA  31  -0.732  15.865   6.702
  262    HB2  ALA  31           1HB      ALA  31  -1.170  14.559   7.806
  263    HB3  ALA  31           2HB      ALA  31  -2.390  15.265   6.743
  264    H    GLY  32           H        GLY  32   0.093  11.969   4.631
  265    HA2  GLY  32           2HA      GLY  32   2.892  12.645   5.340
  266    HA3  GLY  32           3HA      GLY  32   2.274  11.004   5.190
  267    H    THR  33           H        THR  33   4.196  10.937   3.710
  268    HA   THR  33           HA       THR  33   3.743  11.996   0.986
  269    HB   THR  33           HB       THR  33   6.243  10.863   2.361
  270    HG1  THR  33           HG1      THR  33   5.413  13.495   1.669
  271   HG21  THR  33          3HG2      THR  33   6.037  12.056  -0.434
  272   HG22  THR  33          1HG2      THR  33   6.370  10.365  -0.052
  273   HG23  THR  33          2HG2      THR  33   7.531  11.617   0.398
  274    H    VAL  34           H        VAL  34   3.708  10.524  -0.806
  275    HA   VAL  34           HA       VAL  34   4.041   7.653  -0.329
  276    HB   VAL  34           HB       VAL  34   1.640   7.998  -0.040
  277   HG11  VAL  34          1HG1      VAL  34   0.160   8.860  -1.798
  278   HG12  VAL  34          2HG1      VAL  34   1.563   9.246  -2.797
  279   HG13  VAL  34          3HG1      VAL  34   1.316  10.083  -1.264
  280   HG21  VAL  34          3HG2      VAL  34   2.195   6.646  -2.704
  281   HG22  VAL  34          1HG2      VAL  34   0.748   6.426  -1.714
  282   HG23  VAL  34          2HG2      VAL  34   2.319   5.897  -1.110
  283    H    THR  35           H        THR  35   5.027   6.654  -1.994
  284    HA   THR  35           HA       THR  35   5.017   7.734  -4.737
  285    HB   THR  35           HB       THR  35   7.593   6.855  -3.304
  286    HG1  THR  35           HG1      THR  35   6.374   9.343  -3.539
  287   HG21  THR  35          3HG2      THR  35   7.643   6.480  -5.765
  288   HG22  THR  35          1HG2      THR  35   8.768   7.749  -5.277
  289   HG23  THR  35          2HG2      THR  35   7.230   8.177  -6.026
  290    H    TYR  36           H        TYR  36   5.586   5.931  -6.314
  291    HA   TYR  36           HA       TYR  36   5.672   3.236  -5.155
  292    HB2  TYR  36           2HB      TYR  36   3.865   2.380  -6.583
  293    HB3  TYR  36           3HB      TYR  36   3.281   3.612  -5.476
  294    HD1  TYR  36           HD2      TYR  36   2.805   5.962  -6.385
  295    HD2  TYR  36           HD1      TYR  36   3.556   2.631  -8.971
  296    HE1  TYR  36           HE2      TYR  36   1.751   7.165  -8.252
  297    HE2  TYR  36           HE1      TYR  36   2.490   3.842 -10.824
  298    HH   TYR  36           HH       TYR  36   0.838   5.677 -11.122
  299    H    THR  37           H        THR  37   6.383   1.606  -6.492
  300    HA   THR  37           HA       THR  37   7.499   2.310  -9.145
  301    HB   THR  37           HB       THR  37   8.721   0.373  -7.108
  302    HG1  THR  37           HG1      THR  37   9.862   1.994  -6.407
  303   HG21  THR  37          3HG2      THR  37   9.239  -0.266  -9.439
  304   HG22  THR  37          1HG2      THR  37  10.680   0.345  -8.625
  305   HG23  THR  37          2HG2      THR  37   9.818   1.368  -9.775
  306    H    LEU  38           H        LEU  38   5.902   1.368 -10.449
  307    HA   LEU  38           HA       LEU  38   5.018  -1.373 -10.057
  308    HB2  LEU  38           2HB      LEU  38   4.929   0.428 -12.529
  309    HB3  LEU  38           3HB      LEU  38   4.201  -1.168 -12.442
  310    HG   LEU  38           HG       LEU  38   3.356   1.247 -10.794
  311   HD11  LEU  38          1HD1      LEU  38   2.727   1.508 -13.135
  312   HD12  LEU  38          2HD1      LEU  38   1.301   1.200 -12.150
  313   HD13  LEU  38          3HD1      LEU  38   1.974  -0.092 -13.145
  314   HD21  LEU  38          3HD2      LEU  38   1.474  -0.115 -10.030
  315   HD22  LEU  38          1HD2      LEU  38   3.010  -0.835  -9.546
  316   HD23  LEU  38          2HD2      LEU  38   2.106  -1.513 -10.904
  317    H    ASP  39           H        ASP  39   6.500  -2.954 -10.187
  318    HA   ASP  39           HA       ASP  39   8.555  -2.970 -12.309
  319    HB2  ASP  39           2HB      ASP  39   9.634  -2.067 -10.256
  320    HB3  ASP  39           3HB      ASP  39   9.089  -3.463  -9.339
  321    H    GLY  40           H        GLY  40   7.600  -4.575 -13.419
  322    HA2  GLY  40           2HA      GLY  40   6.901  -6.642 -14.049
  323    HA3  GLY  40           3HA      GLY  40   7.696  -7.283 -12.618
  324    H    ASN  41           H        ASN  41   6.417  -8.126 -11.123
  325    HA   ASN  41           HA       ASN  41   3.536  -7.450 -11.030
  326    HB2  ASN  41           2HB      ASN  41   5.001  -9.996 -10.201
  327    HB3  ASN  41           3HB      ASN  41   3.292  -9.685  -9.879
  328   HD21  ASN  41          1HD2      ASN  41   1.827  -9.623 -11.652
  329   HD22  ASN  41          2HD2      ASN  41   2.231 -10.312 -13.185
  330    H    ASP  42           H        ASP  42   6.236  -6.492  -9.545
  331    HA   ASP  42           HA       ASP  42   5.126  -6.404  -6.822
  332    HB2  ASP  42           2HB      ASP  42   7.836  -5.596  -7.951
  333    HB3  ASP  42           3HB      ASP  42   7.332  -5.151  -6.325
  334    H    LEU  43           H        LEU  43   4.418  -4.613  -5.928
  335    HA   LEU  43           HA       LEU  43   4.591  -1.980  -7.262
  336    HB2  LEU  43           2HB      LEU  43   2.297  -2.760  -7.343
  337    HB3  LEU  43           3HB      LEU  43   2.369  -3.353  -5.693
  338    HG   LEU  43           HG       LEU  43   2.506  -0.962  -4.898
  339   HD11  LEU  43          1HD1      LEU  43   1.849   0.855  -6.375
  340   HD12  LEU  43          2HD1      LEU  43   1.838  -0.243  -7.755
  341   HD13  LEU  43          3HD1      LEU  43   3.351   0.109  -6.918
  342   HD21  LEU  43          3HD2      LEU  43   0.032  -1.695  -6.481
  343   HD22  LEU  43          1HD2      LEU  43   0.118  -0.537  -5.151
  344   HD23  LEU  43          2HD2      LEU  43   0.422  -2.246  -4.850
  345    H    GLU  44           H        GLU  44   6.311  -1.119  -6.136
  346    HA   GLU  44           HA       GLU  44   6.648  -1.549  -3.247
  347    HB2  GLU  44           2HB      GLU  44   8.624  -1.820  -4.685
  348    HB3  GLU  44           3HB      GLU  44   8.391  -0.227  -5.392
  349    HG2  GLU  44           2HG      GLU  44   8.768   0.710  -3.032
  350    HG3  GLU  44           3HG      GLU  44   9.303  -0.904  -2.578
  351    H    ILE  45           H        ILE  45   5.178  -0.235  -2.220
  352    HA   ILE  45           HA       ILE  45   4.913   2.624  -2.945
  353    HB   ILE  45           HB       ILE  45   3.288   0.967  -0.932
  354   HG12  ILE  45          2HG1      ILE  45   2.526   1.810  -3.772
  355   HG13  ILE  45          3HG1      ILE  45   2.995   0.184  -3.293
  356   HG21  ILE  45          1HG2      ILE  45   3.284   3.379  -0.405
  357   HG22  ILE  45          2HG2      ILE  45   1.693   2.853  -0.953
  358   HG23  ILE  45          3HG2      ILE  45   2.749   3.752  -2.046
  359   HD11  ILE  45          3HD1      ILE  45   0.608   0.368  -3.519
  360   HD12  ILE  45          1HD1      ILE  45   0.560   1.665  -2.327
  361   HD13  ILE  45          2HD1      ILE  45   1.043   0.035  -1.845
  362    H    ARG  46           H        ARG  46   6.060   4.092  -1.754
  363    HA   ARG  46           HA       ARG  46   7.160   3.331   0.889
  364    HB2  ARG  46           2HB      ARG  46   8.154   5.495  -1.025
  365    HB3  ARG  46           3HB      ARG  46   8.937   4.964   0.460
  366    HG2  ARG  46           2HG      ARG  46   9.355   2.742  -0.565
  367    HG3  ARG  46           3HG      ARG  46   8.584   3.300  -2.052
  368    HD2  ARG  46           2HD      ARG  46  10.307   5.095  -2.229
  369    HD3  ARG  46           3HD      ARG  46  11.108   4.429  -0.802
  370    HE   ARG  46           HE       ARG  46  10.763   2.466  -2.858
  371   HH11  ARG  46          1HH1      ARG  46  12.802   5.186  -1.931
  372   HH12  ARG  46          2HH1      ARG  46  14.176   4.613  -2.824
  373   HH21  ARG  46          1HH2      ARG  46  12.567   1.720  -4.023
  374   HH22  ARG  46          2HH2      ARG  46  14.041   2.644  -4.012
  375    H    ILE  47           H        ILE  47   5.740   4.091   2.368
  376    HA   ILE  47           HA       ILE  47   4.626   6.810   2.076
  377    HB   ILE  47           HB       ILE  47   3.587   4.466   3.736
  378   HG12  ILE  47          2HG1      ILE  47   2.541   5.850   1.217
  379   HG13  ILE  47          3HG1      ILE  47   3.142   4.204   1.334
  380   HG21  ILE  47          1HG2      ILE  47   1.669   5.926   4.329
  381   HG22  ILE  47          2HG2      ILE  47   2.447   7.277   3.501
  382   HG23  ILE  47          3HG2      ILE  47   3.192   6.581   4.941
  383   HD11  ILE  47          3HD1      ILE  47   0.765   4.200   1.125
  384   HD12  ILE  47          1HD1      ILE  47   0.586   5.274   2.512
  385   HD13  ILE  47          2HD1      ILE  47   1.199   3.635   2.735
  386    H    THR  48           H        THR  48   5.753   8.270   3.105
  387    HA   THR  48           HA       THR  48   7.339   7.611   5.511
  388    HB   THR  48           HB       THR  48   8.129   9.340   3.113
  389    HG1  THR  48           HG1      THR  48   9.065   7.585   2.422
  390   HG21  THR  48          3HG2      THR  48   9.754   8.698   5.609
  391   HG22  THR  48          1HG2      THR  48   9.106  10.284   5.185
  392   HG23  THR  48          2HG2      THR  48  10.356   9.542   4.182
  393    H    GLY  49           H        GLY  49   7.383   9.148   7.130
  394    HA2  GLY  49           2HA      GLY  49   7.013  11.170   8.217
  395    HA3  GLY  49           3HA      GLY  49   6.333  11.842   6.746
  396    H    VAL  50           H        VAL  50   5.060   8.814   7.736
  397    HA   VAL  50           HA       VAL  50   2.699  10.051   9.007
  398    HB   VAL  50           HB       VAL  50   1.623   7.783   8.746
  399   HG11  VAL  50          1HG1      VAL  50   2.560   9.059   6.152
  400   HG12  VAL  50          2HG1      VAL  50   1.171   9.556   7.119
  401   HG13  VAL  50          3HG1      VAL  50   1.170   7.981   6.326
  402   HG21  VAL  50          3HG2      VAL  50   2.611   6.104   7.216
  403   HG22  VAL  50          1HG2      VAL  50   3.629   6.361   8.635
  404   HG23  VAL  50          2HG2      VAL  50   4.078   7.078   7.088
  405    HA   PRO  51           HA       PRO  51   4.202   8.937  13.172
  406    HB2  PRO  51           2HB      PRO  51   1.232   8.375  13.488
  407    HB3  PRO  51           3HB      PRO  51   2.341   9.226  14.593
  408    HG2  PRO  51           2HG      PRO  51   0.690  10.593  13.040
  409    HG3  PRO  51           3HG      PRO  51   2.353  11.166  13.309
  410    HD2  PRO  51           2HD      PRO  51   1.165   9.908  10.864
  411    HD3  PRO  51           3HD      PRO  51   2.489  11.082  10.998
  412    H    GLU  52           H        GLU  52   4.297   7.129  14.597
  413    HA   GLU  52           HA       GLU  52   4.652   4.634  13.387
  414    HB2  GLU  52           2HB      GLU  52   5.780   5.421  15.492
  415    HB3  GLU  52           3HB      GLU  52   4.267   5.203  16.361
  416    HG2  GLU  52           2HG      GLU  52   5.691   3.329  16.835
  417    HG3  GLU  52           3HG      GLU  52   4.373   2.760  15.815
  418    H    GLN  53           H        GLN  53   1.903   5.947  15.246
  419    HA   GLN  53           HA       GLN  53   0.331   3.568  15.364
  420    HB2  GLN  53           2HB      GLN  53  -1.579   5.052  15.890
  421    HB3  GLN  53           3HB      GLN  53  -0.157   5.474  16.835
  422    HG2  GLN  53           2HG      GLN  53   0.231   7.462  15.586
  423    HG3  GLN  53           3HG      GLN  53  -0.860   6.956  14.294
  424   HE21  GLN  53          1HE2      GLN  53  -3.103   7.170  14.581
  425   HE22  GLN  53          2HE2      GLN  53  -3.774   8.165  15.828
  426    H    VAL  54           H        VAL  54   0.671   6.107  12.969
  427    HA   VAL  54           HA       VAL  54  -1.673   5.441  11.462
  428    HB   VAL  54           HB       VAL  54   0.667   7.287  10.821
  429   HG11  VAL  54          1HG1      VAL  54  -0.796   8.265   9.077
  430   HG12  VAL  54          2HG1      VAL  54  -1.977   6.983   9.357
  431   HG13  VAL  54          3HG1      VAL  54  -0.377   6.588   8.730
  432   HG21  VAL  54          3HG2      VAL  54  -2.141   7.893  11.830
  433   HG22  VAL  54          1HG2      VAL  54  -0.930   9.100  11.387
  434   HG23  VAL  54          2HG2      VAL  54  -0.645   8.027  12.757
  435    H    ARG  55           H        ARG  55   1.778   4.661  11.230
  436    HA   ARG  55           HA       ARG  55   1.923   3.336   8.778
  437    HB2  ARG  55           2HB      ARG  55   3.252   2.633  11.423
  438    HB3  ARG  55           3HB      ARG  55   3.682   1.894   9.886
  439    HG2  ARG  55           2HG      ARG  55   4.456   4.046   9.031
  440    HG3  ARG  55           3HG      ARG  55   3.983   4.835  10.543
  441    HD2  ARG  55           2HD      ARG  55   5.570   3.452  11.794
  442    HD3  ARG  55           3HD      ARG  55   6.005   2.575  10.324
  443    HE   ARG  55           HE       ARG  55   6.606   5.118   9.664
  444   HH11  ARG  55          1HH1      ARG  55   7.423   3.144  12.479
  445   HH12  ARG  55          2HH1      ARG  55   8.949   3.930  12.720
  446   HH21  ARG  55          1HH2      ARG  55   8.617   6.084   9.964
  447   HH22  ARG  55          2HH2      ARG  55   9.628   5.604  11.288
  448    H    LYS  56           H        LYS  56   0.825   2.183  11.950
  449    HA   LYS  56           HA       LYS  56   0.346  -0.517  11.287
  450    HB2  LYS  56           2HB      LYS  56  -1.324   0.987  13.340
  451    HB3  LYS  56           3HB      LYS  56  -0.867  -0.709  13.348
  452    HG2  LYS  56           2HG      LYS  56   0.910   1.667  13.893
  453    HG3  LYS  56           3HG      LYS  56   0.375   0.461  15.059
  454    HD2  LYS  56           2HD      LYS  56   1.761  -1.251  13.983
  455    HD3  LYS  56           3HD      LYS  56   2.188  -0.132  12.681
  456    HE2  LYS  56           2HE      LYS  56   3.257   1.359  14.411
  457    HE3  LYS  56           3HE      LYS  56   2.969   0.096  15.608
  458    HZ1  LYS  56           3HZ      LYS  56   5.232   0.208  14.465
  459    HZ2  LYS  56           1HZ      LYS  56   4.462  -0.473  13.126
  460    HZ3  LYS  56           2HZ      LYS  56   4.494  -1.308  14.598
  461    H    GLU  57           H        GLU  57  -1.709   2.373  11.083
  462    HA   GLU  57           HA       GLU  57  -4.121   1.135  10.252
  463    HB2  GLU  57           2HB      GLU  57  -3.100   3.967   9.683
  464    HB3  GLU  57           3HB      GLU  57  -4.764   3.428   9.456
  465    HG2  GLU  57           2HG      GLU  57  -5.009   3.021  11.857
  466    HG3  GLU  57           3HG      GLU  57  -3.309   3.408  12.112
  467    H    LEU  58           H        LEU  58  -1.375   2.499   8.390
  468    HA   LEU  58           HA       LEU  58  -2.313   1.913   5.788
  469    HB2  LEU  58           2HB      LEU  58   0.443   2.441   6.920
  470    HB3  LEU  58           3HB      LEU  58   0.302   1.842   5.285
  471    HG   LEU  58           HG       LEU  58   0.512   4.128   4.957
  472   HD11  LEU  58          1HD1      LEU  58  -1.371   3.341   3.662
  473   HD12  LEU  58          2HD1      LEU  58  -1.610   5.018   4.135
  474   HD13  LEU  58          3HD1      LEU  58  -2.489   3.736   4.972
  475   HD21  LEU  58          3HD2      LEU  58  -1.374   4.720   7.243
  476   HD22  LEU  58          1HD2      LEU  58  -0.577   5.912   6.210
  477   HD23  LEU  58          2HD2      LEU  58   0.384   4.875   7.261
  478    H    ALA  59           H        ALA  59  -0.688  -0.109   8.176
  479    HA   ALA  59           HA       ALA  59  -0.135  -2.340   6.525
  480    HB1  ALA  59           3HB      ALA  59   0.873  -2.058   8.743
  481    HB2  ALA  59           1HB      ALA  59   0.034  -3.604   8.631
  482    HB3  ALA  59           2HB      ALA  59  -0.700  -2.262   9.511
  483    H    LYS  60           H        LYS  60  -2.993  -1.445   8.476
  484    HA   LYS  60           HA       LYS  60  -4.493  -3.808   7.871
  485    HB2  LYS  60           2HB      LYS  60  -5.221  -1.133   9.096
  486    HB3  LYS  60           3HB      LYS  60  -6.495  -2.255   8.634
  487    HG2  LYS  60           2HG      LYS  60  -6.056  -2.541  10.988
  488    HG3  LYS  60           3HG      LYS  60  -5.476  -3.979  10.148
  489    HD2  LYS  60           2HD      LYS  60  -3.152  -2.963  10.224
  490    HD3  LYS  60           3HD      LYS  60  -3.815  -1.687  11.245
  491    HE2  LYS  60           2HE      LYS  60  -2.747  -3.334  12.642
  492    HE3  LYS  60           3HE      LYS  60  -4.489  -3.435  12.901
  493    HZ1  LYS  60           3HZ      LYS  60  -3.338  -5.612  12.667
  494    HZ2  LYS  60           1HZ      LYS  60  -2.982  -5.216  11.061
  495    HZ3  LYS  60           2HZ      LYS  60  -4.591  -5.388  11.558
  496    H    GLU  61           H        GLU  61  -4.032  -0.718   6.241
  497    HA   GLU  61           HA       GLU  61  -6.134  -1.024   4.322
  498    HB2  GLU  61           2HB      GLU  61  -3.569   0.625   4.139
  499    HB3  GLU  61           3HB      GLU  61  -4.942   0.760   3.045
  500    HG2  GLU  61           2HG      GLU  61  -4.836   1.487   5.971
  501    HG3  GLU  61           3HG      GLU  61  -5.070   2.571   4.604
  502    H    ALA  62           H        ALA  62  -2.672  -1.740   4.367
  503    HA   ALA  62           HA       ALA  62  -2.269  -2.794   1.844
  504    HB1  ALA  62           3HB      ALA  62  -0.973  -3.715   4.438
  505    HB2  ALA  62           1HB      ALA  62  -0.503  -2.286   3.518
  506    HB3  ALA  62           2HB      ALA  62  -0.311  -3.885   2.813
  507    H    GLU  63           H        GLU  63  -3.274  -4.463   4.814
  508    HA   GLU  63           HA       GLU  63  -3.495  -7.088   3.792
  509    HB2  GLU  63           2HB      GLU  63  -4.801  -5.771   6.208
  510    HB3  GLU  63           3HB      GLU  63  -4.796  -7.506   5.911
  511    HG2  GLU  63           2HG      GLU  63  -2.366  -7.591   6.144
  512    HG3  GLU  63           3HG      GLU  63  -2.294  -5.834   6.292
  513    H    ARG  64           H        ARG  64  -5.942  -4.484   4.156
  514    HA   ARG  64           HA       ARG  64  -8.167  -6.190   3.546
  515    HB2  ARG  64           2HB      ARG  64  -9.567  -4.296   3.830
  516    HB3  ARG  64           3HB      ARG  64  -8.242  -4.047   4.956
  517    HG2  ARG  64           2HG      ARG  64  -7.200  -2.535   3.149
  518    HG3  ARG  64           3HG      ARG  64  -8.767  -2.617   2.346
  519    HD2  ARG  64           2HD      ARG  64  -8.244  -1.556   5.141
  520    HD3  ARG  64           3HD      ARG  64  -8.574  -0.589   3.705
  521    HE   ARG  64           HE       ARG  64 -10.725  -2.350   4.102
  522   HH11  ARG  64          1HH1      ARG  64  -9.279   0.474   5.654
  523   HH12  ARG  64          2HH1      ARG  64 -10.781   1.001   6.360
  524   HH21  ARG  64          1HH2      ARG  64 -12.686  -1.653   5.051
  525   HH22  ARG  64          2HH2      ARG  64 -12.710  -0.208   6.011
  526    H    LEU  65           H        LEU  65  -6.081  -4.088   1.648
  527    HA   LEU  65           HA       LEU  65  -7.633  -4.255  -0.800
  528    HB2  LEU  65           2HB      LEU  65  -4.785  -3.313  -0.277
  529    HB3  LEU  65           3HB      LEU  65  -5.604  -3.177  -1.827
  530    HG   LEU  65           HG       LEU  65  -6.542  -1.818   0.728
  531   HD11  LEU  65          1HD1      LEU  65  -4.407  -0.895   0.015
  532   HD12  LEU  65          2HD1      LEU  65  -5.702   0.266  -0.250
  533   HD13  LEU  65          3HD1      LEU  65  -5.031  -0.630  -1.615
  534   HD21  LEU  65          3HD2      LEU  65  -8.389  -2.250  -0.813
  535   HD22  LEU  65          1HD2      LEU  65  -7.505  -1.474  -2.131
  536   HD23  LEU  65          2HD2      LEU  65  -8.034  -0.528  -0.737
  537    H    ALA  66           H        ALA  66  -4.997  -5.983   0.715
  538    HA   ALA  66           HA       ALA  66  -4.131  -7.578  -1.426
  539    HB1  ALA  66           3HB      ALA  66  -3.233  -9.090   0.278
  540    HB2  ALA  66           1HB      ALA  66  -4.222  -8.311   1.519
  541    HB3  ALA  66           2HB      ALA  66  -2.929  -7.411   0.726
  542    H    LYS  67           H        LYS  67  -6.696  -8.172   0.992
  543    HA   LYS  67           HA       LYS  67  -7.506 -10.655  -0.280
  544    HB2  LYS  67           2HB      LYS  67  -9.133 -10.849   1.527
  545    HB3  LYS  67           3HB      LYS  67  -7.551 -10.443   2.172
  546    HG2  LYS  67           2HG      LYS  67  -8.308  -8.054   2.375
  547    HG3  LYS  67           3HG      LYS  67  -9.921  -8.568   1.882
  548    HD2  LYS  67           2HD      LYS  67  -8.428  -9.536   4.355
  549    HD3  LYS  67           3HD      LYS  67  -9.769  -8.393   4.343
  550    HE2  LYS  67           2HE      LYS  67 -11.318 -10.104   3.613
  551    HE3  LYS  67           3HE      LYS  67 -10.006 -11.251   3.331
  552    HZ1  LYS  67           3HZ      LYS  67 -10.787 -10.153   5.983
  553    HZ2  LYS  67           1HZ      LYS  67  -9.562 -11.285   5.705
  554    HZ3  LYS  67           2HZ      LYS  67 -11.175 -11.693   5.412
  555    H    GLU  68           H        GLU  68  -8.335  -7.330  -0.611
  556    HA   GLU  68           HA       GLU  68 -10.993  -7.646  -1.645
  557    HB2  GLU  68           2HB      GLU  68 -10.152  -5.490  -0.719
  558    HB3  GLU  68           3HB      GLU  68  -9.016  -5.354  -2.054
  559    HG2  GLU  68           2HG      GLU  68 -10.976  -3.911  -2.384
  560    HG3  GLU  68           3HG      GLU  68 -10.866  -5.139  -3.640
  561    H    PHE  69           H        PHE  69  -7.822  -7.047  -3.163
  562    HA   PHE  69           HA       PHE  69  -8.894  -7.593  -5.847
  563    HB2  PHE  69           2HB      PHE  69  -6.193  -6.482  -4.961
  564    HB3  PHE  69           3HB      PHE  69  -6.743  -6.623  -6.627
  565    HD1  PHE  69           HD1      PHE  69  -8.999  -5.405  -7.214
  566    HD2  PHE  69           HD2      PHE  69  -6.580  -4.451  -3.816
  567    HE1  PHE  69           HE1      PHE  69 -10.075  -3.200  -7.053
  568    HE2  PHE  69           HE2      PHE  69  -7.666  -2.246  -3.670
  569    HZ   PHE  69           HZ       PHE  69  -9.412  -1.627  -5.284
  570    H    ASN  70           H        ASN  70  -7.775  -9.518  -3.507
  571    HA   ASN  70           HA       ASN  70  -6.950 -11.621  -3.353
  572    HB2  ASN  70           2HB      ASN  70  -8.679 -11.990  -5.170
  573    HB3  ASN  70           3HB      ASN  70  -7.415 -11.779  -6.373
  574   HD21  ASN  70          1HD2      ASN  70  -7.395 -13.802  -7.251
  575   HD22  ASN  70          2HD2      ASN  70  -7.054 -15.249  -6.372
  576    H    ILE  71           H        ILE  71  -5.139  -9.427  -3.762
  577    HA   ILE  71           HA       ILE  71  -2.799 -10.632  -5.131
  578    HB   ILE  71           HB       ILE  71  -1.820  -8.319  -5.055
  579   HG12  ILE  71          2HG1      ILE  71  -4.572  -7.514  -3.982
  580   HG13  ILE  71          3HG1      ILE  71  -3.041  -7.367  -3.134
  581   HG21  ILE  71          1HG2      ILE  71  -3.196  -7.377  -6.870
  582   HG22  ILE  71          2HG2      ILE  71  -4.514  -8.477  -6.463
  583   HG23  ILE  71          3HG2      ILE  71  -2.989  -9.118  -7.079
  584   HD11  ILE  71          3HD1      ILE  71  -3.784  -5.219  -3.923
  585   HD12  ILE  71          1HD1      ILE  71  -3.876  -5.814  -5.581
  586   HD13  ILE  71          2HD1      ILE  71  -2.313  -5.684  -4.773
  587    H    THR  72           H        THR  72  -0.839 -10.857  -3.966
  588    HA   THR  72           HA       THR  72  -1.089 -11.177  -1.085
  589    HB   THR  72           HB       THR  72   1.354 -11.908  -1.234
  590    HG1  THR  72           HG1      THR  72   0.903 -11.370  -3.979
  591   HG21  THR  72          3HG2      THR  72   0.919 -14.050  -2.360
  592   HG22  THR  72          1HG2      THR  72  -0.537 -13.383  -3.103
  593   HG23  THR  72          2HG2      THR  72  -0.454 -13.592  -1.352
  594    H    VAL  73           H        VAL  73   0.352 -10.121   0.464
  595    HA   VAL  73           HA       VAL  73   1.710  -7.663  -0.442
  596    HB   VAL  73           HB       VAL  73  -0.597  -7.040   0.345
  597   HG11  VAL  73          1HG1      VAL  73  -1.178  -7.099   2.738
  598   HG12  VAL  73          2HG1      VAL  73   0.312  -7.977   3.090
  599   HG13  VAL  73          3HG1      VAL  73  -0.937  -8.726   2.095
  600   HG21  VAL  73          3HG2      VAL  73   1.272  -5.422   0.418
  601   HG22  VAL  73          1HG2      VAL  73   1.634  -5.909   2.076
  602   HG23  VAL  73          2HG2      VAL  73   0.098  -5.130   1.695
  603    H    THR  74           H        THR  74   3.434  -7.082   0.736
  604    HA   THR  74           HA       THR  74   4.101  -8.317   3.294
  605    HB   THR  74           HB       THR  74   5.361  -9.676   1.708
  606    HG1  THR  74           HG1      THR  74   7.567  -8.980   2.345
  607   HG21  THR  74          3HG2      THR  74   5.360  -8.191  -0.264
  608   HG22  THR  74          1HG2      THR  74   6.989  -8.761   0.103
  609   HG23  THR  74          2HG2      THR  74   6.512  -7.119   0.534
  610    H    TYR  75           H        TYR  75   4.772  -6.738   4.673
  611    HA   TYR  75           HA       TYR  75   5.593  -4.112   3.656
  612    HB2  TYR  75           2HB      TYR  75   3.966  -2.943   5.180
  613    HB3  TYR  75           3HB      TYR  75   3.196  -3.795   3.850
  614    HD1  TYR  75           HD1      TYR  75   3.869  -3.968   7.536
  615    HD2  TYR  75           HD2      TYR  75   1.538  -5.490   4.285
  616    HE1  TYR  75           HE1      TYR  75   2.368  -5.088   9.126
  617    HE2  TYR  75           HE2      TYR  75   0.046  -6.611   5.885
  618    HH   TYR  75           HH       TYR  75  -0.059  -5.882   9.114
  619    H    THR  76           H        THR  76   6.673  -2.812   5.221
  620    HA   THR  76           HA       THR  76   7.875  -4.377   7.431
  621    HB   THR  76           HB       THR  76   9.057  -2.022   5.875
  622    HG1  THR  76           HG1      THR  76   8.785  -3.929   4.588
  623   HG21  THR  76          3HG2      THR  76  10.048  -2.295   8.148
  624   HG22  THR  76          1HG2      THR  76  11.209  -2.701   6.883
  625   HG23  THR  76          2HG2      THR  76  10.405  -3.986   7.786
  626    H    ILE  77           H        ILE  77   7.164  -3.736   9.380
  627    HA   ILE  77           HA       ILE  77   7.417  -0.965  10.201
  628    HB   ILE  77           HB       ILE  77   5.247  -1.110  11.614
  629   HG12  ILE  77          2HG1      ILE  77   4.497  -3.228   9.544
  630   HG13  ILE  77          3HG1      ILE  77   4.761  -3.509  11.259
  631   HG21  ILE  77          1HG2      ILE  77   3.818  -0.149   9.886
  632   HG22  ILE  77          2HG2      ILE  77   4.902  -0.759   8.634
  633   HG23  ILE  77          3HG2      ILE  77   5.470   0.466   9.768
  634   HD11  ILE  77          3HD1      ILE  77   2.829  -2.100  11.783
  635   HD12  ILE  77          1HD1      ILE  77   2.408  -3.472  10.760
  636   HD13  ILE  77          2HD1      ILE  77   2.541  -1.860  10.057
  637    H    ARG  78           H        ARG  78   8.132  -0.808  12.250
  638    HA   ARG  78           HA       ARG  78   8.236  -3.215  13.980
  639    HB2  ARG  78           2HB      ARG  78  10.306  -0.979  13.728
  640    HB3  ARG  78           3HB      ARG  78  10.376  -2.317  14.868
  641    HG2  ARG  78           2HG      ARG  78  10.654  -3.918  13.043
  642    HG3  ARG  78           3HG      ARG  78  10.471  -2.630  11.850
  643    HD2  ARG  78           2HD      ARG  78  12.527  -1.543  12.762
  644    HD3  ARG  78           3HD      ARG  78  12.723  -2.904  13.872
  645    HE   ARG  78           HE       ARG  78  12.776  -4.285  11.688
  646   HH11  ARG  78          1HH1      ARG  78  14.141  -1.061  12.044
  647   HH12  ARG  78          2HH1      ARG  78  15.360  -1.315  10.835
  648   HH21  ARG  78          1HH2      ARG  78  14.391  -4.608  10.105
  649   HH22  ARG  78          2HH2      ARG  78  15.499  -3.325   9.735
  650    H    GLY  79           H        GLY  79   8.677  -2.409  16.338
  651    HA2  GLY  79           2HA      GLY  79   7.993   0.004  17.415
  652    HA3  GLY  79           3HA      GLY  79   6.434  -0.753  17.088
  653    H    SER  80           H        SER  80   7.376  -3.468  17.549
  654    HA   SER  80           HA       SER  80   7.193  -3.727  20.386
  655    HB2  SER  80           2HB      SER  80   7.994  -5.795  18.280
  656    HB3  SER  80           3HB      SER  80   7.523  -6.156  19.944
  657    HG   SER  80           HG       SER  80   5.952  -5.736  17.785
  658    H    LEU  81           H        LEU  81   9.773  -2.789  18.504
  659    HA   LEU  81           HA       LEU  81  12.089  -3.884  19.499
  660    HB2  LEU  81           2HB      LEU  81  11.602  -0.943  18.898
  661    HB3  LEU  81           3HB      LEU  81  13.174  -1.717  18.979
  662    HG   LEU  81           HG       LEU  81  11.034  -2.227  16.878
  663   HD11  LEU  81          1HD1      LEU  81  12.602  -1.196  15.306
  664   HD12  LEU  81          2HD1      LEU  81  13.741  -0.878  16.615
  665   HD13  LEU  81          3HD1      LEU  81  12.170  -0.073  16.594
  666   HD21  LEU  81          3HD2      LEU  81  12.229  -4.311  17.327
  667   HD22  LEU  81          1HD2      LEU  81  13.784  -3.500  17.116
  668   HD23  LEU  81          2HD2      LEU  81  12.680  -3.672  15.749
  669    H    GLU  82           H        GLU  82   9.996  -1.492  21.040
  670    HA   GLU  82           HA       GLU  82  11.552  -1.119  23.399
  671    HB2  GLU  82           2HB      GLU  82   9.408  -0.209  24.360
  672    HB3  GLU  82           3HB      GLU  82   9.847   0.508  22.817
  673    HG2  GLU  82           2HG      GLU  82   8.202  -1.060  21.716
  674    HG3  GLU  82           3HG      GLU  82   7.697  -1.554  23.327
  675    H    HIS  83           H        HIS  83  12.165  -2.851  24.559
  676    HA   HIS  83           HA       HIS  83  10.187  -4.751  25.592
  677    HB2  HIS  83           2HB      HIS  83  10.991  -5.714  23.409
  678    HB3  HIS  83           3HB      HIS  83  12.636  -5.702  24.031
  679    HD1  HIS  83           HD1      HIS  83  13.359  -7.893  24.945
  680    HD2  HIS  83           HD2      HIS  83   9.240  -7.409  25.217
  681    HE1  HIS  83           HE1      HIS  83  12.495 -10.001  26.011
  682    HE2  HIS  83           HE2      HIS  83  10.011  -9.687  26.149
  683    H    HIS  84           H        HIS  84  11.903  -2.595  26.646
  684    HA   HIS  84           HA       HIS  84  13.458  -4.115  28.657
  685    HB2  HIS  84           2HB      HIS  84  14.781  -2.332  27.638
  686    HB3  HIS  84           3HB      HIS  84  13.515  -1.149  27.940
  687    HD1  HIS  84           HD1      HIS  84  13.841   0.225  29.969
  688    HD2  HIS  84           HD2      HIS  84  15.884  -3.383  30.256
  689    HE1  HIS  84           HE1      HIS  84  15.077   0.328  32.141
  690    HE2  HIS  84           HE2      HIS  84  16.481  -1.756  32.172
  691    H    HIS  85           H        HIS  85  11.390  -4.877  29.475
  692    HA   HIS  85           HA       HIS  85   9.792  -3.084  31.106
  693    HB2  HIS  85           2HB      HIS  85   8.847  -5.186  30.117
  694    HB3  HIS  85           3HB      HIS  85   9.945  -6.143  31.102
  695    HD1  HIS  85           HD1      HIS  85   6.860  -4.003  31.339
  696    HD2  HIS  85           HD2      HIS  85   9.110  -6.507  33.777
  697    HE1  HIS  85           HE1      HIS  85   5.473  -4.374  33.391
  698    HE2  HIS  85           HE2      HIS  85   6.782  -6.002  34.777
  699    H    HIS  86           H        HIS  86   9.806  -3.108  33.435
  700    HA   HIS  86           HA       HIS  86  12.113  -4.249  34.828
  701    HB2  HIS  86           2HB      HIS  86  12.809  -2.053  35.759
  702    HB3  HIS  86           3HB      HIS  86  12.972  -2.087  34.007
  703    HD1  HIS  86           HD1      HIS  86  11.419  -0.522  32.636
  704    HD2  HIS  86           HD2      HIS  86  10.893  -0.230  36.750
  705    HE1  HIS  86           HE1      HIS  86  10.037   1.539  33.000
  706    HE2  HIS  86           HE2      HIS  86   9.610   1.611  35.470
  707    H    HIS  87           H        HIS  87  11.986  -3.679  37.220
  708    HA   HIS  87           HA       HIS  87   9.614  -2.814  38.480
  709    HB2  HIS  87           2HB      HIS  87   8.729  -4.930  39.389
  710    HB3  HIS  87           3HB      HIS  87   8.679  -4.970  37.631
  711    HD1  HIS  87           HD1      HIS  87  10.226  -6.639  40.578
  712    HD2  HIS  87           HD2      HIS  87  10.457  -6.831  36.438
  713    HE1  HIS  87           HE1      HIS  87  11.406  -8.788  40.068
  714    HE2  HIS  87           HE2      HIS  87  11.373  -8.967  37.560
  715    H    HIS  88           H        HIS  88   9.649  -3.711  40.903
  716    HA   HIS  88           HA       HIS  88  12.450  -3.772  41.859
  717    HB2  HIS  88           2HB      HIS  88  11.633  -2.584  43.927
  718    HB3  HIS  88           3HB      HIS  88  11.501  -1.619  42.465
  719    HD1  HIS  88           HD1      HIS  88   9.512  -3.040  45.235
  720    HD2  HIS  88           HD2      HIS  88   8.779  -1.184  41.596
  721    HE1  HIS  88           HE1      HIS  88   7.108  -2.325  45.315
  722    HE2  HIS  88           HE2      HIS  88   6.732  -1.074  43.162
  Start of MODEL    6
    1    H1   MET   1           1H       MET   1  10.613  10.428  13.353
    2    H2   MET   1           2H       MET   1   9.153   9.596  13.155
    3    H3   MET   1           3H       MET   1   9.509  10.925  12.174
    4    HA   MET   1           HA       MET   1  11.320   9.774  11.144
    5    HB2  MET   1           2HB      MET   1  10.450   7.406  12.865
    6    HB3  MET   1           3HB      MET   1  11.674   7.347  11.602
    7    HG2  MET   1           2HG      MET   1  12.736   7.399  13.771
    8    HG3  MET   1           3HG      MET   1  13.076   8.908  12.924
    9    HE1  MET   1           3HE      MET   1  13.458   8.388  16.131
   10    HE2  MET   1           1HE      MET   1  12.862   9.921  16.760
   11    HE3  MET   1           2HE      MET   1  13.898   9.899  15.333
   12    H    GLY   2           H        GLY   2   8.748   7.447  11.987
   13    HA2  GLY   2           2HA      GLY   2   6.770   6.866  11.047
   14    HA3  GLY   2           3HA      GLY   2   6.709   8.500  10.423
   15    H    GLU   3           H        GLU   3   9.007   5.927   9.575
   16    HA   GLU   3           HA       GLU   3   7.990   5.994   6.795
   17    HB2  GLU   3           2HB      GLU   3  10.175   5.196   6.035
   18    HB3  GLU   3           3HB      GLU   3  10.332   6.693   6.931
   19    HG2  GLU   3           2HG      GLU   3  10.935   3.960   8.079
   20    HG3  GLU   3           3HG      GLU   3  12.143   5.003   7.336
   21    H    MET   4           H        MET   4   7.083   4.279   5.982
   22    HA   MET   4           HA       MET   4   7.427   1.579   7.140
   23    HB2  MET   4           2HB      MET   4   5.227   2.499   7.839
   24    HB3  MET   4           3HB      MET   4   4.834   2.897   6.171
   25    HG2  MET   4           2HG      MET   4   4.781   0.528   5.595
   26    HG3  MET   4           3HG      MET   4   5.263   0.099   7.241
   27    HE1  MET   4           3HE      MET   4   2.772  -1.296   6.048
   28    HE2  MET   4           1HE      MET   4   1.592  -1.089   7.339
   29    HE3  MET   4           2HE      MET   4   3.262  -1.478   7.735
   30    H    ASP   5           H        ASP   5   7.585  -0.100   5.502
   31    HA   ASP   5           HA       ASP   5   7.640   0.845   2.708
   32    HB2  ASP   5           2HB      ASP   5   9.918   0.321   3.484
   33    HB3  ASP   5           3HB      ASP   5   9.386  -1.227   4.126
   34    H    ILE   6           H        ILE   6   5.959   0.006   1.701
   35    HA   ILE   6           HA       ILE   6   4.675  -2.538   2.526
   36    HB   ILE   6           HB       ILE   6   3.363  -0.093   1.203
   37   HG12  ILE   6          2HG1      ILE   6   3.082  -1.036   4.096
   38   HG13  ILE   6          3HG1      ILE   6   4.027   0.353   3.576
   39   HG21  ILE   6          1HG2      ILE   6   2.073  -2.626   2.293
   40   HG22  ILE   6          2HG2      ILE   6   2.271  -2.217   0.588
   41   HG23  ILE   6          3HG2      ILE   6   1.217  -1.239   1.609
   42   HD11  ILE   6          3HD1      ILE   6   1.980   1.430   2.773
   43   HD12  ILE   6          1HD1      ILE   6   1.930   1.055   4.495
   44   HD13  ILE   6          2HD1      ILE   6   1.040   0.049   3.351
   45    H    ARG   7           H        ARG   7   4.323  -3.994   0.825
   46    HA   ARG   7           HA       ARG   7   4.818  -3.125  -1.938
   47    HB2  ARG   7           2HB      ARG   7   7.005  -3.844  -0.889
   48    HB3  ARG   7           3HB      ARG   7   6.341  -5.463  -0.707
   49    HG2  ARG   7           2HG      ARG   7   6.272  -5.798  -3.085
   50    HG3  ARG   7           3HG      ARG   7   6.569  -4.091  -3.411
   51    HD2  ARG   7           2HD      ARG   7   8.577  -5.915  -2.035
   52    HD3  ARG   7           3HD      ARG   7   8.566  -5.595  -3.769
   53    HE   ARG   7           HE       ARG   7   9.306  -3.409  -3.394
   54   HH11  ARG   7          1HH1      ARG   7   8.936  -5.063  -0.291
   55   HH12  ARG   7          2HH1      ARG   7   9.843  -3.868   0.583
   56   HH21  ARG   7          1HH2      ARG   7  10.492  -1.860  -2.195
   57   HH22  ARG   7          2HH2      ARG   7  10.712  -2.076  -0.485
   58    H    PHE   8           H        PHE   8   3.492  -4.060  -3.307
   59    HA   PHE   8           HA       PHE   8   1.853  -6.395  -2.533
   60    HB2  PHE   8           2HB      PHE   8   1.298  -4.081  -4.457
   61    HB3  PHE   8           3HB      PHE   8   0.299  -5.527  -4.380
   62    HD1  PHE   8           HD2      PHE   8  -1.137  -5.968  -2.425
   63    HD2  PHE   8           HD1      PHE   8   1.157  -2.363  -2.697
   64    HE1  PHE   8           HE2      PHE   8  -2.498  -4.963  -0.646
   65    HE2  PHE   8           HE1      PHE   8  -0.212  -1.370  -0.906
   66    HZ   PHE   8           HZ       PHE   8  -2.037  -2.667   0.118
   67    H    ARG   9           H        ARG   9   1.530  -7.986  -4.149
   68    HA   ARG   9           HA       ARG   9   2.999  -7.902  -6.687
   69    HB2  ARG   9           2HB      ARG   9   3.395  -9.991  -4.493
   70    HB3  ARG   9           3HB      ARG   9   3.681 -10.398  -6.176
   71    HG2  ARG   9           2HG      ARG   9   5.412  -8.619  -6.302
   72    HG3  ARG   9           3HG      ARG   9   5.130  -8.244  -4.602
   73    HD2  ARG   9           2HD      ARG   9   5.887 -10.490  -3.956
   74    HD3  ARG   9           3HD      ARG   9   6.101 -10.924  -5.657
   75    HE   ARG   9           HE       ARG   9   7.643  -8.640  -5.158
   76   HH11  ARG   9          1HH1      ARG   9   7.618 -12.036  -4.181
   77   HH12  ARG   9          2HH1      ARG   9   9.334 -12.092  -3.939
   78   HH21  ARG   9          1HH2      ARG   9   9.902  -8.754  -4.841
   79   HH22  ARG   9          2HH2      ARG   9  10.619 -10.243  -4.311
   80    H    GLY  10           H        GLY  10   1.761  -8.891  -8.302
   81    HA2  GLY  10           2HA      GLY  10  -0.543 -10.548  -7.563
   82    HA3  GLY  10           3HA      GLY  10  -0.907  -8.966  -8.240
   83    H    ASP  11           H        ASP  11  -1.490 -11.660  -9.192
   84    HA   ASP  11           HA       ASP  11  -0.056 -12.232 -11.581
   85    HB2  ASP  11           2HB      ASP  11  -1.489 -13.891 -10.464
   86    HB3  ASP  11           3HB      ASP  11  -2.906 -12.886 -10.718
   87    H    ASP  12           H        ASP  12  -2.630 -10.066 -10.756
   88    HA   ASP  12           HA       ASP  12  -2.991  -9.111 -13.536
   89    HB2  ASP  12           2HB      ASP  12  -5.041  -9.997 -12.500
   90    HB3  ASP  12           3HB      ASP  12  -4.810  -8.986 -11.081
   91    H    LEU  13           H        LEU  13  -1.822  -7.293 -13.927
   92    HA   LEU  13           HA       LEU  13  -0.618  -5.619 -12.020
   93    HB2  LEU  13           2HB      LEU  13   0.144  -5.780 -14.370
   94    HB3  LEU  13           3HB      LEU  13  -1.313  -4.970 -14.907
   95    HG   LEU  13           HG       LEU  13  -0.575  -2.901 -13.661
   96   HD11  LEU  13          1HD1      LEU  13   2.012  -4.414 -13.212
   97   HD12  LEU  13          2HD1      LEU  13   0.864  -3.901 -11.972
   98   HD13  LEU  13          3HD1      LEU  13   1.748  -2.695 -12.902
   99   HD21  LEU  13          3HD2      LEU  13   1.130  -2.212 -15.279
  100   HD22  LEU  13          1HD2      LEU  13  -0.163  -3.115 -16.067
  101   HD23  LEU  13          2HD2      LEU  13   1.389  -3.894 -15.749
  102    H    GLU  14           H        GLU  14  -3.853  -5.514 -13.381
  103    HA   GLU  14           HA       GLU  14  -4.438  -2.761 -12.811
  104    HB2  GLU  14           2HB      GLU  14  -6.282  -5.130 -13.296
  105    HB3  GLU  14           3HB      GLU  14  -6.888  -3.513 -12.942
  106    HG2  GLU  14           2HG      GLU  14  -5.655  -2.670 -14.936
  107    HG3  GLU  14           3HG      GLU  14  -5.230  -4.338 -15.333
  108    H    ALA  15           H        ALA  15  -4.685  -5.761 -10.993
  109    HA   ALA  15           HA       ALA  15  -6.191  -4.858  -8.778
  110    HB1  ALA  15           3HB      ALA  15  -4.101  -7.066  -8.953
  111    HB2  ALA  15           1HB      ALA  15  -5.823  -7.240  -9.298
  112    HB3  ALA  15           2HB      ALA  15  -5.284  -6.874  -7.659
  113    H    LEU  16           H        LEU  16  -2.765  -4.731  -9.586
  114    HA   LEU  16           HA       LEU  16  -1.810  -3.716  -7.080
  115    HB2  LEU  16           2HB      LEU  16  -0.540  -3.526  -9.844
  116    HB3  LEU  16           3HB      LEU  16   0.286  -3.269  -8.313
  117    HG   LEU  16           HG       LEU  16  -0.893  -5.921  -9.234
  118   HD11  LEU  16          1HD1      LEU  16   1.026  -5.284 -10.599
  119   HD12  LEU  16          2HD1      LEU  16   1.425  -6.649  -9.560
  120   HD13  LEU  16          3HD1      LEU  16   2.005  -5.030  -9.151
  121   HD21  LEU  16          3HD2      LEU  16  -0.911  -5.739  -6.805
  122   HD22  LEU  16          1HD2      LEU  16   0.797  -5.287  -6.796
  123   HD23  LEU  16          2HD2      LEU  16   0.305  -6.898  -7.328
  124    H    GLU  17           H        GLU  17  -2.760  -2.280 -10.183
  125    HA   GLU  17           HA       GLU  17  -2.013   0.419  -9.660
  126    HB2  GLU  17           2HB      GLU  17  -4.001  -0.771 -11.641
  127    HB3  GLU  17           3HB      GLU  17  -3.512   0.923 -11.642
  128    HG2  GLU  17           2HG      GLU  17  -1.201   0.300 -12.129
  129    HG3  GLU  17           3HG      GLU  17  -1.612  -1.411 -12.025
  130    H    LYS  18           H        LYS  18  -4.951  -1.394  -9.132
  131    HA   LYS  18           HA       LYS  18  -6.624   0.831  -8.392
  132    HB2  LYS  18           2HB      LYS  18  -6.933  -2.197  -8.284
  133    HB3  LYS  18           3HB      LYS  18  -8.165  -1.124  -7.627
  134    HG2  LYS  18           2HG      LYS  18  -8.809  -0.326  -9.729
  135    HG3  LYS  18           3HG      LYS  18  -7.262  -0.719 -10.481
  136    HD2  LYS  18           2HD      LYS  18  -7.810  -3.091 -10.482
  137    HD3  LYS  18           3HD      LYS  18  -9.288  -2.800  -9.584
  138    HE2  LYS  18           2HE      LYS  18  -9.749  -3.188 -11.961
  139    HE3  LYS  18           3HE      LYS  18 -10.228  -1.562 -11.486
  140    HZ1  LYS  18           3HZ      LYS  18  -9.065  -1.696 -13.644
  141    HZ2  LYS  18           1HZ      LYS  18  -7.669  -2.209 -12.843
  142    HZ3  LYS  18           2HZ      LYS  18  -8.297  -0.673 -12.539
  143    H    ALA  19           H        ALA  19  -4.910  -1.803  -6.639
  144    HA   ALA  19           HA       ALA  19  -5.544  -1.026  -3.993
  145    HB1  ALA  19           3HB      ALA  19  -4.553  -3.219  -4.535
  146    HB2  ALA  19           1HB      ALA  19  -3.596  -2.380  -3.313
  147    HB3  ALA  19           2HB      ALA  19  -3.039  -2.435  -4.990
  148    H    LEU  20           H        LEU  20  -2.871  -0.114  -6.139
  149    HA   LEU  20           HA       LEU  20  -1.376   1.595  -4.546
  150    HB2  LEU  20           2HB      LEU  20  -0.636   0.908  -6.773
  151    HB3  LEU  20           3HB      LEU  20  -1.983   1.740  -7.524
  152    HG   LEU  20           HG       LEU  20  -1.026   3.924  -6.871
  153   HD11  LEU  20          1HD1      LEU  20   1.261   2.350  -5.668
  154   HD12  LEU  20          2HD1      LEU  20   0.096   3.361  -4.811
  155   HD13  LEU  20          3HD1      LEU  20   1.240   4.095  -5.929
  156   HD21  LEU  20          3HD2      LEU  20   0.903   3.931  -8.394
  157   HD22  LEU  20          1HD2      LEU  20  -0.444   3.005  -9.056
  158   HD23  LEU  20          2HD2      LEU  20   0.948   2.167  -8.365
  159    H    LYS  21           H        LYS  21  -4.040   2.398  -6.740
  160    HA   LYS  21           HA       LYS  21  -4.220   5.151  -6.378
  161    HB2  LYS  21           2HB      LYS  21  -5.302   3.891  -8.194
  162    HB3  LYS  21           3HB      LYS  21  -6.361   3.087  -7.045
  163    HG2  LYS  21           2HG      LYS  21  -7.466   5.250  -6.558
  164    HG3  LYS  21           3HG      LYS  21  -6.390   6.048  -7.706
  165    HD2  LYS  21           2HD      LYS  21  -8.601   5.597  -8.707
  166    HD3  LYS  21           3HD      LYS  21  -7.319   4.729  -9.555
  167    HE2  LYS  21           2HE      LYS  21  -9.323   3.329  -9.251
  168    HE3  LYS  21           3HE      LYS  21  -7.942   2.650  -8.391
  169    HZ1  LYS  21           3HZ      LYS  21  -8.821   3.579  -6.334
  170    HZ2  LYS  21           1HZ      LYS  21  -9.968   2.577  -7.068
  171    HZ3  LYS  21           2HZ      LYS  21 -10.124   4.256  -7.169
  172    H    GLU  22           H        GLU  22  -5.628   2.511  -4.505
  173    HA   GLU  22           HA       GLU  22  -7.179   4.125  -2.720
  174    HB2  GLU  22           2HB      GLU  22  -6.159   1.272  -2.407
  175    HB3  GLU  22           3HB      GLU  22  -7.351   2.035  -1.366
  176    HG2  GLU  22           2HG      GLU  22  -7.671   1.335  -4.293
  177    HG3  GLU  22           3HG      GLU  22  -8.454   0.554  -2.927
  178    H    MET  23           H        MET  23  -3.947   2.548  -2.472
  179    HA   MET  23           HA       MET  23  -3.383   3.350   0.196
  180    HB2  MET  23           2HB      MET  23  -1.495   2.497  -2.038
  181    HB3  MET  23           3HB      MET  23  -0.979   2.762  -0.375
  182    HG2  MET  23           2HG      MET  23  -2.951   0.673  -1.316
  183    HG3  MET  23           3HG      MET  23  -1.282   0.390  -0.828
  184    HE1  MET  23           3HE      MET  23  -1.440   1.041   3.035
  185    HE2  MET  23           1HE      MET  23  -1.006   2.237   1.814
  186    HE3  MET  23           2HE      MET  23  -0.419   0.578   1.673
  187    H    ILE  24           H        ILE  24  -2.973   5.010  -2.860
  188    HA   ILE  24           HA       ILE  24  -1.255   7.111  -1.939
  189    HB   ILE  24           HB       ILE  24  -3.186   7.012  -4.322
  190   HG12  ILE  24          2HG1      ILE  24  -0.134   6.824  -4.218
  191   HG13  ILE  24          3HG1      ILE  24  -1.229   5.477  -4.488
  192   HG21  ILE  24          1HG2      ILE  24  -2.916   9.361  -3.636
  193   HG22  ILE  24          2HG2      ILE  24  -2.100   9.069  -5.171
  194   HG23  ILE  24          3HG2      ILE  24  -1.159   9.191  -3.684
  195   HD11  ILE  24          3HD1      ILE  24  -0.819   7.826  -6.339
  196   HD12  ILE  24          1HD1      ILE  24  -1.950   6.495  -6.601
  197   HD13  ILE  24          2HD1      ILE  24  -0.216   6.183  -6.559
  198    H    ARG  25           H        ARG  25  -4.788   6.798  -2.451
  199    HA   ARG  25           HA       ARG  25  -5.711   9.195  -1.414
  200    HB2  ARG  25           2HB      ARG  25  -7.256   7.670  -2.508
  201    HB3  ARG  25           3HB      ARG  25  -6.956   6.412  -1.316
  202    HG2  ARG  25           2HG      ARG  25  -8.068   7.777   0.416
  203    HG3  ARG  25           3HG      ARG  25  -8.357   9.051  -0.768
  204    HD2  ARG  25           2HD      ARG  25  -9.819   7.532  -2.052
  205    HD3  ARG  25           3HD      ARG  25  -9.507   6.236  -0.887
  206    HE   ARG  25           HE       ARG  25 -10.452   8.221   0.691
  207   HH11  ARG  25          1HH1      ARG  25 -11.776   6.820  -2.265
  208   HH12  ARG  25          2HH1      ARG  25 -13.419   7.139  -1.809
  209   HH21  ARG  25          1HH2      ARG  25 -12.631   8.610   1.257
  210   HH22  ARG  25          2HH2      ARG  25 -13.900   8.142   0.167
  211    H    GLN  26           H        GLN  26  -4.817   6.217   0.318
  212    HA   GLN  26           HA       GLN  26  -5.656   7.033   2.908
  213    HB2  GLN  26           2HB      GLN  26  -3.537   4.948   2.230
  214    HB3  GLN  26           3HB      GLN  26  -4.386   5.113   3.765
  215    HG2  GLN  26           2HG      GLN  26  -5.500   4.202   1.113
  216    HG3  GLN  26           3HG      GLN  26  -5.392   3.290   2.609
  217   HE21  GLN  26          1HE2      GLN  26  -7.684   3.992   0.825
  218   HE22  GLN  26          2HE2      GLN  26  -8.868   4.694   1.863
  219    H    ALA  27           H        ALA  27  -2.426   6.925   1.381
  220    HA   ALA  27           HA       ALA  27  -0.956   7.980   3.527
  221    HB1  ALA  27           3HB      ALA  27   0.077   6.801   1.639
  222    HB2  ALA  27           1HB      ALA  27   0.826   8.379   1.884
  223    HB3  ALA  27           2HB      ALA  27  -0.326   8.141   0.564
  224    H    ARG  28           H        ARG  28  -2.863   9.602   1.044
  225    HA   ARG  28           HA       ARG  28  -1.760  12.221   1.501
  226    HB2  ARG  28           2HB      ARG  28  -4.293  11.410   0.022
  227    HB3  ARG  28           3HB      ARG  28  -3.643  13.046   0.075
  228    HG2  ARG  28           2HG      ARG  28  -1.505  12.096  -0.992
  229    HG3  ARG  28           3HG      ARG  28  -2.416  10.614  -1.255
  230    HD2  ARG  28           2HD      ARG  28  -2.459  11.972  -3.278
  231    HD3  ARG  28           3HD      ARG  28  -4.085  11.884  -2.590
  232    HE   ARG  28           HE       ARG  28  -2.456  14.191  -1.844
  233   HH11  ARG  28          1HH1      ARG  28  -5.031  13.002  -3.954
  234   HH12  ARG  28          2HH1      ARG  28  -5.603  14.596  -4.329
  235   HH21  ARG  28          1HH2      ARG  28  -3.220  16.251  -2.350
  236   HH22  ARG  28          2HH2      ARG  28  -4.577  16.438  -3.420
  237    H    LYS  29           H        LYS  29  -4.817  10.598   2.484
  238    HA   LYS  29           HA       LYS  29  -5.780  12.816   4.030
  239    HB2  LYS  29           2HB      LYS  29  -7.508  11.313   4.881
  240    HB3  LYS  29           3HB      LYS  29  -7.312  11.049   3.154
  241    HG2  LYS  29           2HG      LYS  29  -6.017   9.009   3.593
  242    HG3  LYS  29           3HG      LYS  29  -6.157   9.270   5.328
  243    HD2  LYS  29           2HD      LYS  29  -8.574   8.874   3.524
  244    HD3  LYS  29           3HD      LYS  29  -7.721   7.535   4.286
  245    HE2  LYS  29           2HE      LYS  29  -9.645   8.053   5.626
  246    HE3  LYS  29           3HE      LYS  29  -8.217   8.565   6.523
  247    HZ1  LYS  29           3HZ      LYS  29  -9.951  10.385   4.929
  248    HZ2  LYS  29           1HZ      LYS  29  -8.665  10.836   5.930
  249    HZ3  LYS  29           2HZ      LYS  29 -10.062  10.168   6.601
  250    H    PHE  30           H        PHE  30  -3.558  10.236   4.655
  251    HA   PHE  30           HA       PHE  30  -3.425  10.662   7.539
  252    HB2  PHE  30           2HB      PHE  30  -1.860   8.848   5.655
  253    HB3  PHE  30           3HB      PHE  30  -1.568   8.925   7.387
  254    HD1  PHE  30           HD1      PHE  30  -4.646   9.145   8.116
  255    HD2  PHE  30           HD2      PHE  30  -2.382   6.479   5.652
  256    HE1  PHE  30           HE1      PHE  30  -6.290   7.357   8.510
  257    HE2  PHE  30           HE2      PHE  30  -4.040   4.703   6.048
  258    HZ   PHE  30           HZ       PHE  30  -5.993   5.141   7.479
  259    H    ALA  31           H        ALA  31  -2.275  12.340   4.925
  260    HA   ALA  31           HA       ALA  31  -0.954  14.155   4.717
  261    HB1  ALA  31           3HB      ALA  31  -0.730  14.061   7.745
  262    HB2  ALA  31           1HB      ALA  31  -2.030  14.833   6.833
  263    HB3  ALA  31           2HB      ALA  31  -0.382  15.451   6.713
  264    H    GLY  32           H        GLY  32   0.296  11.708   4.289
  265    HA2  GLY  32           2HA      GLY  32   3.136  12.276   4.957
  266    HA3  GLY  32           3HA      GLY  32   2.477  10.648   4.839
  267    H    THR  33           H        THR  33   4.539  10.890   3.313
  268    HA   THR  33           HA       THR  33   3.820  11.762   0.586
  269    HB   THR  33           HB       THR  33   6.515  10.969   1.827
  270    HG1  THR  33           HG1      THR  33   5.138  13.332   1.679
  271   HG21  THR  33          3HG2      THR  33   5.980  12.113  -0.948
  272   HG22  THR  33          1HG2      THR  33   6.493  10.455  -0.607
  273   HG23  THR  33          2HG2      THR  33   7.565  11.806  -0.240
  274    H    VAL  34           H        VAL  34   3.889  10.174  -1.130
  275    HA   VAL  34           HA       VAL  34   4.155   7.348  -0.341
  276    HB   VAL  34           HB       VAL  34   1.775   7.701  -0.219
  277   HG11  VAL  34          1HG1      VAL  34   1.577   9.810  -1.456
  278   HG12  VAL  34          2HG1      VAL  34   0.372   8.637  -1.992
  279   HG13  VAL  34          3HG1      VAL  34   1.803   8.948  -2.982
  280   HG21  VAL  34          3HG2      VAL  34   0.891   6.164  -1.929
  281   HG22  VAL  34          1HG2      VAL  34   2.436   5.590  -1.294
  282   HG23  VAL  34          2HG2      VAL  34   2.363   6.359  -2.881
  283    H    THR  35           H        THR  35   5.952   6.896  -1.465
  284    HA   THR  35           HA       THR  35   6.222   7.662  -4.308
  285    HB   THR  35           HB       THR  35   8.302   6.321  -2.501
  286    HG1  THR  35           HG1      THR  35   8.389   8.204  -1.530
  287   HG21  THR  35          3HG2      THR  35   9.924   7.186  -4.113
  288   HG22  THR  35          1HG2      THR  35   8.637   7.937  -5.056
  289   HG23  THR  35          2HG2      THR  35   8.738   6.177  -4.942
  290    H    TYR  36           H        TYR  36   6.007   6.054  -5.894
  291    HA   TYR  36           HA       TYR  36   5.775   3.252  -4.946
  292    HB2  TYR  36           2HB      TYR  36   3.879   2.821  -6.337
  293    HB3  TYR  36           3HB      TYR  36   3.522   4.285  -5.433
  294    HD1  TYR  36           HD2      TYR  36   3.496   6.509  -6.613
  295    HD2  TYR  36           HD1      TYR  36   4.012   2.846  -8.779
  296    HE1  TYR  36           HE2      TYR  36   2.953   7.663  -8.713
  297    HE2  TYR  36           HE1      TYR  36   3.464   4.014 -10.872
  298    HH   TYR  36           HH       TYR  36   2.277   6.009 -11.611
  299    H    THR  37           H        THR  37   6.168   1.595  -6.510
  300    HA   THR  37           HA       THR  37   7.318   2.395  -9.109
  301    HB   THR  37           HB       THR  37   8.627   0.164  -7.479
  302    HG1  THR  37           HG1      THR  37   9.159   1.841  -6.226
  303   HG21  THR  37          3HG2      THR  37   9.660   1.852  -9.800
  304   HG22  THR  37          1HG2      THR  37   9.080   0.186  -9.923
  305   HG23  THR  37          2HG2      THR  37  10.534   0.549  -8.994
  306    H    LEU  38           H        LEU  38   5.634   1.604 -10.349
  307    HA   LEU  38           HA       LEU  38   4.722  -1.161 -10.123
  308    HB2  LEU  38           2HB      LEU  38   4.216   1.042 -12.171
  309    HB3  LEU  38           3HB      LEU  38   3.591  -0.585 -12.370
  310    HG   LEU  38           HG       LEU  38   2.871   1.277 -10.072
  311   HD11  LEU  38          1HD1      LEU  38   1.953   2.118 -12.179
  312   HD12  LEU  38          2HD1      LEU  38   0.671   1.502 -11.143
  313   HD13  LEU  38          3HD1      LEU  38   1.226   0.545 -12.519
  314   HD21  LEU  38          3HD2      LEU  38   1.733  -1.436 -10.814
  315   HD22  LEU  38          1HD2      LEU  38   1.119  -0.366  -9.548
  316   HD23  LEU  38          2HD2      LEU  38   2.732  -1.058  -9.406
  317    H    ASP  39           H        ASP  39   6.101  -2.758 -10.774
  318    HA   ASP  39           HA       ASP  39   7.611  -2.474 -13.294
  319    HB2  ASP  39           2HB      ASP  39   9.182  -1.877 -11.440
  320    HB3  ASP  39           3HB      ASP  39   8.874  -3.430 -10.677
  321    H    GLY  40           H        GLY  40   6.702  -4.018 -14.460
  322    HA2  GLY  40           2HA      GLY  40   5.913  -6.012 -15.205
  323    HA3  GLY  40           3HA      GLY  40   6.906  -6.772 -13.973
  324    H    ASN  41           H        ASN  41   5.972  -7.376 -12.024
  325    HA   ASN  41           HA       ASN  41   3.026  -7.253 -11.771
  326    HB2  ASN  41           2HB      ASN  41   4.826  -9.706 -11.583
  327    HB3  ASN  41           3HB      ASN  41   3.194  -9.680 -10.921
  328   HD21  ASN  41          1HD2      ASN  41   1.419  -9.502 -12.353
  329   HD22  ASN  41          2HD2      ASN  41   1.559  -9.939 -14.017
  330    H    ASP  42           H        ASP  42   5.596  -6.031 -10.361
  331    HA   ASP  42           HA       ASP  42   4.427  -6.416  -7.659
  332    HB2  ASP  42           2HB      ASP  42   6.529  -6.085  -6.570
  333    HB3  ASP  42           3HB      ASP  42   6.806  -7.292  -7.812
  334    H    LEU  43           H        LEU  43   4.236  -4.652  -6.380
  335    HA   LEU  43           HA       LEU  43   4.669  -1.951  -7.480
  336    HB2  LEU  43           2HB      LEU  43   2.299  -2.372  -7.574
  337    HB3  LEU  43           3HB      LEU  43   2.302  -3.156  -6.002
  338    HG   LEU  43           HG       LEU  43   2.758  -0.945  -4.924
  339   HD11  LEU  43          1HD1      LEU  43   3.851   0.192  -6.810
  340   HD12  LEU  43          2HD1      LEU  43   2.530   1.132  -6.135
  341   HD13  LEU  43          3HD1      LEU  43   2.304   0.272  -7.657
  342   HD21  LEU  43          3HD2      LEU  43   0.495  -1.839  -5.061
  343   HD22  LEU  43          1HD2      LEU  43   0.258  -1.062  -6.630
  344   HD23  LEU  43          2HD2      LEU  43   0.480  -0.082  -5.177
  345    H    GLU  44           H        GLU  44   6.299  -1.108  -6.263
  346    HA   GLU  44           HA       GLU  44   6.542  -1.642  -3.389
  347    HB2  GLU  44           2HB      GLU  44   8.606  -1.527  -4.725
  348    HB3  GLU  44           3HB      GLU  44   8.170   0.070  -5.329
  349    HG2  GLU  44           2HG      GLU  44   8.360   0.965  -2.998
  350    HG3  GLU  44           3HG      GLU  44   8.873  -0.634  -2.457
  351    H    ILE  45           H        ILE  45   5.903  -0.183  -1.859
  352    HA   ILE  45           HA       ILE  45   5.073   2.570  -2.576
  353    HB   ILE  45           HB       ILE  45   3.427   0.693  -0.783
  354   HG12  ILE  45          2HG1      ILE  45   2.694   1.910  -3.492
  355   HG13  ILE  45          3HG1      ILE  45   3.096   0.223  -3.202
  356   HG21  ILE  45          1HG2      ILE  45   2.897   3.604  -1.504
  357   HG22  ILE  45          2HG2      ILE  45   3.405   3.000   0.075
  358   HG23  ILE  45          3HG2      ILE  45   1.823   2.561  -0.566
  359   HD11  ILE  45          3HD1      ILE  45   0.717   0.525  -3.428
  360   HD12  ILE  45          1HD1      ILE  45   0.698   1.672  -2.091
  361   HD13  ILE  45          2HD1      ILE  45   1.117  -0.019  -1.802
  362    H    ARG  46           H        ARG  46   6.438   3.824  -1.408
  363    HA   ARG  46           HA       ARG  46   7.308   3.025   1.302
  364    HB2  ARG  46           2HB      ARG  46   8.707   4.822  -0.740
  365    HB3  ARG  46           3HB      ARG  46   9.304   4.476   0.881
  366    HG2  ARG  46           2HG      ARG  46   9.530   2.084   0.281
  367    HG3  ARG  46           3HG      ARG  46   8.939   2.445  -1.343
  368    HD2  ARG  46           2HD      ARG  46  11.470   3.588  -0.110
  369    HD3  ARG  46           3HD      ARG  46  11.411   2.245  -1.250
  370    HE   ARG  46           HE       ARG  46  10.355   3.919  -2.839
  371   HH11  ARG  46          1HH1      ARG  46  12.674   4.948  -0.371
  372   HH12  ARG  46          2HH1      ARG  46  13.204   6.319  -1.294
  373   HH21  ARG  46          1HH2      ARG  46  11.126   5.697  -4.035
  374   HH22  ARG  46          2HH2      ARG  46  12.337   6.740  -3.352
  375    H    ILE  47           H        ILE  47   6.047   4.069   2.709
  376    HA   ILE  47           HA       ILE  47   5.117   6.826   2.152
  377    HB   ILE  47           HB       ILE  47   3.846   4.754   4.009
  378   HG12  ILE  47          2HG1      ILE  47   2.889   5.820   1.306
  379   HG13  ILE  47          3HG1      ILE  47   3.587   4.231   1.576
  380   HG21  ILE  47          1HG2      ILE  47   1.983   6.368   4.251
  381   HG22  ILE  47          2HG2      ILE  47   2.863   7.540   3.267
  382   HG23  ILE  47          3HG2      ILE  47   3.499   7.056   4.839
  383   HD11  ILE  47          3HD1      ILE  47   1.196   4.101   1.356
  384   HD12  ILE  47          1HD1      ILE  47   0.972   5.225   2.697
  385   HD13  ILE  47          2HD1      ILE  47   1.684   3.635   2.983
  386    H    THR  48           H        THR  48   6.026   8.399   3.321
  387    HA   THR  48           HA       THR  48   7.186   7.832   5.981
  388    HB   THR  48           HB       THR  48   8.561   9.514   3.825
  389    HG1  THR  48           HG1      THR  48   8.695   6.796   4.432
  390   HG21  THR  48          3HG2      THR  48   9.570   8.551   6.536
  391   HG22  THR  48          1HG2      THR  48   9.125  10.215   6.140
  392   HG23  THR  48          2HG2      THR  48  10.510   9.459   5.353
  393    H    GLY  49           H        GLY  49   6.929   9.472   7.469
  394    HA2  GLY  49           2HA      GLY  49   6.569  11.743   8.140
  395    HA3  GLY  49           3HA      GLY  49   5.700  12.048   6.644
  396    H    VAL  50           H        VAL  50   4.789   9.066   7.885
  397    HA   VAL  50           HA       VAL  50   2.363  10.158   9.176
  398    HB   VAL  50           HB       VAL  50   1.372   7.862   8.761
  399   HG11  VAL  50          1HG1      VAL  50   2.293   9.345   6.272
  400   HG12  VAL  50          2HG1      VAL  50   0.866   9.713   7.241
  401   HG13  VAL  50          3HG1      VAL  50   0.950   8.196   6.344
  402   HG21  VAL  50          3HG2      VAL  50   3.871   7.377   7.090
  403   HG22  VAL  50          1HG2      VAL  50   2.442   6.336   7.124
  404   HG23  VAL  50          2HG2      VAL  50   3.431   6.529   8.572
  405    HA   PRO  51           HA       PRO  51   4.333   8.885  13.060
  406    HB2  PRO  51           2HB      PRO  51   2.036   8.971  14.687
  407    HB3  PRO  51           3HB      PRO  51   3.067  10.358  14.293
  408    HG2  PRO  51           2HG      PRO  51   0.459   9.552  13.105
  409    HG3  PRO  51           3HG      PRO  51   1.101  11.176  13.424
  410    HD2  PRO  51           2HD      PRO  51   1.042  10.094  10.922
  411    HD3  PRO  51           3HD      PRO  51   2.301  11.236  11.435
  412    H    GLU  52           H        GLU  52   3.996   7.273  14.860
  413    HA   GLU  52           HA       GLU  52   4.201   4.708  13.886
  414    HB2  GLU  52           2HB      GLU  52   5.141   5.455  16.054
  415    HB3  GLU  52           3HB      GLU  52   3.520   5.601  16.719
  416    HG2  GLU  52           2HG      GLU  52   4.509   3.581  17.574
  417    HG3  GLU  52           3HG      GLU  52   3.229   3.127  16.449
  418    H    GLN  53           H        GLN  53   1.464   6.055  15.709
  419    HA   GLN  53           HA       GLN  53  -0.304   3.922  15.716
  420    HB2  GLN  53           2HB      GLN  53  -2.102   5.658  16.012
  421    HB3  GLN  53           3HB      GLN  53  -0.714   5.920  17.061
  422    HG2  GLN  53           2HG      GLN  53   0.085   7.734  15.699
  423    HG3  GLN  53           3HG      GLN  53  -1.082   7.376  14.431
  424   HE21  GLN  53          1HE2      GLN  53  -3.261   7.967  14.741
  425   HE22  GLN  53          2HE2      GLN  53  -3.723   9.141  15.918
  426    H    VAL  54           H        VAL  54   0.322   6.281  13.179
  427    HA   VAL  54           HA       VAL  54  -1.936   5.531  11.545
  428    HB   VAL  54           HB       VAL  54   0.386   7.430  10.991
  429   HG11  VAL  54          1HG1      VAL  54  -0.984   8.308   9.132
  430   HG12  VAL  54          2HG1      VAL  54  -2.175   7.032   9.403
  431   HG13  VAL  54          3HG1      VAL  54  -0.543   6.620   8.875
  432   HG21  VAL  54          3HG2      VAL  54  -2.493   7.999  11.812
  433   HG22  VAL  54          1HG2      VAL  54  -1.276   9.218  11.419
  434   HG23  VAL  54          2HG2      VAL  54  -1.064   8.186  12.832
  435    H    ARG  55           H        ARG  55   1.529   4.765  11.628
  436    HA   ARG  55           HA       ARG  55   1.740   3.482   9.094
  437    HB2  ARG  55           2HB      ARG  55   3.294   2.899  11.650
  438    HB3  ARG  55           3HB      ARG  55   3.728   2.326  10.040
  439    HG2  ARG  55           2HG      ARG  55   3.888   4.775   9.358
  440    HG3  ARG  55           3HG      ARG  55   3.763   5.163  11.076
  441    HD2  ARG  55           2HD      ARG  55   5.923   3.529   9.714
  442    HD3  ARG  55           3HD      ARG  55   6.093   5.128  10.440
  443    HE   ARG  55           HE       ARG  55   5.242   3.510  12.499
  444   HH11  ARG  55          1HH1      ARG  55   7.999   3.480  10.299
  445   HH12  ARG  55          2HH1      ARG  55   9.037   2.689  11.433
  446   HH21  ARG  55          1HH2      ARG  55   6.649   2.418  13.960
  447   HH22  ARG  55          2HH2      ARG  55   8.287   2.097  13.480
  448    H    LYS  56           H        LYS  56   0.751   2.376  12.299
  449    HA   LYS  56           HA       LYS  56   0.220  -0.326  11.758
  450    HB2  LYS  56           2HB      LYS  56  -1.348   1.536  13.602
  451    HB3  LYS  56           3HB      LYS  56  -1.342  -0.224  13.681
  452    HG2  LYS  56           2HG      LYS  56   1.079   1.546  14.144
  453    HG3  LYS  56           3HG      LYS  56   0.086   0.844  15.421
  454    HD2  LYS  56           2HD      LYS  56   0.795  -1.383  14.887
  455    HD3  LYS  56           3HD      LYS  56   1.503  -0.878  13.351
  456    HE2  LYS  56           2HE      LYS  56   3.206  -1.347  15.117
  457    HE3  LYS  56           3HE      LYS  56   3.292   0.301  14.502
  458    HZ1  LYS  56           3HZ      LYS  56   2.054  -0.550  17.072
  459    HZ2  LYS  56           1HZ      LYS  56   2.064   1.033  16.481
  460    HZ3  LYS  56           2HZ      LYS  56   3.517   0.277  16.890
  461    H    GLU  57           H        GLU  57  -1.792   2.587  11.245
  462    HA   GLU  57           HA       GLU  57  -4.138   1.313  10.296
  463    HB2  GLU  57           2HB      GLU  57  -3.142   4.120   9.614
  464    HB3  GLU  57           3HB      GLU  57  -4.785   3.525   9.387
  465    HG2  GLU  57           2HG      GLU  57  -4.993   3.221  11.849
  466    HG3  GLU  57           3HG      GLU  57  -3.370   3.882  12.041
  467    H    LEU  58           H        LEU  58  -1.221   2.474   8.587
  468    HA   LEU  58           HA       LEU  58  -2.089   1.878   5.944
  469    HB2  LEU  58           2HB      LEU  58   0.648   2.346   7.147
  470    HB3  LEU  58           3HB      LEU  58   0.527   1.717   5.520
  471    HG   LEU  58           HG       LEU  58   0.833   4.000   5.174
  472   HD11  LEU  58          1HD1      LEU  58  -1.224   4.923   4.230
  473   HD12  LEU  58          2HD1      LEU  58  -2.179   3.690   5.058
  474   HD13  LEU  58          3HD1      LEU  58  -1.020   3.224   3.811
  475   HD21  LEU  58          3HD2      LEU  58  -1.156   4.684   7.348
  476   HD22  LEU  58          1HD2      LEU  58  -0.257   5.832   6.350
  477   HD23  LEU  58          2HD2      LEU  58   0.603   4.779   7.471
  478    H    ALA  59           H        ALA  59  -0.653  -0.136   8.463
  479    HA   ALA  59           HA       ALA  59  -0.167  -2.449   6.905
  480    HB1  ALA  59           3HB      ALA  59   0.738  -2.156   9.179
  481    HB2  ALA  59           1HB      ALA  59  -0.161  -3.666   9.037
  482    HB3  ALA  59           2HB      ALA  59  -0.887  -2.280   9.853
  483    H    LYS  60           H        LYS  60  -3.059  -1.337   8.715
  484    HA   LYS  60           HA       LYS  60  -4.750  -3.557   8.227
  485    HB2  LYS  60           2HB      LYS  60  -5.282  -0.647   8.892
  486    HB3  LYS  60           3HB      LYS  60  -6.630  -1.678   8.452
  487    HG2  LYS  60           2HG      LYS  60  -6.478  -1.465  10.863
  488    HG3  LYS  60           3HG      LYS  60  -6.160  -3.136  10.394
  489    HD2  LYS  60           2HD      LYS  60  -3.828  -2.911  10.833
  490    HD3  LYS  60           3HD      LYS  60  -3.933  -1.154  10.914
  491    HE2  LYS  60           2HE      LYS  60  -3.645  -2.173  13.142
  492    HE3  LYS  60           3HE      LYS  60  -5.165  -1.290  13.022
  493    HZ1  LYS  60           3HZ      LYS  60  -4.862  -4.236  12.770
  494    HZ2  LYS  60           1HZ      LYS  60  -6.325  -3.387  12.734
  495    HZ3  LYS  60           2HZ      LYS  60  -5.400  -3.425  14.149
  496    H    GLU  61           H        GLU  61  -4.034  -0.621   6.361
  497    HA   GLU  61           HA       GLU  61  -5.997  -0.955   4.341
  498    HB2  GLU  61           2HB      GLU  61  -3.425   0.679   4.396
  499    HB3  GLU  61           3HB      GLU  61  -4.617   0.771   3.102
  500    HG2  GLU  61           2HG      GLU  61  -4.999   1.537   6.003
  501    HG3  GLU  61           3HG      GLU  61  -4.982   2.615   4.605
  502    H    ALA  62           H        ALA  62  -2.536  -1.711   4.485
  503    HA   ALA  62           HA       ALA  62  -2.125  -2.750   1.948
  504    HB1  ALA  62           3HB      ALA  62  -0.363  -2.222   3.614
  505    HB2  ALA  62           1HB      ALA  62  -0.155  -3.833   2.932
  506    HB3  ALA  62           2HB      ALA  62  -0.828  -3.643   4.552
  507    H    GLU  63           H        GLU  63  -3.167  -4.446   4.901
  508    HA   GLU  63           HA       GLU  63  -3.379  -7.058   3.828
  509    HB2  GLU  63           2HB      GLU  63  -4.694  -5.796   6.260
  510    HB3  GLU  63           3HB      GLU  63  -4.705  -7.525   5.915
  511    HG2  GLU  63           2HG      GLU  63  -2.294  -7.650   6.158
  512    HG3  GLU  63           3HG      GLU  63  -2.181  -5.896   6.294
  513    H    ARG  64           H        ARG  64  -5.856  -4.476   4.246
  514    HA   ARG  64           HA       ARG  64  -8.058  -6.184   3.585
  515    HB2  ARG  64           2HB      ARG  64  -9.461  -4.172   3.539
  516    HB3  ARG  64           3HB      ARG  64  -8.446  -4.189   4.972
  517    HG2  ARG  64           2HG      ARG  64  -7.019  -2.488   4.091
  518    HG3  ARG  64           3HG      ARG  64  -7.746  -2.601   2.492
  519    HD2  ARG  64           2HD      ARG  64  -9.324  -1.737   4.933
  520    HD3  ARG  64           3HD      ARG  64  -8.420  -0.599   3.933
  521    HE   ARG  64           HE       ARG  64 -10.601  -2.309   2.880
  522   HH11  ARG  64          1HH1      ARG  64  -8.982   0.825   3.040
  523   HH12  ARG  64          2HH1      ARG  64 -10.065   1.571   1.898
  524   HH21  ARG  64          1HH2      ARG  64 -12.000  -1.310   1.395
  525   HH22  ARG  64          2HH2      ARG  64 -11.770   0.361   0.972
  526    H    LEU  65           H        LEU  65  -5.926  -4.107   1.725
  527    HA   LEU  65           HA       LEU  65  -7.479  -4.282  -0.726
  528    HB2  LEU  65           2HB      LEU  65  -4.680  -3.223  -0.190
  529    HB3  LEU  65           3HB      LEU  65  -5.524  -3.073  -1.725
  530    HG   LEU  65           HG       LEU  65  -6.396  -1.822   0.911
  531   HD11  LEU  65          1HD1      LEU  65  -4.429  -0.737  -0.017
  532   HD12  LEU  65          2HD1      LEU  65  -5.833   0.320  -0.103
  533   HD13  LEU  65          3HD1      LEU  65  -5.256  -0.497  -1.558
  534   HD21  LEU  65          3HD2      LEU  65  -7.694  -1.574  -1.821
  535   HD22  LEU  65          1HD2      LEU  65  -8.128  -0.641  -0.384
  536   HD23  LEU  65          2HD2      LEU  65  -8.364  -2.387  -0.403
  537    H    ALA  66           H        ALA  66  -4.787  -5.976   0.758
  538    HA   ALA  66           HA       ALA  66  -4.009  -7.589  -1.436
  539    HB1  ALA  66           3HB      ALA  66  -2.695  -7.397   0.639
  540    HB2  ALA  66           1HB      ALA  66  -3.029  -9.083   0.241
  541    HB3  ALA  66           2HB      ALA  66  -3.943  -8.278   1.520
  542    H    LYS  67           H        LYS  67  -6.513  -8.069   1.069
  543    HA   LYS  67           HA       LYS  67  -7.366 -10.609  -0.068
  544    HB2  LYS  67           2HB      LYS  67  -8.936 -10.717   1.795
  545    HB3  LYS  67           3HB      LYS  67  -7.340 -10.269   2.384
  546    HG2  LYS  67           2HG      LYS  67  -8.129  -7.865   2.418
  547    HG3  LYS  67           3HG      LYS  67  -9.750  -8.458   2.059
  548    HD2  LYS  67           2HD      LYS  67  -8.095  -9.182   4.511
  549    HD3  LYS  67           3HD      LYS  67  -9.433  -8.036   4.479
  550    HE2  LYS  67           2HE      LYS  67 -11.023  -9.794   4.012
  551    HE3  LYS  67           3HE      LYS  67  -9.731 -10.975   3.773
  552    HZ1  LYS  67           3HZ      LYS  67 -10.708 -11.242   5.952
  553    HZ2  LYS  67           1HZ      LYS  67 -10.410  -9.618   6.333
  554    HZ3  LYS  67           2HZ      LYS  67  -9.120 -10.684   6.120
  555    H    GLU  68           H        GLU  68  -8.190  -7.283  -0.530
  556    HA   GLU  68           HA       GLU  68 -10.859  -7.696  -1.550
  557    HB2  GLU  68           2HB      GLU  68 -10.217  -5.487  -0.668
  558    HB3  GLU  68           3HB      GLU  68  -8.929  -5.345  -1.857
  559    HG2  GLU  68           2HG      GLU  68 -10.888  -3.950  -2.418
  560    HG3  GLU  68           3HG      GLU  68 -10.554  -5.152  -3.665
  561    H    PHE  69           H        PHE  69  -7.696  -6.983  -3.044
  562    HA   PHE  69           HA       PHE  69  -8.736  -7.536  -5.729
  563    HB2  PHE  69           2HB      PHE  69  -6.043  -6.411  -4.821
  564    HB3  PHE  69           3HB      PHE  69  -6.594  -6.523  -6.490
  565    HD1  PHE  69           HD1      PHE  69  -8.807  -5.258  -7.094
  566    HD2  PHE  69           HD2      PHE  69  -6.510  -4.432  -3.585
  567    HE1  PHE  69           HE1      PHE  69  -9.902  -3.067  -6.884
  568    HE2  PHE  69           HE2      PHE  69  -7.610  -2.237  -3.390
  569    HZ   PHE  69           HZ       PHE  69  -9.309  -1.557  -5.034
  570    H    ASN  70           H        ASN  70  -7.682  -9.494  -3.419
  571    HA   ASN  70           HA       ASN  70  -6.539 -11.418  -3.157
  572    HB2  ASN  70           2HB      ASN  70  -8.487 -12.177  -4.499
  573    HB3  ASN  70           3HB      ASN  70  -7.562 -11.950  -5.979
  574   HD21  ASN  70          1HD2      ASN  70  -7.792 -14.139  -6.544
  575   HD22  ASN  70          2HD2      ASN  70  -6.927 -15.408  -5.750
  576    H    ILE  71           H        ILE  71  -4.673  -9.913  -3.247
  577    HA   ILE  71           HA       ILE  71  -2.576 -10.983  -5.019
  578    HB   ILE  71           HB       ILE  71  -1.515  -8.681  -5.067
  579   HG12  ILE  71          2HG1      ILE  71  -4.212  -7.771  -3.942
  580   HG13  ILE  71          3HG1      ILE  71  -2.644  -7.620  -3.159
  581   HG21  ILE  71          1HG2      ILE  71  -4.236  -8.822  -6.405
  582   HG22  ILE  71          2HG2      ILE  71  -2.747  -9.545  -7.016
  583   HG23  ILE  71          3HG2      ILE  71  -2.885  -7.792  -6.893
  584   HD11  ILE  71          3HD1      ILE  71  -3.359  -5.487  -4.020
  585   HD12  ILE  71          1HD1      ILE  71  -3.543  -6.156  -5.643
  586   HD13  ILE  71          2HD1      ILE  71  -1.942  -6.038  -4.910
  587    H    THR  72           H        THR  72  -0.419 -10.822  -4.035
  588    HA   THR  72           HA       THR  72  -0.458 -11.354  -1.180
  589    HB   THR  72           HB       THR  72   2.083 -11.756  -1.638
  590    HG1  THR  72           HG1      THR  72   1.153 -11.534  -4.318
  591   HG21  THR  72          3HG2      THR  72   0.081 -13.494  -3.129
  592   HG22  THR  72          1HG2      THR  72   0.470 -13.625  -1.411
  593   HG23  THR  72          2HG2      THR  72   1.700 -13.977  -2.624
  594    H    VAL  73           H        VAL  73   0.447 -10.075   0.394
  595    HA   VAL  73           HA       VAL  73   1.799  -7.565  -0.390
  596    HB   VAL  73           HB       VAL  73  -0.578  -7.146   0.386
  597   HG11  VAL  73          1HG1      VAL  73  -0.790  -8.878   2.103
  598   HG12  VAL  73          2HG1      VAL  73  -1.151  -7.284   2.766
  599   HG13  VAL  73          3HG1      VAL  73   0.402  -8.052   3.113
  600   HG21  VAL  73          3HG2      VAL  73   1.598  -5.889   2.099
  601   HG22  VAL  73          1HG2      VAL  73  -0.018  -5.232   1.823
  602   HG23  VAL  73          2HG2      VAL  73   1.114  -5.373   0.480
  603    H    THR  74           H        THR  74   3.528  -7.009   0.804
  604    HA   THR  74           HA       THR  74   4.169  -8.296   3.344
  605    HB   THR  74           HB       THR  74   5.454  -9.635   1.795
  606    HG1  THR  74           HG1      THR  74   7.698  -8.554   2.362
  607   HG21  THR  74          3HG2      THR  74   7.061  -8.727   0.163
  608   HG22  THR  74          1HG2      THR  74   6.583  -7.081   0.584
  609   HG23  THR  74          2HG2      THR  74   5.427  -8.162  -0.195
  610    H    TYR  75           H        TYR  75   4.807  -6.798   4.766
  611    HA   TYR  75           HA       TYR  75   5.621  -4.108   3.965
  612    HB2  TYR  75           2HB      TYR  75   3.750  -3.072   5.331
  613    HB3  TYR  75           3HB      TYR  75   3.181  -3.893   3.880
  614    HD1  TYR  75           HD2      TYR  75   1.923  -6.044   4.058
  615    HD2  TYR  75           HD1      TYR  75   3.162  -3.932   7.568
  616    HE1  TYR  75           HE2      TYR  75   0.439  -7.444   5.432
  617    HE2  TYR  75           HE1      TYR  75   1.679  -5.334   8.919
  618    HH   TYR  75           HH       TYR  75  -0.417  -6.716   8.555
  619    H    THR  76           H        THR  76   6.602  -2.949   5.703
  620    HA   THR  76           HA       THR  76   7.229  -4.569   8.109
  621    HB   THR  76           HB       THR  76   9.244  -2.836   6.599
  622    HG1  THR  76           HG1      THR  76   9.846  -5.461   6.565
  623   HG21  THR  76          3HG2      THR  76  10.913  -4.017   8.011
  624   HG22  THR  76          1HG2      THR  76   9.607  -4.834   8.872
  625   HG23  THR  76          2HG2      THR  76   9.786  -3.081   8.994
  626    H    ILE  77           H        ILE  77   6.996  -3.577   9.969
  627    HA   ILE  77           HA       ILE  77   7.346  -0.700  10.330
  628    HB   ILE  77           HB       ILE  77   5.284  -0.817  12.017
  629   HG12  ILE  77          2HG1      ILE  77   4.476  -2.981  10.011
  630   HG13  ILE  77          3HG1      ILE  77   4.772  -3.214  11.728
  631   HG21  ILE  77          1HG2      ILE  77   3.773   0.110  10.336
  632   HG22  ILE  77          2HG2      ILE  77   4.811  -0.500   9.048
  633   HG23  ILE  77          3HG2      ILE  77   5.410   0.743  10.148
  634   HD11  ILE  77          3HD1      ILE  77   2.828  -1.805  12.245
  635   HD12  ILE  77          1HD1      ILE  77   2.410  -3.211  11.269
  636   HD13  ILE  77          2HD1      ILE  77   2.512  -1.619  10.517
  637    H    ARG  78           H        ARG  78   9.011  -0.731  11.707
  638    HA   ARG  78           HA       ARG  78   8.869  -2.448  14.134
  639    HB2  ARG  78           2HB      ARG  78  11.378  -1.148  12.973
  640    HB3  ARG  78           3HB      ARG  78  11.297  -2.259  14.332
  641    HG2  ARG  78           2HG      ARG  78  10.587  -3.056  11.489
  642    HG3  ARG  78           3HG      ARG  78  12.215  -3.196  12.146
  643    HD2  ARG  78           2HD      ARG  78  11.204  -5.351  12.305
  644    HD3  ARG  78           3HD      ARG  78  11.260  -4.700  13.945
  645    HE   ARG  78           HE       ARG  78   8.786  -4.179  12.588
  646   HH11  ARG  78          1HH1      ARG  78  10.452  -6.689  14.425
  647   HH12  ARG  78          2HH1      ARG  78   8.972  -7.431  14.953
  648   HH21  ARG  78          1HH2      ARG  78   6.893  -5.097  13.365
  649   HH22  ARG  78          2HH2      ARG  78   6.960  -6.523  14.350
  650    H    GLY  79           H        GLY  79   8.651  -1.360  16.019
  651    HA2  GLY  79           2HA      GLY  79   9.827   1.007  16.811
  652    HA3  GLY  79           3HA      GLY  79   8.271   1.464  16.123
  653    H    SER  80           H        SER  80   9.915  -0.076  18.725
  654    HA   SER  80           HA       SER  80   9.398  -0.534  20.871
  655    HB2  SER  80           2HB      SER  80   6.667   0.701  20.319
  656    HB3  SER  80           3HB      SER  80   7.361   0.385  21.910
  657    HG   SER  80           HG       SER  80   9.064   1.844  20.408
  658    H    LEU  81           H        LEU  81   8.136  -2.118  18.321
  659    HA   LEU  81           HA       LEU  81   6.106  -3.764  19.567
  660    HB2  LEU  81           2HB      LEU  81   7.567  -4.074  16.906
  661    HB3  LEU  81           3HB      LEU  81   6.176  -5.027  17.404
  662    HG   LEU  81           HG       LEU  81   6.167  -2.026  16.876
  663   HD11  LEU  81          1HD1      LEU  81   4.808  -2.553  14.903
  664   HD12  LEU  81          2HD1      LEU  81   4.971  -4.280  15.231
  665   HD13  LEU  81          3HD1      LEU  81   6.392  -3.322  14.812
  666   HD21  LEU  81          3HD2      LEU  81   4.549  -2.581  18.617
  667   HD22  LEU  81          1HD2      LEU  81   3.851  -3.850  17.606
  668   HD23  LEU  81          2HD2      LEU  81   3.719  -2.156  17.123
  669    H    GLU  82           H        GLU  82   9.508  -3.782  19.400
  670    HA   GLU  82           HA       GLU  82   9.749  -6.660  20.047
  671    HB2  GLU  82           2HB      GLU  82  11.895  -4.812  18.920
  672    HB3  GLU  82           3HB      GLU  82  11.955  -6.567  19.058
  673    HG2  GLU  82           2HG      GLU  82  10.236  -6.800  17.341
  674    HG3  GLU  82           3HG      GLU  82  10.046  -5.050  17.261
  675    H    HIS  83           H        HIS  83  10.194  -3.446  21.170
  676    HA   HIS  83           HA       HIS  83  11.004  -2.429  23.002
  677    HB2  HIS  83           2HB      HIS  83  11.066  -5.199  24.264
  678    HB3  HIS  83           3HB      HIS  83  11.101  -3.666  25.131
  679    HD1  HIS  83           HD1      HIS  83   8.849  -6.260  24.400
  680    HD2  HIS  83           HD2      HIS  83   8.541  -2.118  24.357
  681    HE1  HIS  83           HE1      HIS  83   6.390  -5.764  24.520
  682    HE2  HIS  83           HE2      HIS  83   6.255  -3.263  24.705
  683    H    HIS  84           H        HIS  84  12.900  -3.563  20.983
  684    HA   HIS  84           HA       HIS  84  15.196  -4.695  22.135
  685    HB2  HIS  84           2HB      HIS  84  14.665  -3.337  19.484
  686    HB3  HIS  84           3HB      HIS  84  16.321  -3.739  19.916
  687    HD1  HIS  84           HD1      HIS  84  14.220  -5.030  17.674
  688    HD2  HIS  84           HD2      HIS  84  15.867  -6.777  21.063
  689    HE1  HIS  84           HE1      HIS  84  14.255  -7.499  17.222
  690    HE2  HIS  84           HE2      HIS  84  15.139  -8.524  19.325
  691    H    HIS  85           H        HIS  85  14.250  -1.343  21.990
  692    HA   HIS  85           HA       HIS  85  16.735  -0.067  22.411
  693    HB2  HIS  85           2HB      HIS  85  14.768   1.224  21.748
  694    HB3  HIS  85           3HB      HIS  85  13.902   0.749  23.206
  695    HD1  HIS  85           HD1      HIS  85  13.786   2.615  24.817
  696    HD2  HIS  85           HD2      HIS  85  17.322   2.755  22.629
  697    HE1  HIS  85           HE1      HIS  85  15.016   4.632  25.655
  698    HE2  HIS  85           HE2      HIS  85  17.204   4.619  24.417
  699    H    HIS  86           H        HIS  86  18.003  -1.082  23.923
  700    HA   HIS  86           HA       HIS  86  17.195  -0.945  26.770
  701    HB2  HIS  86           2HB      HIS  86  18.663  -3.250  25.416
  702    HB3  HIS  86           3HB      HIS  86  18.527  -3.066  27.159
  703    HD1  HIS  86           HD1      HIS  86  17.186  -5.086  24.710
  704    HD2  HIS  86           HD2      HIS  86  15.441  -2.825  27.726
  705    HE1  HIS  86           HE1      HIS  86  14.954  -6.153  25.146
  706    HE2  HIS  86           HE2      HIS  86  13.951  -4.809  27.016
  707    H    HIS  87           H        HIS  87  18.878  -0.503  28.228
  708    HA   HIS  87           HA       HIS  87  21.656  -0.444  27.251
  709    HB2  HIS  87           2HB      HIS  87  22.150   1.666  28.465
  710    HB3  HIS  87           3HB      HIS  87  20.987   1.920  27.174
  711    HD1  HIS  87           HD1      HIS  87  21.476   2.374  30.786
  712    HD2  HIS  87           HD2      HIS  87  18.279   2.391  28.122
  713    HE1  HIS  87           HE1      HIS  87  19.600   3.527  31.993
  714    HE2  HIS  87           HE2      HIS  87  17.703   3.582  30.341
  715    H    HIS  88           H        HIS  88  19.889  -2.201  28.782
  716    HA   HIS  88           HA       HIS  88  21.776  -3.020  30.785
  717    HB2  HIS  88           2HB      HIS  88  20.376  -1.418  32.100
  718    HB3  HIS  88           3HB      HIS  88  18.925  -2.296  31.640
  719    HD1  HIS  88           HD1      HIS  88  18.512  -4.590  32.801
  720    HD2  HIS  88           HD2      HIS  88  21.894  -2.591  34.155
  721    HE1  HIS  88           HE1      HIS  88  19.206  -5.785  34.895
  722    HE2  HIS  88           HE2      HIS  88  21.127  -4.443  35.796
  Start of MODEL    7
    1    H1   MET   1           1H       MET   1  12.194   6.045  15.500
    2    H2   MET   1           2H       MET   1  11.698   7.580  16.009
    3    H3   MET   1           3H       MET   1  12.932   7.423  14.866
    4    HA   MET   1           HA       MET   1  10.134   6.578  14.457
    5    HB2  MET   1           2HB      MET   1   9.919   8.507  12.927
    6    HB3  MET   1           3HB      MET   1  10.321   9.045  14.548
    7    HG2  MET   1           2HG      MET   1  12.587   9.539  13.914
    8    HG3  MET   1           3HG      MET   1  12.386   8.751  12.352
    9    HE1  MET   1           3HE      MET   1  10.324  12.753  13.449
   10    HE2  MET   1           1HE      MET   1  11.359  11.868  14.566
   11    HE3  MET   1           2HE      MET   1   9.783  11.214  14.116
   12    H    GLY   2           H        GLY   2   9.818   6.622  11.904
   13    HA2  GLY   2           2HA      GLY   2  11.900   6.056  10.127
   14    HA3  GLY   2           3HA      GLY   2  11.335   4.517  10.778
   15    H    GLU   3           H        GLU   3  11.139   5.283   8.052
   16    HA   GLU   3           HA       GLU   3   8.354   5.860   7.464
   17    HB2  GLU   3           2HB      GLU   3   8.946   5.452   5.127
   18    HB3  GLU   3           3HB      GLU   3  10.156   6.494   5.874
   19    HG2  GLU   3           2HG      GLU   3  11.705   4.611   6.087
   20    HG3  GLU   3           3HG      GLU   3  10.489   3.505   5.448
   21    H    MET   4           H        MET   4   7.143   4.272   6.024
   22    HA   MET   4           HA       MET   4   7.553   1.443   6.833
   23    HB2  MET   4           2HB      MET   4   5.437   2.402   7.705
   24    HB3  MET   4           3HB      MET   4   4.971   2.900   6.076
   25    HG2  MET   4           2HG      MET   4   4.864   0.546   5.392
   26    HG3  MET   4           3HG      MET   4   5.362   0.055   7.019
   27    HE1  MET   4           3HE      MET   4   2.844  -1.278   5.970
   28    HE2  MET   4           1HE      MET   4   1.709  -1.006   7.289
   29    HE3  MET   4           2HE      MET   4   3.385  -1.409   7.647
   30    H    ASP   5           H        ASP   5   7.499  -0.149   5.142
   31    HA   ASP   5           HA       ASP   5   7.231   0.823   2.366
   32    HB2  ASP   5           2HB      ASP   5   9.532   0.032   2.782
   33    HB3  ASP   5           3HB      ASP   5   8.931  -1.466   3.481
   34    H    ILE   6           H        ILE   6   5.567  -0.094   1.305
   35    HA   ILE   6           HA       ILE   6   4.201  -2.496   2.363
   36    HB   ILE   6           HB       ILE   6   2.826  -0.035   1.156
   37   HG12  ILE   6          2HG1      ILE   6   2.870  -0.863   4.096
   38   HG13  ILE   6          3HG1      ILE   6   3.854   0.427   3.420
   39   HG21  ILE   6          1HG2      ILE   6   1.613  -2.139   0.773
   40   HG22  ILE   6          2HG2      ILE   6   0.734  -1.121   1.917
   41   HG23  ILE   6          3HG2      ILE   6   1.665  -2.505   2.499
   42   HD11  ILE   6          3HD1      ILE   6   1.800   1.616   2.783
   43   HD12  ILE   6          1HD1      ILE   6   1.967   1.355   4.518
   44   HD13  ILE   6          2HD1      ILE   6   0.857   0.354   3.584
   45    H    ARG   7           H        ARG   7   4.420  -3.993   0.827
   46    HA   ARG   7           HA       ARG   7   4.802  -3.146  -1.978
   47    HB2  ARG   7           2HB      ARG   7   6.897  -3.837  -0.519
   48    HB3  ARG   7           3HB      ARG   7   6.329  -5.488  -0.770
   49    HG2  ARG   7           2HG      ARG   7   6.524  -5.252  -3.176
   50    HG3  ARG   7           3HG      ARG   7   6.878  -3.533  -3.019
   51    HD2  ARG   7           2HD      ARG   7   8.974  -4.198  -1.725
   52    HD3  ARG   7           3HD      ARG   7   8.648  -5.865  -2.236
   53    HE   ARG   7           HE       ARG   7   8.583  -4.801  -4.582
   54   HH11  ARG   7          1HH1      ARG   7  10.795  -3.819  -2.038
   55   HH12  ARG   7          2HH1      ARG   7  12.019  -3.280  -3.138
   56   HH21  ARG   7          1HH2      ARG   7  10.133  -4.035  -6.014
   57   HH22  ARG   7          2HH2      ARG   7  11.641  -3.400  -5.416
   58    H    PHE   8           H        PHE   8   3.525  -4.078  -3.366
   59    HA   PHE   8           HA       PHE   8   1.796  -6.353  -2.592
   60    HB2  PHE   8           2HB      PHE   8   1.372  -4.020  -4.522
   61    HB3  PHE   8           3HB      PHE   8   0.326  -5.433  -4.513
   62    HD1  PHE   8           HD1      PHE   8   1.321  -2.407  -2.608
   63    HD2  PHE   8           HD2      PHE   8  -1.317  -5.773  -2.756
   64    HE1  PHE   8           HE1      PHE   8  -0.104  -1.380  -0.887
   65    HE2  PHE   8           HE2      PHE   8  -2.734  -4.741  -1.038
   66    HZ   PHE   8           HZ       PHE   8  -2.131  -2.540  -0.097
   67    H    ARG   9           H        ARG   9   1.545  -8.032  -4.060
   68    HA   ARG   9           HA       ARG   9   2.950  -8.058  -6.627
   69    HB2  ARG   9           2HB      ARG   9   3.429  -9.986  -4.327
   70    HB3  ARG   9           3HB      ARG   9   3.518 -10.602  -5.973
   71    HG2  ARG   9           2HG      ARG   9   5.287  -8.961  -6.499
   72    HG3  ARG   9           3HG      ARG   9   5.192  -8.331  -4.854
   73    HD2  ARG   9           2HD      ARG   9   5.943 -10.477  -3.953
   74    HD3  ARG   9           3HD      ARG   9   5.935 -11.185  -5.572
   75    HE   ARG   9           HE       ARG   9   7.664  -8.869  -5.027
   76   HH11  ARG   9          1HH1      ARG   9   7.373 -12.291  -5.797
   77   HH12  ARG   9          2HH1      ARG   9   9.051 -12.471  -6.202
   78   HH21  ARG   9          1HH2      ARG   9   9.883  -9.130  -5.537
   79   HH22  ARG   9          2HH2      ARG   9  10.463 -10.682  -6.053
   80    H    GLY  10           H        GLY  10   1.862  -9.194  -8.163
   81    HA2  GLY  10           2HA      GLY  10  -0.236 -11.056  -7.679
   82    HA3  GLY  10           3HA      GLY  10  -0.901  -9.451  -7.986
   83    H    ASP  11           H        ASP  11  -0.858 -12.074  -9.517
   84    HA   ASP  11           HA       ASP  11   0.608 -11.794 -11.925
   85    HB2  ASP  11           2HB      ASP  11  -0.395 -13.918 -11.194
   86    HB3  ASP  11           3HB      ASP  11  -2.012 -13.241 -11.350
   87    H    ASP  12           H        ASP  12  -2.236 -10.236 -10.794
   88    HA   ASP  12           HA       ASP  12  -2.867  -9.057 -13.431
   89    HB2  ASP  12           2HB      ASP  12  -4.764 -10.188 -12.276
   90    HB3  ASP  12           3HB      ASP  12  -4.540  -9.148 -10.874
   91    H    LEU  13           H        LEU  13  -1.651  -7.276 -13.688
   92    HA   LEU  13           HA       LEU  13  -0.638  -5.614 -11.616
   93    HB2  LEU  13           2HB      LEU  13   0.501  -5.891 -13.777
   94    HB3  LEU  13           3HB      LEU  13  -0.852  -5.144 -14.608
   95    HG   LEU  13           HG       LEU  13  -0.341  -2.971 -13.517
   96   HD11  LEU  13          1HD1      LEU  13   1.725  -2.630 -12.246
   97   HD12  LEU  13          2HD1      LEU  13   2.054  -4.364 -12.280
   98   HD13  LEU  13          3HD1      LEU  13   0.642  -3.746 -11.416
   99   HD21  LEU  13          3HD2      LEU  13   2.038  -4.203 -14.935
  100   HD22  LEU  13          1HD2      LEU  13   1.725  -2.474 -14.742
  101   HD23  LEU  13          2HD2      LEU  13   0.628  -3.464 -15.702
  102    H    GLU  14           H        GLU  14  -3.661  -5.623 -13.368
  103    HA   GLU  14           HA       GLU  14  -4.547  -2.961 -12.917
  104    HB2  GLU  14           2HB      GLU  14  -6.007  -5.564 -13.417
  105    HB3  GLU  14           3HB      GLU  14  -6.942  -4.197 -12.818
  106    HG2  GLU  14           2HG      GLU  14  -6.168  -2.856 -14.751
  107    HG3  GLU  14           3HG      GLU  14  -5.340  -4.278 -15.389
  108    H    ALA  15           H        ALA  15  -4.751  -5.904 -10.983
  109    HA   ALA  15           HA       ALA  15  -6.288  -4.929  -8.828
  110    HB1  ALA  15           3HB      ALA  15  -5.998  -7.314  -9.286
  111    HB2  ALA  15           1HB      ALA  15  -5.420  -6.949  -7.659
  112    HB3  ALA  15           2HB      ALA  15  -4.265  -7.196  -8.970
  113    H    LEU  16           H        LEU  16  -2.822  -4.929  -9.505
  114    HA   LEU  16           HA       LEU  16  -1.935  -4.075  -6.933
  115    HB2  LEU  16           2HB      LEU  16  -0.530  -3.832  -9.625
  116    HB3  LEU  16           3HB      LEU  16   0.234  -3.650  -8.051
  117    HG   LEU  16           HG       LEU  16  -0.965  -6.218  -9.166
  118   HD11  LEU  16          1HD1      LEU  16   1.150  -5.631 -10.236
  119   HD12  LEU  16          2HD1      LEU  16   1.340  -7.048  -9.208
  120   HD13  LEU  16          3HD1      LEU  16   1.932  -5.475  -8.660
  121   HD21  LEU  16          3HD2      LEU  16  -0.110  -7.322  -7.163
  122   HD22  LEU  16          1HD2      LEU  16  -1.295  -6.092  -6.739
  123   HD23  LEU  16          2HD2      LEU  16   0.427  -5.773  -6.508
  124    H    GLU  17           H        GLU  17  -2.771  -2.386  -9.942
  125    HA   GLU  17           HA       GLU  17  -1.909   0.218  -9.035
  126    HB2  GLU  17           2HB      GLU  17  -3.593  -0.617 -11.435
  127    HB3  GLU  17           3HB      GLU  17  -3.039   1.033 -11.134
  128    HG2  GLU  17           2HG      GLU  17  -0.696   0.307 -11.300
  129    HG3  GLU  17           3HG      GLU  17  -1.224  -1.362 -11.525
  130    H    LYS  18           H        LYS  18  -4.963  -1.522  -9.111
  131    HA   LYS  18           HA       LYS  18  -6.698   0.602  -8.335
  132    HB2  LYS  18           2HB      LYS  18  -6.897  -2.429  -8.115
  133    HB3  LYS  18           3HB      LYS  18  -8.191  -1.373  -7.560
  134    HG2  LYS  18           2HG      LYS  18  -8.711  -0.641  -9.762
  135    HG3  LYS  18           3HG      LYS  18  -7.188  -1.242 -10.425
  136    HD2  LYS  18           2HD      LYS  18  -7.896  -3.528 -10.234
  137    HD3  LYS  18           3HD      LYS  18  -9.282  -3.100  -9.247
  138    HE2  LYS  18           2HE      LYS  18  -9.986  -3.682 -11.509
  139    HE3  LYS  18           3HE      LYS  18 -10.327  -1.986 -11.182
  140    HZ1  LYS  18           3HZ      LYS  18  -8.458  -1.343 -12.486
  141    HZ2  LYS  18           1HZ      LYS  18  -9.378  -2.425 -13.404
  142    HZ3  LYS  18           2HZ      LYS  18  -7.945  -2.940 -12.670
  143    H    ALA  19           H        ALA  19  -4.947  -1.925  -6.527
  144    HA   ALA  19           HA       ALA  19  -5.572  -1.122  -3.889
  145    HB1  ALA  19           3HB      ALA  19  -4.534  -3.299  -4.422
  146    HB2  ALA  19           1HB      ALA  19  -3.591  -2.421  -3.213
  147    HB3  ALA  19           2HB      ALA  19  -3.045  -2.477  -4.892
  148    H    LEU  20           H        LEU  20  -2.889  -0.263  -6.029
  149    HA   LEU  20           HA       LEU  20  -1.319   1.380  -4.454
  150    HB2  LEU  20           2HB      LEU  20  -0.635   0.645  -6.669
  151    HB3  LEU  20           3HB      LEU  20  -1.958   1.512  -7.419
  152    HG   LEU  20           HG       LEU  20  -0.888   3.677  -6.831
  153   HD11  LEU  20          1HD1      LEU  20   1.395   3.776  -5.985
  154   HD12  LEU  20          2HD1      LEU  20   1.409   2.027  -5.752
  155   HD13  LEU  20          3HD1      LEU  20   0.310   3.039  -4.810
  156   HD21  LEU  20          3HD2      LEU  20  -0.468   2.647  -9.016
  157   HD22  LEU  20          1HD2      LEU  20   0.939   1.801  -8.362
  158   HD23  LEU  20          2HD2      LEU  20   0.927   3.565  -8.457
  159    H    LYS  21           H        LYS  21  -4.086   2.307  -6.496
  160    HA   LYS  21           HA       LYS  21  -4.018   5.082  -6.117
  161    HB2  LYS  21           2HB      LYS  21  -5.357   3.949  -7.885
  162    HB3  LYS  21           3HB      LYS  21  -6.436   3.301  -6.652
  163    HG2  LYS  21           2HG      LYS  21  -7.040   5.672  -6.022
  164    HG3  LYS  21           3HG      LYS  21  -6.060   6.230  -7.380
  165    HD2  LYS  21           2HD      LYS  21  -8.434   6.184  -8.001
  166    HD3  LYS  21           3HD      LYS  21  -7.540   4.994  -8.951
  167    HE2  LYS  21           2HE      LYS  21  -8.377   3.183  -7.569
  168    HE3  LYS  21           3HE      LYS  21  -9.124   4.321  -6.443
  169    HZ1  LYS  21           3HZ      LYS  21 -10.803   3.457  -7.870
  170    HZ2  LYS  21           1HZ      LYS  21  -9.914   3.823  -9.266
  171    HZ3  LYS  21           2HZ      LYS  21 -10.548   5.067  -8.316
  172    H    GLU  22           H        GLU  22  -5.516   2.491  -4.240
  173    HA   GLU  22           HA       GLU  22  -6.914   4.238  -2.436
  174    HB2  GLU  22           2HB      GLU  22  -6.300   1.275  -2.150
  175    HB3  GLU  22           3HB      GLU  22  -7.460   2.188  -1.192
  176    HG2  GLU  22           2HG      GLU  22  -7.638   1.622  -4.163
  177    HG3  GLU  22           3HG      GLU  22  -8.586   0.852  -2.895
  178    H    MET  23           H        MET  23  -3.758   2.509  -2.316
  179    HA   MET  23           HA       MET  23  -3.193   3.134   0.405
  180    HB2  MET  23           2HB      MET  23  -1.266   2.507  -1.871
  181    HB3  MET  23           3HB      MET  23  -0.825   2.567  -0.166
  182    HG2  MET  23           2HG      MET  23  -2.722   0.612  -1.471
  183    HG3  MET  23           3HG      MET  23  -1.110   0.270  -0.851
  184    HE1  MET  23           3HE      MET  23  -1.159   1.869   1.989
  185    HE2  MET  23           1HE      MET  23  -0.515   0.244   1.736
  186    HE3  MET  23           2HE      MET  23  -1.681   0.540   3.026
  187    H    ILE  24           H        ILE  24  -2.546   4.849  -2.630
  188    HA   ILE  24           HA       ILE  24  -1.063   7.025  -1.511
  189    HB   ILE  24           HB       ILE  24  -2.729   6.909  -4.080
  190   HG12  ILE  24          2HG1      ILE  24   0.294   6.619  -3.717
  191   HG13  ILE  24          3HG1      ILE  24  -0.814   5.292  -4.036
  192   HG21  ILE  24          1HG2      ILE  24  -2.420   9.245  -3.369
  193   HG22  ILE  24          2HG2      ILE  24  -1.482   8.909  -4.824
  194   HG23  ILE  24          3HG2      ILE  24  -0.675   8.996  -3.258
  195   HD11  ILE  24          3HD1      ILE  24  -1.363   6.287  -6.214
  196   HD12  ILE  24          1HD1      ILE  24   0.355   5.927  -6.043
  197   HD13  ILE  24          2HD1      ILE  24  -0.211   7.590  -5.899
  198    H    ARG  25           H        ARG  25  -4.484   6.427  -2.223
  199    HA   ARG  25           HA       ARG  25  -5.706   8.828  -1.513
  200    HB2  ARG  25           2HB      ARG  25  -6.815   6.907  -2.638
  201    HB3  ARG  25           3HB      ARG  25  -6.708   5.967  -1.160
  202    HG2  ARG  25           2HG      ARG  25  -8.285   7.554  -0.063
  203    HG3  ARG  25           3HG      ARG  25  -8.408   8.448  -1.583
  204    HD2  ARG  25           2HD      ARG  25  -9.198   6.288  -2.681
  205    HD3  ARG  25           3HD      ARG  25  -9.273   5.575  -1.066
  206    HE   ARG  25           HE       ARG  25 -10.781   7.931  -1.025
  207   HH11  ARG  25          1HH1      ARG  25 -10.946   4.761  -2.596
  208   HH12  ARG  25          2HH1      ARG  25 -12.679   4.786  -2.717
  209   HH21  ARG  25          1HH2      ARG  25 -13.046   7.932  -1.199
  210   HH22  ARG  25          2HH2      ARG  25 -13.866   6.583  -1.926
  211    H    GLN  26           H        GLN  26  -4.733   6.068   0.498
  212    HA   GLN  26           HA       GLN  26  -5.690   7.063   2.986
  213    HB2  GLN  26           2HB      GLN  26  -3.498   5.016   2.435
  214    HB3  GLN  26           3HB      GLN  26  -4.204   5.337   4.018
  215    HG2  GLN  26           2HG      GLN  26  -5.605   4.173   1.606
  216    HG3  GLN  26           3HG      GLN  26  -5.201   3.343   3.102
  217   HE21  GLN  26          1HE2      GLN  26  -7.795   3.873   1.707
  218   HE22  GLN  26          2HE2      GLN  26  -8.812   4.577   2.911
  219    H    ALA  27           H        ALA  27  -2.432   7.005   1.534
  220    HA   ALA  27           HA       ALA  27  -1.041   8.360   3.548
  221    HB1  ALA  27           3HB      ALA  27   0.055   7.131   1.715
  222    HB2  ALA  27           1HB      ALA  27   0.675   8.778   1.839
  223    HB3  ALA  27           2HB      ALA  27  -0.470   8.360   0.561
  224    H    ARG  28           H        ARG  28  -3.120   9.621   1.017
  225    HA   ARG  28           HA       ARG  28  -2.279  12.368   1.273
  226    HB2  ARG  28           2HB      ARG  28  -4.625  11.116  -0.203
  227    HB3  ARG  28           3HB      ARG  28  -4.277  12.843  -0.217
  228    HG2  ARG  28           2HG      ARG  28  -2.006  12.286  -1.221
  229    HG3  ARG  28           3HG      ARG  28  -2.556  10.622  -1.363
  230    HD2  ARG  28           2HD      ARG  28  -3.895  13.017  -2.671
  231    HD3  ARG  28           3HD      ARG  28  -2.827  11.874  -3.489
  232    HE   ARG  28           HE       ARG  28  -4.577  10.141  -2.785
  233   HH11  ARG  28          1HH1      ARG  28  -5.409  13.466  -3.664
  234   HH12  ARG  28          2HH1      ARG  28  -7.006  13.050  -4.203
  235   HH21  ARG  28          1HH2      ARG  28  -6.668   9.621  -3.488
  236   HH22  ARG  28          2HH2      ARG  28  -7.716  10.860  -4.100
  237    H    LYS  29           H        LYS  29  -5.135  10.465   2.386
  238    HA   LYS  29           HA       LYS  29  -6.408  12.735   3.633
  239    HB2  LYS  29           2HB      LYS  29  -7.971  11.113   4.664
  240    HB3  LYS  29           3HB      LYS  29  -7.817  10.877   2.929
  241    HG2  LYS  29           2HG      LYS  29  -6.467   8.918   3.224
  242    HG3  LYS  29           3HG      LYS  29  -6.294   9.204   4.951
  243    HD2  LYS  29           2HD      LYS  29  -9.031   8.731   3.726
  244    HD3  LYS  29           3HD      LYS  29  -7.972   7.375   4.119
  245    HE2  LYS  29           2HE      LYS  29  -9.478   7.712   5.964
  246    HE3  LYS  29           3HE      LYS  29  -7.869   8.207   6.482
  247    HZ1  LYS  29           3HZ      LYS  29  -9.442   9.798   7.253
  248    HZ2  LYS  29           1HZ      LYS  29 -10.134   9.968   5.723
  249    HZ3  LYS  29           2HZ      LYS  29  -8.572  10.533   6.009
  250    H    PHE  30           H        PHE  30  -4.113  10.326   4.716
  251    HA   PHE  30           HA       PHE  30  -4.174  11.083   7.508
  252    HB2  PHE  30           2HB      PHE  30  -2.214   9.407   5.867
  253    HB3  PHE  30           3HB      PHE  30  -2.006   9.704   7.588
  254    HD1  PHE  30           HD1      PHE  30  -4.649   9.335   8.739
  255    HD2  PHE  30           HD2      PHE  30  -2.777   7.127   5.596
  256    HE1  PHE  30           HE1      PHE  30  -6.000   7.365   9.293
  257    HE2  PHE  30           HE2      PHE  30  -4.145   5.164   6.154
  258    HZ   PHE  30           HZ       PHE  30  -5.758   5.284   8.005
  259    H    ALA  31           H        ALA  31  -2.757  12.257   4.629
  260    HA   ALA  31           HA       ALA  31  -1.481  13.971   4.036
  261    HB1  ALA  31           3HB      ALA  31  -2.912  15.296   5.542
  262    HB2  ALA  31           1HB      ALA  31  -1.266  15.928   5.479
  263    HB3  ALA  31           2HB      ALA  31  -1.799  14.988   6.876
  264    H    GLY  32           H        GLY  32   0.107  12.340   3.759
  265    HA2  GLY  32           2HA      GLY  32   2.570  12.863   5.336
  266    HA3  GLY  32           3HA      GLY  32   2.083  11.227   4.899
  267    H    THR  33           H        THR  33   4.107  11.063   3.817
  268    HA   THR  33           HA       THR  33   4.131  12.197   1.073
  269    HB   THR  33           HB       THR  33   6.471  11.188   2.778
  270    HG1  THR  33           HG1      THR  33   5.690  13.815   1.981
  271   HG21  THR  33          3HG2      THR  33   6.515  12.457   0.012
  272   HG22  THR  33          1HG2      THR  33   6.884  10.766   0.374
  273   HG23  THR  33          2HG2      THR  33   7.931  12.049   0.982
  274    H    VAL  34           H        VAL  34   4.248  10.685  -0.638
  275    HA   VAL  34           HA       VAL  34   4.474   7.824  -0.056
  276    HB   VAL  34           HB       VAL  34   2.077   8.229   0.130
  277   HG11  VAL  34          1HG1      VAL  34   1.873  10.322  -1.109
  278   HG12  VAL  34          2HG1      VAL  34   0.687   9.143  -1.676
  279   HG13  VAL  34          3HG1      VAL  34   2.136   9.469  -2.632
  280   HG21  VAL  34          3HG2      VAL  34   1.180   6.704  -1.593
  281   HG22  VAL  34          1HG2      VAL  34   2.697   6.106  -0.912
  282   HG23  VAL  34          2HG2      VAL  34   2.682   6.855  -2.512
  283    H    THR  35           H        THR  35   5.697   6.868  -1.548
  284    HA   THR  35           HA       THR  35   5.975   7.906  -4.297
  285    HB   THR  35           HB       THR  35   8.301   7.333  -2.386
  286    HG1  THR  35           HG1      THR  35   7.001   9.644  -3.205
  287   HG21  THR  35          3HG2      THR  35   8.891   6.608  -4.671
  288   HG22  THR  35          1HG2      THR  35   9.787   8.064  -4.226
  289   HG23  THR  35          2HG2      THR  35   8.397   8.178  -5.308
  290    H    TYR  36           H        TYR  36   6.163   6.192  -5.779
  291    HA   TYR  36           HA       TYR  36   6.263   3.448  -4.666
  292    HB2  TYR  36           2HB      TYR  36   4.272   2.789  -5.946
  293    HB3  TYR  36           3HB      TYR  36   3.887   4.086  -4.826
  294    HD1  TYR  36           HD2      TYR  36   3.313   6.371  -5.692
  295    HD2  TYR  36           HD1      TYR  36   4.121   3.138  -8.382
  296    HE1  TYR  36           HE2      TYR  36   2.269   7.629  -7.526
  297    HE2  TYR  36           HE1      TYR  36   3.075   4.405 -10.206
  298    HH   TYR  36           HH       TYR  36   2.330   7.702  -9.994
  299    H    THR  37           H        THR  37   6.801   1.822  -6.079
  300    HA   THR  37           HA       THR  37   8.031   2.542  -8.670
  301    HB   THR  37           HB       THR  37   8.934   0.331  -6.756
  302    HG1  THR  37           HG1      THR  37   9.948   1.871  -5.741
  303   HG21  THR  37          3HG2      THR  37  10.280   1.478  -9.236
  304   HG22  THR  37          1HG2      THR  37   9.508  -0.110  -9.126
  305   HG23  THR  37          2HG2      THR  37  10.953   0.241  -8.175
  306    H    LEU  38           H        LEU  38   6.559   1.817 -10.159
  307    HA   LEU  38           HA       LEU  38   5.310  -0.830  -9.953
  308    HB2  LEU  38           2HB      LEU  38   5.122   1.437 -11.975
  309    HB3  LEU  38           3HB      LEU  38   4.416  -0.137 -12.299
  310    HG   LEU  38           HG       LEU  38   3.629   1.627  -9.940
  311   HD11  LEU  38          1HD1      LEU  38   2.152   1.215 -12.563
  312   HD12  LEU  38          2HD1      LEU  38   2.971   2.692 -12.047
  313   HD13  LEU  38          3HD1      LEU  38   1.565   2.114 -11.158
  314   HD21  LEU  38          3HD2      LEU  38   2.370  -0.920 -11.011
  315   HD22  LEU  38          1HD2      LEU  38   1.737   0.085  -9.701
  316   HD23  LEU  38          2HD2      LEU  38   3.278  -0.746  -9.502
  317    H    ASP  39           H        ASP  39   6.558  -2.545 -10.489
  318    HA   ASP  39           HA       ASP  39   8.239  -2.466 -12.917
  319    HB2  ASP  39           2HB      ASP  39   9.726  -1.981 -10.947
  320    HB3  ASP  39           3HB      ASP  39   9.222  -3.495 -10.207
  321    H    GLY  40           H        GLY  40   6.768  -3.748 -13.954
  322    HA2  GLY  40           2HA      GLY  40   5.925  -5.698 -14.790
  323    HA3  GLY  40           3HA      GLY  40   6.970  -6.571 -13.681
  324    H    ASN  41           H        ASN  41   5.936  -7.772 -12.207
  325    HA   ASN  41           HA       ASN  41   3.117  -7.186 -11.474
  326    HB2  ASN  41           2HB      ASN  41   4.660  -9.820 -11.463
  327    HB3  ASN  41           3HB      ASN  41   3.019  -9.627 -10.855
  328   HD21  ASN  41          1HD2      ASN  41   1.338  -9.219 -12.314
  329   HD22  ASN  41          2HD2      ASN  41   1.483  -9.581 -13.998
  330    H    ASP  42           H        ASP  42   5.597  -6.023 -10.317
  331    HA   ASP  42           HA       ASP  42   5.031  -6.590  -7.472
  332    HB2  ASP  42           2HB      ASP  42   7.134  -7.730  -7.931
  333    HB3  ASP  42           3HB      ASP  42   7.779  -6.333  -8.778
  334    H    LEU  43           H        LEU  43   4.745  -4.793  -6.281
  335    HA   LEU  43           HA       LEU  43   5.339  -2.117  -7.390
  336    HB2  LEU  43           2HB      LEU  43   3.018  -2.379  -7.829
  337    HB3  LEU  43           3HB      LEU  43   2.738  -3.269  -6.343
  338    HG   LEU  43           HG       LEU  43   3.057  -1.135  -5.049
  339   HD11  LEU  43          1HD1      LEU  43   3.063   0.256  -7.730
  340   HD12  LEU  43          2HD1      LEU  43   4.420   0.150  -6.610
  341   HD13  LEU  43          3HD1      LEU  43   2.967   1.033  -6.149
  342   HD21  LEU  43          3HD2      LEU  43   0.843  -1.984  -5.586
  343   HD22  LEU  43          1HD2      LEU  43   0.845  -1.087  -7.107
  344   HD23  LEU  43          2HD2      LEU  43   0.861  -0.223  -5.566
  345    H    GLU  44           H        GLU  44   6.751  -1.232  -6.013
  346    HA   GLU  44           HA       GLU  44   6.709  -1.669  -3.116
  347    HB2  GLU  44           2HB      GLU  44   8.876  -1.596  -4.282
  348    HB3  GLU  44           3HB      GLU  44   8.495  -0.020  -4.966
  349    HG2  GLU  44           2HG      GLU  44   8.500   0.935  -2.653
  350    HG3  GLU  44           3HG      GLU  44   9.004  -0.636  -2.038
  351    H    ILE  45           H        ILE  45   5.742  -0.209  -1.690
  352    HA   ILE  45           HA       ILE  45   5.201   2.587  -2.613
  353    HB   ILE  45           HB       ILE  45   3.334   0.958  -0.804
  354   HG12  ILE  45          2HG1      ILE  45   2.861   1.813  -3.702
  355   HG13  ILE  45          3HG1      ILE  45   3.269   0.182  -3.189
  356   HG21  ILE  45          1HG2      ILE  45   2.981   3.754  -1.952
  357   HG22  ILE  45          2HG2      ILE  45   3.306   3.354  -0.265
  358   HG23  ILE  45          3HG2      ILE  45   1.777   2.874  -1.002
  359   HD11  ILE  45          3HD1      ILE  45   1.173   0.034  -1.951
  360   HD12  ILE  45          1HD1      ILE  45   0.913   0.388  -3.656
  361   HD13  ILE  45          2HD1      ILE  45   0.748   1.671  -2.460
  362    H    ARG  46           H        ARG  46   6.501   3.875  -1.419
  363    HA   ARG  46           HA       ARG  46   7.318   3.136   1.321
  364    HB2  ARG  46           2HB      ARG  46   8.620   5.021  -0.706
  365    HB3  ARG  46           3HB      ARG  46   9.217   4.721   0.923
  366    HG2  ARG  46           2HG      ARG  46   9.663   2.366   0.342
  367    HG3  ARG  46           3HG      ARG  46   9.039   2.647  -1.287
  368    HD2  ARG  46           2HD      ARG  46  11.505   2.689  -1.242
  369    HD3  ARG  46           3HD      ARG  46  10.844   4.252  -1.730
  370    HE   ARG  46           HE       ARG  46  11.214   4.479   0.973
  371   HH11  ARG  46          1HH1      ARG  46  13.385   3.679  -1.700
  372   HH12  ARG  46          2HH1      ARG  46  14.777   4.348  -0.913
  373   HH21  ARG  46          1HH2      ARG  46  13.056   5.360   1.962
  374   HH22  ARG  46          2HH2      ARG  46  14.591   5.300   1.153
  375    H    ILE  47           H        ILE  47   5.924   4.110   2.700
  376    HA   ILE  47           HA       ILE  47   4.998   6.876   2.182
  377    HB   ILE  47           HB       ILE  47   3.754   4.784   4.034
  378   HG12  ILE  47          2HG1      ILE  47   2.855   5.766   1.280
  379   HG13  ILE  47          3HG1      ILE  47   3.503   4.172   1.639
  380   HG21  ILE  47          1HG2      ILE  47   2.715   7.528   3.218
  381   HG22  ILE  47          2HG2      ILE  47   3.347   7.100   4.809
  382   HG23  ILE  47          3HG2      ILE  47   1.858   6.358   4.228
  383   HD11  ILE  47          3HD1      ILE  47   1.537   3.697   3.022
  384   HD12  ILE  47          1HD1      ILE  47   1.117   4.087   1.357
  385   HD13  ILE  47          2HD1      ILE  47   0.879   5.287   2.626
  386    H    THR  48           H        THR  48   6.018   8.400   3.293
  387    HA   THR  48           HA       THR  48   7.401   7.799   5.846
  388    HB   THR  48           HB       THR  48   8.238   9.808   3.692
  389    HG1  THR  48           HG1      THR  48   8.593   7.129   3.806
  390   HG21  THR  48          3HG2      THR  48  10.387   9.912   4.893
  391   HG22  THR  48          1HG2      THR  48   9.791   8.782   6.106
  392   HG23  THR  48          2HG2      THR  48   9.069  10.389   5.969
  393    H    GLY  49           H        GLY  49   7.437   9.538   7.398
  394    HA2  GLY  49           2HA      GLY  49   7.024  11.685   8.226
  395    HA3  GLY  49           3HA      GLY  49   5.966  12.026   6.866
  396    H    VAL  50           H        VAL  50   4.404   9.565   7.167
  397    HA   VAL  50           HA       VAL  50   2.486  10.308   9.104
  398    HB   VAL  50           HB       VAL  50   1.403   8.118   8.664
  399   HG11  VAL  50          1HG1      VAL  50   0.964   8.389   6.250
  400   HG12  VAL  50          2HG1      VAL  50   2.373   9.442   6.102
  401   HG13  VAL  50          3HG1      VAL  50   0.989   9.949   7.075
  402   HG21  VAL  50          3HG2      VAL  50   2.348   6.473   7.091
  403   HG22  VAL  50          1HG2      VAL  50   3.395   6.676   8.496
  404   HG23  VAL  50          2HG2      VAL  50   3.828   7.428   6.960
  405    HA   PRO  51           HA       PRO  51   4.717   8.842  12.782
  406    HB2  PRO  51           2HB      PRO  51   2.510   8.748  14.522
  407    HB3  PRO  51           3HB      PRO  51   3.452  10.206  14.156
  408    HG2  PRO  51           2HG      PRO  51   0.843   9.310  12.998
  409    HG3  PRO  51           3HG      PRO  51   1.368  10.943  13.466
  410    HD2  PRO  51           2HD      PRO  51   1.328  10.164  10.882
  411    HD3  PRO  51           3HD      PRO  51   2.590  11.262  11.493
  412    H    GLU  52           H        GLU  52   4.748   6.929  14.234
  413    HA   GLU  52           HA       GLU  52   4.522   4.620  12.640
  414    HB2  GLU  52           2HB      GLU  52   6.270   4.925  14.366
  415    HB3  GLU  52           3HB      GLU  52   5.059   4.755  15.634
  416    HG2  GLU  52           2HG      GLU  52   4.650   2.434  14.994
  417    HG3  GLU  52           3HG      GLU  52   5.709   2.600  13.592
  418    H    GLN  53           H        GLN  53   2.370   5.883  15.114
  419    HA   GLN  53           HA       GLN  53   0.643   3.694  15.431
  420    HB2  GLN  53           2HB      GLN  53  -1.071   5.329  16.126
  421    HB3  GLN  53           3HB      GLN  53   0.486   5.664  16.871
  422    HG2  GLN  53           2HG      GLN  53   0.861   7.579  15.501
  423    HG3  GLN  53           3HG      GLN  53  -0.426   7.135  14.383
  424   HE21  GLN  53          1HE2      GLN  53  -2.605   7.473  15.016
  425   HE22  GLN  53          2HE2      GLN  53  -3.015   8.582  16.279
  426    H    VAL  54           H        VAL  54   0.726   6.212  12.946
  427    HA   VAL  54           HA       VAL  54  -1.635   5.320  11.553
  428    HB   VAL  54           HB       VAL  54   0.506   7.367  10.802
  429   HG11  VAL  54          1HG1      VAL  54  -1.066   8.186   9.076
  430   HG12  VAL  54          2HG1      VAL  54  -2.153   6.838   9.425
  431   HG13  VAL  54          3HG1      VAL  54  -0.552   6.531   8.750
  432   HG21  VAL  54          3HG2      VAL  54  -2.316   7.754  11.873
  433   HG22  VAL  54          1HG2      VAL  54  -1.218   9.051  11.384
  434   HG23  VAL  54          2HG2      VAL  54  -0.817   8.028  12.766
  435    H    ARG  55           H        ARG  55   1.871   4.846  11.231
  436    HA   ARG  55           HA       ARG  55   1.992   3.516   8.757
  437    HB2  ARG  55           2HB      ARG  55   3.670   3.219  11.283
  438    HB3  ARG  55           3HB      ARG  55   4.029   2.310   9.818
  439    HG2  ARG  55           2HG      ARG  55   4.492   4.323   8.581
  440    HG3  ARG  55           3HG      ARG  55   3.916   5.340   9.907
  441    HD2  ARG  55           2HD      ARG  55   6.409   5.226   9.734
  442    HD3  ARG  55           3HD      ARG  55   5.781   4.704  11.297
  443    HE   ARG  55           HE       ARG  55   6.405   2.652   9.285
  444   HH11  ARG  55          1HH1      ARG  55   7.339   4.222  12.302
  445   HH12  ARG  55          2HH1      ARG  55   8.447   2.966  12.759
  446   HH21  ARG  55          1HH2      ARG  55   7.894   1.030   9.901
  447   HH22  ARG  55          2HH2      ARG  55   8.755   1.177  11.405
  448    H    LYS  56           H        LYS  56   1.338   2.285  12.027
  449    HA   LYS  56           HA       LYS  56   0.953  -0.431  11.439
  450    HB2  LYS  56           2HB      LYS  56  -0.369   1.297  13.566
  451    HB3  LYS  56           3HB      LYS  56  -0.431  -0.465  13.543
  452    HG2  LYS  56           2HG      LYS  56   1.923  -0.653  13.943
  453    HG3  LYS  56           3HG      LYS  56   2.184   1.070  13.650
  454    HD2  LYS  56           2HD      LYS  56   0.829   1.598  15.683
  455    HD3  LYS  56           3HD      LYS  56   0.635  -0.131  15.988
  456    HE2  LYS  56           2HE      LYS  56   3.103  -0.335  16.228
  457    HE3  LYS  56           3HE      LYS  56   3.256   1.406  15.979
  458    HZ1  LYS  56           3HZ      LYS  56   2.036   1.814  17.977
  459    HZ2  LYS  56           1HZ      LYS  56   3.274   0.724  18.341
  460    HZ3  LYS  56           2HZ      LYS  56   1.684   0.175  18.182
  461    H    GLU  57           H        GLU  57  -1.300   2.314  11.276
  462    HA   GLU  57           HA       GLU  57  -3.654   0.856  10.635
  463    HB2  GLU  57           2HB      GLU  57  -2.948   3.762  10.025
  464    HB3  GLU  57           3HB      GLU  57  -4.563   3.063   9.888
  465    HG2  GLU  57           2HG      GLU  57  -4.578   2.589  12.308
  466    HG3  GLU  57           3HG      GLU  57  -2.955   3.268  12.453
  467    H    LEU  58           H        LEU  58  -1.101   2.296   8.615
  468    HA   LEU  58           HA       LEU  58  -2.262   1.767   6.081
  469    HB2  LEU  58           2HB      LEU  58   0.500   2.476   7.036
  470    HB3  LEU  58           3HB      LEU  58   0.388   1.758   5.450
  471    HG   LEU  58           HG       LEU  58   0.454   4.093   5.086
  472   HD11  LEU  58          1HD1      LEU  58  -2.462   3.297   4.823
  473   HD12  LEU  58          2HD1      LEU  58  -1.173   2.974   3.660
  474   HD13  LEU  58          3HD1      LEU  58  -1.660   4.633   3.988
  475   HD21  LEU  58          3HD2      LEU  58  -1.008   5.748   6.138
  476   HD22  LEU  58          1HD2      LEU  58  -0.039   4.884   7.330
  477   HD23  LEU  58          2HD2      LEU  58  -1.745   4.483   7.129
  478    H    ALA  59           H        ALA  59  -0.511  -0.283   8.318
  479    HA   ALA  59           HA       ALA  59   0.012  -2.482   6.612
  480    HB1  ALA  59           3HB      ALA  59   0.204  -3.785   8.693
  481    HB2  ALA  59           1HB      ALA  59  -0.531  -2.462   9.599
  482    HB3  ALA  59           2HB      ALA  59   1.041  -2.238   8.831
  483    H    LYS  60           H        LYS  60  -2.808  -1.605   8.589
  484    HA   LYS  60           HA       LYS  60  -4.331  -3.962   7.979
  485    HB2  LYS  60           2HB      LYS  60  -5.084  -1.298   9.222
  486    HB3  LYS  60           3HB      LYS  60  -6.308  -2.503   8.856
  487    HG2  LYS  60           2HG      LYS  60  -5.744  -2.649  11.196
  488    HG3  LYS  60           3HG      LYS  60  -5.152  -4.104  10.389
  489    HD2  LYS  60           2HD      LYS  60  -2.877  -3.152  10.354
  490    HD3  LYS  60           3HD      LYS  60  -3.475  -1.686  11.134
  491    HE2  LYS  60           2HE      LYS  60  -2.361  -3.142  12.747
  492    HE3  LYS  60           3HE      LYS  60  -4.076  -3.000  13.135
  493    HZ1  LYS  60           3HZ      LYS  60  -3.240  -5.281  13.324
  494    HZ2  LYS  60           1HZ      LYS  60  -2.845  -5.284  11.679
  495    HZ3  LYS  60           2HZ      LYS  60  -4.460  -5.161  12.162
  496    H    GLU  61           H        GLU  61  -3.938  -0.800   6.480
  497    HA   GLU  61           HA       GLU  61  -6.125  -0.924   4.658
  498    HB2  GLU  61           2HB      GLU  61  -3.497   0.617   4.529
  499    HB3  GLU  61           3HB      GLU  61  -4.828   0.848   3.399
  500    HG2  GLU  61           2HG      GLU  61  -4.858   1.407   6.377
  501    HG3  GLU  61           3HG      GLU  61  -4.850   2.601   5.083
  502    H    ALA  62           H        ALA  62  -2.693  -1.802   4.468
  503    HA   ALA  62           HA       ALA  62  -2.512  -2.836   1.900
  504    HB1  ALA  62           3HB      ALA  62  -0.585  -2.494   3.384
  505    HB2  ALA  62           1HB      ALA  62  -0.611  -4.149   2.773
  506    HB3  ALA  62           2HB      ALA  62  -1.130  -3.809   4.426
  507    H    GLU  63           H        GLU  63  -3.545  -4.470   4.916
  508    HA   GLU  63           HA       GLU  63  -3.929  -7.066   3.858
  509    HB2  GLU  63           2HB      GLU  63  -5.175  -5.751   6.304
  510    HB3  GLU  63           3HB      GLU  63  -5.292  -7.471   5.935
  511    HG2  GLU  63           2HG      GLU  63  -2.852  -7.698   6.127
  512    HG3  GLU  63           3HG      GLU  63  -2.710  -5.970   6.450
  513    H    ARG  64           H        ARG  64  -6.276  -4.356   4.261
  514    HA   ARG  64           HA       ARG  64  -8.554  -5.954   3.563
  515    HB2  ARG  64           2HB      ARG  64  -9.821  -3.807   3.365
  516    HB3  ARG  64           3HB      ARG  64  -9.003  -4.012   4.907
  517    HG2  ARG  64           2HG      ARG  64  -7.324  -2.408   4.339
  518    HG3  ARG  64           3HG      ARG  64  -7.844  -2.352   2.655
  519    HD2  ARG  64           2HD      ARG  64  -9.645  -1.493   4.942
  520    HD3  ARG  64           3HD      ARG  64  -8.527  -0.386   4.148
  521    HE   ARG  64           HE       ARG  64 -10.879  -1.677   2.907
  522   HH11  ARG  64          1HH1      ARG  64  -8.352   0.787   2.768
  523   HH12  ARG  64          2HH1      ARG  64  -9.063   1.611   1.417
  524   HH21  ARG  64          1HH2      ARG  64 -11.807  -0.554   1.147
  525   HH22  ARG  64          2HH2      ARG  64 -11.018   0.849   0.501
  526    H    LEU  65           H        LEU  65  -6.308  -3.959   1.710
  527    HA   LEU  65           HA       LEU  65  -7.821  -4.169  -0.759
  528    HB2  LEU  65           2HB      LEU  65  -4.932  -3.341  -0.284
  529    HB3  LEU  65           3HB      LEU  65  -5.819  -3.132  -1.791
  530    HG   LEU  65           HG       LEU  65  -6.508  -1.787   0.853
  531   HD11  LEU  65          1HD1      LEU  65  -5.265  -0.596  -1.636
  532   HD12  LEU  65          2HD1      LEU  65  -4.449  -0.913  -0.102
  533   HD13  LEU  65          3HD1      LEU  65  -5.742   0.279  -0.177
  534   HD21  LEU  65          3HD2      LEU  65  -8.129  -0.457  -0.436
  535   HD22  LEU  65          1HD2      LEU  65  -8.530  -2.172  -0.453
  536   HD23  LEU  65          2HD2      LEU  65  -7.794  -1.425  -1.876
  537    H    ALA  66           H        ALA  66  -5.317  -6.021   0.848
  538    HA   ALA  66           HA       ALA  66  -4.435  -7.642  -1.287
  539    HB1  ALA  66           3HB      ALA  66  -3.624  -9.163   0.444
  540    HB2  ALA  66           1HB      ALA  66  -4.633  -8.361   1.653
  541    HB3  ALA  66           2HB      ALA  66  -3.300  -7.489   0.895
  542    H    LYS  67           H        LYS  67  -7.067  -8.127   1.084
  543    HA   LYS  67           HA       LYS  67  -7.961 -10.630  -0.065
  544    HB2  LYS  67           2HB      LYS  67  -9.834 -10.470   1.562
  545    HB3  LYS  67           3HB      LYS  67  -8.268 -10.254   2.331
  546    HG2  LYS  67           2HG      LYS  67  -8.633  -7.800   2.353
  547    HG3  LYS  67           3HG      LYS  67 -10.220  -8.034   1.626
  548    HD2  LYS  67           2HD      LYS  67  -9.365  -9.115   4.345
  549    HD3  LYS  67           3HD      LYS  67 -10.316  -7.653   4.086
  550    HE2  LYS  67           2HE      LYS  67 -11.171 -10.473   3.344
  551    HE3  LYS  67           3HE      LYS  67 -11.750  -9.536   4.722
  552    HZ1  LYS  67           3HZ      LYS  67 -13.337  -9.408   2.951
  553    HZ2  LYS  67           1HZ      LYS  67 -12.161  -8.883   1.853
  554    HZ3  LYS  67           2HZ      LYS  67 -12.625  -7.887   3.134
  555    H    GLU  68           H        GLU  68  -8.631  -7.279  -0.623
  556    HA   GLU  68           HA       GLU  68 -11.242  -7.502  -1.765
  557    HB2  GLU  68           2HB      GLU  68 -10.339  -5.389  -0.801
  558    HB3  GLU  68           3HB      GLU  68  -9.128  -5.321  -2.075
  559    HG2  GLU  68           2HG      GLU  68 -10.973  -3.756  -2.485
  560    HG3  GLU  68           3HG      GLU  68 -10.864  -4.971  -3.758
  561    H    PHE  69           H        PHE  69  -7.979  -7.126  -3.165
  562    HA   PHE  69           HA       PHE  69  -9.002  -7.592  -5.888
  563    HB2  PHE  69           2HB      PHE  69  -6.253  -6.650  -4.935
  564    HB3  PHE  69           3HB      PHE  69  -6.825  -6.670  -6.602
  565    HD1  PHE  69           HD1      PHE  69  -9.158  -5.380  -6.968
  566    HD2  PHE  69           HD2      PHE  69  -6.399  -4.572  -3.804
  567    HE1  PHE  69           HE1      PHE  69 -10.142  -3.157  -6.659
  568    HE2  PHE  69           HE2      PHE  69  -7.393  -2.343  -3.507
  569    HZ   PHE  69           HZ       PHE  69  -9.271  -1.636  -4.931
  570    H    ASN  70           H        ASN  70  -7.822  -9.446  -3.444
  571    HA   ASN  70           HA       ASN  70  -6.849 -11.430  -3.143
  572    HB2  ASN  70           2HB      ASN  70  -8.806 -12.032  -4.746
  573    HB3  ASN  70           3HB      ASN  70  -7.581 -12.200  -5.994
  574   HD21  ASN  70          1HD2      ASN  70  -9.418 -14.152  -4.654
  575   HD22  ASN  70          2HD2      ASN  70  -8.394 -15.437  -4.118
  576    H    ILE  71           H        ILE  71  -5.027  -9.795  -3.317
  577    HA   ILE  71           HA       ILE  71  -2.866 -10.928  -4.998
  578    HB   ILE  71           HB       ILE  71  -1.766  -8.601  -4.807
  579   HG12  ILE  71          2HG1      ILE  71  -4.603  -7.810  -3.992
  580   HG13  ILE  71          3HG1      ILE  71  -3.131  -7.595  -3.051
  581   HG21  ILE  71          1HG2      ILE  71  -2.685  -9.443  -6.920
  582   HG22  ILE  71          2HG2      ILE  71  -2.893  -7.699  -6.776
  583   HG23  ILE  71          3HG2      ILE  71  -4.267  -8.774  -6.509
  584   HD11  ILE  71          3HD1      ILE  71  -2.333  -5.973  -4.746
  585   HD12  ILE  71          1HD1      ILE  71  -3.831  -5.493  -3.950
  586   HD13  ILE  71          2HD1      ILE  71  -3.879  -6.139  -5.588
  587    H    THR  72           H        THR  72  -0.772 -10.869  -4.013
  588    HA   THR  72           HA       THR  72  -0.806 -11.334  -1.139
  589    HB   THR  72           HB       THR  72   1.676 -11.902  -1.594
  590    HG1  THR  72           HG1      THR  72   0.802 -11.556  -4.283
  591   HG21  THR  72          3HG2      THR  72   1.188 -14.073  -2.655
  592   HG22  THR  72          1HG2      THR  72  -0.407 -13.493  -3.137
  593   HG23  THR  72          2HG2      THR  72  -0.017 -13.692  -1.425
  594    H    VAL  73           H        VAL  73  -0.037  -9.880   0.353
  595    HA   VAL  73           HA       VAL  73   1.641  -7.629  -0.578
  596    HB   VAL  73           HB       VAL  73  -0.703  -6.814  -0.072
  597   HG11  VAL  73          1HG1      VAL  73  -1.308  -8.291   1.791
  598   HG12  VAL  73          2HG1      VAL  73  -1.483  -6.596   2.246
  599   HG13  VAL  73          3HG1      VAL  73  -0.093  -7.524   2.817
  600   HG21  VAL  73          3HG2      VAL  73   1.465  -5.676   1.735
  601   HG22  VAL  73          1HG2      VAL  73   0.017  -4.825   1.181
  602   HG23  VAL  73          2HG2      VAL  73   1.255  -5.310   0.020
  603    H    THR  74           H        THR  74   3.223  -7.021   0.773
  604    HA   THR  74           HA       THR  74   3.548  -8.272   3.420
  605    HB   THR  74           HB       THR  74   5.103  -9.513   2.015
  606    HG1  THR  74           HG1      THR  74   6.811  -9.191   3.278
  607   HG21  THR  74          3HG2      THR  74   6.210  -6.852   1.030
  608   HG22  THR  74          1HG2      THR  74   5.270  -8.000   0.071
  609   HG23  THR  74          2HG2      THR  74   6.874  -8.445   0.659
  610    H    TYR  75           H        TYR  75   4.203  -6.771   4.935
  611    HA   TYR  75           HA       TYR  75   4.905  -4.044   4.043
  612    HB2  TYR  75           2HB      TYR  75   3.274  -3.181   5.853
  613    HB3  TYR  75           3HB      TYR  75   2.579  -3.759   4.348
  614    HD1  TYR  75           HD1      TYR  75   3.143  -4.693   7.939
  615    HD2  TYR  75           HD2      TYR  75   0.988  -5.564   4.349
  616    HE1  TYR  75           HE1      TYR  75   1.664  -6.199   9.190
  617    HE2  TYR  75           HE2      TYR  75  -0.489  -7.070   5.607
  618    HH   TYR  75           HH       TYR  75  -0.567  -8.319   7.647
  619    H    THR  76           H        THR  76   6.397  -3.072   5.287
  620    HA   THR  76           HA       THR  76   7.490  -4.582   7.572
  621    HB   THR  76           HB       THR  76   9.026  -2.651   5.770
  622    HG1  THR  76           HG1      THR  76   8.307  -4.405   4.508
  623   HG21  THR  76          3HG2      THR  76  11.018  -3.795   6.675
  624   HG22  THR  76          1HG2      THR  76   9.991  -4.845   7.651
  625   HG23  THR  76          2HG2      THR  76  10.060  -3.113   7.993
  626    H    ILE  77           H        ILE  77   7.173  -3.604   9.441
  627    HA   ILE  77           HA       ILE  77   7.598  -0.705   9.687
  628    HB   ILE  77           HB       ILE  77   5.951  -0.855  11.755
  629   HG12  ILE  77          2HG1      ILE  77   4.867  -3.146  10.046
  630   HG13  ILE  77          3HG1      ILE  77   5.463  -3.256  11.698
  631   HG21  ILE  77          1HG2      ILE  77   5.597   0.638   9.856
  632   HG22  ILE  77          2HG2      ILE  77   4.068  -0.050  10.399
  633   HG23  ILE  77          3HG2      ILE  77   4.842  -0.669   8.938
  634   HD11  ILE  77          3HD1      ILE  77   3.043  -3.348  11.625
  635   HD12  ILE  77          1HD1      ILE  77   2.974  -1.785  10.812
  636   HD13  ILE  77          2HD1      ILE  77   3.572  -1.894  12.472
  637    H    ARG  78           H        ARG  78   9.403  -0.513  10.718
  638    HA   ARG  78           HA       ARG  78  10.025  -2.110  13.116
  639    HB2  ARG  78           2HB      ARG  78  11.859  -1.753  10.688
  640    HB3  ARG  78           3HB      ARG  78  12.432  -2.294  12.264
  641    HG2  ARG  78           2HG      ARG  78  10.926  -4.285  12.094
  642    HG3  ARG  78           3HG      ARG  78  10.462  -3.756  10.473
  643    HD2  ARG  78           2HD      ARG  78  12.189  -5.505  10.382
  644    HD3  ARG  78           3HD      ARG  78  12.799  -3.983   9.717
  645    HE   ARG  78           HE       ARG  78  13.453  -4.100  12.449
  646   HH11  ARG  78          1HH1      ARG  78  14.398  -5.705   9.454
  647   HH12  ARG  78          2HH1      ARG  78  15.991  -6.081  10.032
  648   HH21  ARG  78          1HH2      ARG  78  15.521  -4.600  13.181
  649   HH22  ARG  78          2HH2      ARG  78  16.633  -5.455  12.148
  650    H    GLY  79           H        GLY  79  12.475  -1.077  13.714
  651    HA2  GLY  79           2HA      GLY  79  13.673   0.942  14.089
  652    HA3  GLY  79           3HA      GLY  79  12.238   1.876  13.677
  653    H    SER  80           H        SER  80  13.797  -0.065  16.097
  654    HA   SER  80           HA       SER  80  13.851  -0.014  18.326
  655    HB2  SER  80           2HB      SER  80  13.545   2.479  18.109
  656    HB3  SER  80           3HB      SER  80  11.818   2.235  18.333
  657    HG   SER  80           HG       SER  80  12.206   1.470  20.381
  658    H    LEU  81           H        LEU  81  11.188  -0.924  16.569
  659    HA   LEU  81           HA       LEU  81   9.559  -2.015  18.668
  660    HB2  LEU  81           2HB      LEU  81   9.912  -2.902  15.761
  661    HB3  LEU  81           3HB      LEU  81   8.674  -3.519  16.846
  662    HG   LEU  81           HG       LEU  81   8.878  -0.619  15.928
  663   HD11  LEU  81          1HD1      LEU  81   8.272  -2.089  14.063
  664   HD12  LEU  81          2HD1      LEU  81   6.933  -1.048  14.529
  665   HD13  LEU  81          3HD1      LEU  81   6.928  -2.752  14.999
  666   HD21  LEU  81          3HD2      LEU  81   6.676  -2.002  17.496
  667   HD22  LEU  81          1HD2      LEU  81   6.653  -0.335  16.909
  668   HD23  LEU  81          2HD2      LEU  81   7.823  -0.820  18.131
  669    H    GLU  82           H        GLU  82  12.566  -2.799  17.218
  670    HA   GLU  82           HA       GLU  82  12.823  -5.500  18.255
  671    HB2  GLU  82           2HB      GLU  82  15.015  -3.699  17.089
  672    HB3  GLU  82           3HB      GLU  82  15.074  -5.441  17.296
  673    HG2  GLU  82           2HG      GLU  82  14.674  -5.325  15.029
  674    HG3  GLU  82           3HG      GLU  82  13.018  -5.420  15.620
  675    H    HIS  83           H        HIS  83  13.821  -6.037  20.186
  676    HA   HIS  83           HA       HIS  83  14.004  -4.115  22.260
  677    HB2  HIS  83           2HB      HIS  83  14.756  -7.053  22.105
  678    HB3  HIS  83           3HB      HIS  83  15.126  -6.123  23.551
  679    HD1  HIS  83           HD1      HIS  83  13.289  -8.472  23.858
  680    HD2  HIS  83           HD2      HIS  83  11.909  -4.654  22.995
  681    HE1  HIS  83           HE1      HIS  83  10.913  -8.412  24.675
  682    HE2  HIS  83           HE2      HIS  83  10.100  -6.101  24.105
  683    H    HIS  84           H        HIS  84  15.643  -2.952  23.050
  684    HA   HIS  84           HA       HIS  84  18.249  -2.977  21.705
  685    HB2  HIS  84           2HB      HIS  84  17.124  -1.057  23.800
  686    HB3  HIS  84           3HB      HIS  84  18.664  -0.863  22.969
  687    HD1  HIS  84           HD1      HIS  84  18.480   0.870  21.213
  688    HD2  HIS  84           HD2      HIS  84  14.940  -1.267  21.585
  689    HE1  HIS  84           HE1      HIS  84  16.898   1.885  19.551
  690    HE2  HIS  84           HE2      HIS  84  14.716   0.738  19.997
  691    H    HIS  85           H        HIS  85  16.884  -3.323  24.966
  692    HA   HIS  85           HA       HIS  85  19.384  -3.693  26.330
  693    HB2  HIS  85           2HB      HIS  85  16.573  -4.447  27.271
  694    HB3  HIS  85           3HB      HIS  85  17.994  -4.257  28.293
  695    HD1  HIS  85           HD1      HIS  85  15.176  -2.646  28.368
  696    HD2  HIS  85           HD2      HIS  85  18.855  -1.244  27.061
  697    HE1  HIS  85           HE1      HIS  85  15.063  -0.156  28.602
  698    HE2  HIS  85           HE2      HIS  85  17.367   0.645  27.968
  699    H    HIS  86           H        HIS  86  20.067  -5.672  27.406
  700    HA   HIS  86           HA       HIS  86  19.893  -8.018  25.742
  701    HB2  HIS  86           2HB      HIS  86  21.208  -7.675  28.481
  702    HB3  HIS  86           3HB      HIS  86  21.432  -9.055  27.408
  703    HD1  HIS  86           HD1      HIS  86  23.811  -7.310  28.366
  704    HD2  HIS  86           HD2      HIS  86  21.819  -6.781  24.757
  705    HE1  HIS  86           HE1      HIS  86  25.431  -6.111  26.869
  706    HE2  HIS  86           HE2      HIS  86  24.127  -5.656  24.766
  707    H    HIS  87           H        HIS  87  18.970  -9.990  26.218
  708    HA   HIS  87           HA       HIS  87  16.343  -9.896  27.075
  709    HB2  HIS  87           2HB      HIS  87  18.177 -12.278  26.605
  710    HB3  HIS  87           3HB      HIS  87  16.450 -12.449  26.889
  711    HD1  HIS  87           HD1      HIS  87  18.885 -11.868  24.217
  712    HD2  HIS  87           HD2      HIS  87  14.825 -11.226  24.803
  713    HE1  HIS  87           HE1      HIS  87  17.908 -11.575  21.927
  714    HE2  HIS  87           HE2      HIS  87  15.431 -11.366  22.308
  715    H    HIS  88           H        HIS  88  18.863 -11.857  28.678
  716    HA   HIS  88           HA       HIS  88  18.211 -11.175  31.347
  717    HB2  HIS  88           2HB      HIS  88  16.130 -12.425  30.943
  718    HB3  HIS  88           3HB      HIS  88  17.025 -13.803  30.323
  719    HD1  HIS  88           HD1      HIS  88  17.422 -15.618  31.972
  720    HD2  HIS  88           HD2      HIS  88  16.693 -11.981  33.855
  721    HE1  HIS  88           HE1      HIS  88  17.301 -16.140  34.423
  722    HE2  HIS  88           HE2      HIS  88  16.652 -13.966  35.509
  Start of MODEL    8
    1    H1   MET   1           1H       MET   1   9.215   3.726  12.666
    2    H2   MET   1           2H       MET   1   8.997   4.318  14.230
    3    H3   MET   1           3H       MET   1  10.479   4.527  13.447
    4    HA   MET   1           HA       MET   1   7.893   5.756  12.713
    5    HB2  MET   1           2HB      MET   1  10.491   6.939  13.789
    6    HB3  MET   1           3HB      MET   1   9.135   7.903  13.216
    7    HG2  MET   1           2HG      MET   1   7.717   6.987  14.992
    8    HG3  MET   1           3HG      MET   1   9.061   5.991  15.560
    9    HE1  MET   1           3HE      MET   1   8.778   8.739  18.383
   10    HE2  MET   1           1HE      MET   1   8.788   7.010  18.046
   11    HE3  MET   1           2HE      MET   1   7.439   8.006  17.499
   12    H    GLY   2           H        GLY   2   8.759   7.869  11.276
   13    HA2  GLY   2           2HA      GLY   2   9.854   8.671   9.414
   14    HA3  GLY   2           3HA      GLY   2  10.781   7.185   9.308
   15    H    GLU   3           H        GLU   3   9.673   5.269   8.422
   16    HA   GLU   3           HA       GLU   3   7.475   5.782   6.547
   17    HB2  GLU   3           2HB      GLU   3   8.750   5.299   4.554
   18    HB3  GLU   3           3HB      GLU   3   9.567   6.599   5.399
   19    HG2  GLU   3           2HG      GLU   3  10.427   3.691   5.442
   20    HG3  GLU   3           3HG      GLU   3  11.105   4.928   4.396
   21    H    MET   4           H        MET   4   6.947   3.817   5.278
   22    HA   MET   4           HA       MET   4   8.116   1.252   6.106
   23    HB2  MET   4           2HB      MET   4   6.162   1.362   7.579
   24    HB3  MET   4           3HB      MET   4   5.123   1.868   6.250
   25    HG2  MET   4           2HG      MET   4   5.412  -0.340   5.174
   26    HG3  MET   4           3HG      MET   4   6.468  -0.851   6.490
   27    HE1  MET   4           3HE      MET   4   1.975   0.062   7.096
   28    HE2  MET   4           1HE      MET   4   2.853   0.416   5.608
   29    HE3  MET   4           2HE      MET   4   3.196   1.333   7.073
   30    H    ASP   5           H        ASP   5   8.528   0.061   4.258
   31    HA   ASP   5           HA       ASP   5   7.282   0.666   1.736
   32    HB2  ASP   5           2HB      ASP   5   8.989  -1.769   2.441
   33    HB3  ASP   5           3HB      ASP   5   8.629  -1.171   0.829
   34    H    ILE   6           H        ILE   6   5.340  -0.018   1.227
   35    HA   ILE   6           HA       ILE   6   4.240  -2.572   2.243
   36    HB   ILE   6           HB       ILE   6   2.733  -0.274   0.890
   37   HG12  ILE   6          2HG1      ILE   6   2.759  -1.056   3.838
   38   HG13  ILE   6          3HG1      ILE   6   3.513   0.380   3.156
   39   HG21  ILE   6          1HG2      ILE   6   1.682  -2.797   2.219
   40   HG22  ILE   6          2HG2      ILE   6   1.723  -2.485   0.481
   41   HG23  ILE   6          3HG2      ILE   6   0.694  -1.508   1.529
   42   HD11  ILE   6          3HD1      ILE   6   1.299   1.189   2.461
   43   HD12  ILE   6          1HD1      ILE   6   1.447   0.961   4.202
   44   HD13  ILE   6          2HD1      ILE   6   0.562  -0.218   3.237
   45    H    ARG   7           H        ARG   7   4.722  -4.124   0.792
   46    HA   ARG   7           HA       ARG   7   5.032  -3.432  -2.061
   47    HB2  ARG   7           2HB      ARG   7   7.071  -4.236  -0.786
   48    HB3  ARG   7           3HB      ARG   7   6.257  -5.776  -0.533
   49    HG2  ARG   7           2HG      ARG   7   6.148  -6.058  -3.035
   50    HG3  ARG   7           3HG      ARG   7   7.083  -4.571  -3.200
   51    HD2  ARG   7           2HD      ARG   7   7.975  -7.150  -1.886
   52    HD3  ARG   7           3HD      ARG   7   8.578  -6.468  -3.397
   53    HE   ARG   7           HE       ARG   7   9.375  -4.545  -1.929
   54   HH11  ARG   7          1HH1      ARG   7   9.186  -7.852  -0.727
   55   HH12  ARG   7          2HH1      ARG   7  10.450  -7.621   0.439
   56   HH21  ARG   7          1HH2      ARG   7  11.041  -4.270  -0.425
   57   HH22  ARG   7          2HH2      ARG   7  11.505  -5.589   0.612
   58    H    PHE   8           H        PHE   8   3.480  -4.186  -3.311
   59    HA   PHE   8           HA       PHE   8   1.765  -6.460  -2.496
   60    HB2  PHE   8           2HB      PHE   8   1.330  -4.218  -4.532
   61    HB3  PHE   8           3HB      PHE   8   0.252  -5.599  -4.370
   62    HD1  PHE   8           HD2      PHE   8  -1.085  -5.902  -2.262
   63    HD2  PHE   8           HD1      PHE   8   1.180  -2.344  -2.998
   64    HE1  PHE   8           HE2      PHE   8  -2.384  -4.716  -0.541
   65    HE2  PHE   8           HE1      PHE   8  -0.119  -1.176  -1.277
   66    HZ   PHE   8           HZ       PHE   8  -1.901  -2.351  -0.044
   67    H    ARG   9           H        ARG   9   1.386  -8.103  -4.032
   68    HA   ARG   9           HA       ARG   9   3.037  -8.244  -6.475
   69    HB2  ARG   9           2HB      ARG   9   3.059 -10.252  -4.181
   70    HB3  ARG   9           3HB      ARG   9   3.528 -10.718  -5.798
   71    HG2  ARG   9           2HG      ARG   9   5.358  -9.012  -5.719
   72    HG3  ARG   9           3HG      ARG   9   4.890  -8.638  -4.059
   73    HD2  ARG   9           2HD      ARG   9   6.002 -11.253  -5.115
   74    HD3  ARG   9           3HD      ARG   9   6.753 -10.143  -3.959
   75    HE   ARG   9           HE       ARG   9   4.195 -11.240  -3.131
   76   HH11  ARG   9          1HH1      ARG   9   7.692 -11.705  -2.992
   77   HH12  ARG   9          2HH1      ARG   9   7.615 -12.726  -1.593
   78   HH21  ARG   9          1HH2      ARG   9   4.106 -12.623  -1.339
   79   HH22  ARG   9          2HH2      ARG   9   5.573 -13.243  -0.659
   80    H    GLY  10           H        GLY  10   1.806  -9.001  -8.128
   81    HA2  GLY  10           2HA      GLY  10  -0.408 -10.827  -7.732
   82    HA3  GLY  10           3HA      GLY  10  -0.923  -9.183  -8.082
   83    H    ASP  11           H        ASP  11  -0.849 -11.928  -9.498
   84    HA   ASP  11           HA       ASP  11   0.525 -11.699 -11.948
   85    HB2  ASP  11           2HB      ASP  11  -0.438 -13.809 -11.127
   86    HB3  ASP  11           3HB      ASP  11  -2.061 -13.147 -11.235
   87    H    ASP  12           H        ASP  12  -2.462 -10.329 -10.805
   88    HA   ASP  12           HA       ASP  12  -3.228  -9.231 -13.420
   89    HB2  ASP  12           2HB      ASP  12  -4.973 -10.275 -11.961
   90    HB3  ASP  12           3HB      ASP  12  -4.627  -9.095 -10.703
   91    H    LEU  13           H        LEU  13  -1.954  -7.506 -13.919
   92    HA   LEU  13           HA       LEU  13  -0.775  -5.707 -12.103
   93    HB2  LEU  13           2HB      LEU  13   0.028  -6.093 -14.438
   94    HB3  LEU  13           3HB      LEU  13  -1.362  -5.214 -15.044
   95    HG   LEU  13           HG       LEU  13  -0.533  -3.131 -13.964
   96   HD11  LEU  13          1HD1      LEU  13   0.654  -4.076 -12.046
   97   HD12  LEU  13          2HD1      LEU  13   1.702  -3.003 -12.968
   98   HD13  LEU  13          3HD1      LEU  13   1.888  -4.752 -13.116
   99   HD21  LEU  13          3HD2      LEU  13   1.373  -2.711 -15.445
  100   HD22  LEU  13          1HD2      LEU  13   0.110  -3.609 -16.286
  101   HD23  LEU  13          2HD2      LEU  13   1.561  -4.445 -15.725
  102    H    GLU  14           H        GLU  14  -3.972  -5.727 -13.546
  103    HA   GLU  14           HA       GLU  14  -4.741  -3.038 -13.166
  104    HB2  GLU  14           2HB      GLU  14  -6.401  -5.582 -13.034
  105    HB3  GLU  14           3HB      GLU  14  -7.105  -3.978 -12.933
  106    HG2  GLU  14           2HG      GLU  14  -5.618  -5.130 -15.298
  107    HG3  GLU  14           3HG      GLU  14  -7.360  -4.913 -15.146
  108    H    ALA  15           H        ALA  15  -4.805  -5.843 -10.992
  109    HA   ALA  15           HA       ALA  15  -6.113  -4.649  -8.794
  110    HB1  ALA  15           3HB      ALA  15  -4.176  -6.991  -8.849
  111    HB2  ALA  15           1HB      ALA  15  -5.915  -7.080  -9.132
  112    HB3  ALA  15           2HB      ALA  15  -5.304  -6.603  -7.546
  113    H    LEU  16           H        LEU  16  -2.707  -4.801  -9.749
  114    HA   LEU  16           HA       LEU  16  -1.623  -3.678  -7.341
  115    HB2  LEU  16           2HB      LEU  16  -0.430  -3.754 -10.147
  116    HB3  LEU  16           3HB      LEU  16   0.455  -3.398  -8.673
  117    HG   LEU  16           HG       LEU  16  -0.823  -6.079  -9.357
  118   HD11  LEU  16          1HD1      LEU  16   1.151  -5.605 -10.732
  119   HD12  LEU  16          2HD1      LEU  16   1.466  -6.915  -9.598
  120   HD13  LEU  16          3HD1      LEU  16   2.111  -5.302  -9.280
  121   HD21  LEU  16          3HD2      LEU  16   0.864  -5.324  -6.946
  122   HD22  LEU  16          1HD2      LEU  16   0.304  -6.948  -7.353
  123   HD23  LEU  16          2HD2      LEU  16  -0.863  -5.696  -6.939
  124    H    GLU  17           H        GLU  17  -2.639  -2.347 -10.467
  125    HA   GLU  17           HA       GLU  17  -1.872   0.360 -10.117
  126    HB2  GLU  17           2HB      GLU  17  -4.048  -0.941 -11.813
  127    HB3  GLU  17           3HB      GLU  17  -3.670   0.772 -11.913
  128    HG2  GLU  17           2HG      GLU  17  -1.529  -1.311 -12.371
  129    HG3  GLU  17           3HG      GLU  17  -2.635  -0.859 -13.651
  130    H    LYS  18           H        LYS  18  -4.832  -1.386  -9.355
  131    HA   LYS  18           HA       LYS  18  -6.412   0.868  -8.556
  132    HB2  LYS  18           2HB      LYS  18  -6.743  -2.145  -8.301
  133    HB3  LYS  18           3HB      LYS  18  -7.953  -1.017  -7.700
  134    HG2  LYS  18           2HG      LYS  18  -8.556  -0.295  -9.872
  135    HG3  LYS  18           3HG      LYS  18  -7.054  -0.884 -10.587
  136    HD2  LYS  18           2HD      LYS  18  -7.779  -3.198 -10.353
  137    HD3  LYS  18           3HD      LYS  18  -9.232  -2.712  -9.487
  138    HE2  LYS  18           2HE      LYS  18  -9.678  -3.290 -11.856
  139    HE3  LYS  18           3HE      LYS  18 -10.109  -1.621 -11.483
  140    HZ1  LYS  18           3HZ      LYS  18  -7.536  -2.402 -12.739
  141    HZ2  LYS  18           1HZ      LYS  18  -8.163  -0.843 -12.572
  142    HZ3  LYS  18           2HZ      LYS  18  -8.899  -1.947 -13.619
  143    H    ALA  19           H        ALA  19  -4.667  -1.739  -6.797
  144    HA   ALA  19           HA       ALA  19  -5.209  -0.902  -4.161
  145    HB1  ALA  19           3HB      ALA  19  -2.754  -2.369  -5.183
  146    HB2  ALA  19           1HB      ALA  19  -4.269  -3.117  -4.681
  147    HB3  ALA  19           2HB      ALA  19  -3.271  -2.269  -3.497
  148    H    LEU  20           H        LEU  20  -2.543  -0.087  -6.380
  149    HA   LEU  20           HA       LEU  20  -0.990   1.571  -4.798
  150    HB2  LEU  20           2HB      LEU  20  -0.369   0.851  -7.078
  151    HB3  LEU  20           3HB      LEU  20  -1.616   1.856  -7.776
  152    HG   LEU  20           HG       LEU  20   0.889   2.641  -7.863
  153   HD11  LEU  20          1HD1      LEU  20  -1.216   4.630  -7.027
  154   HD12  LEU  20          2HD1      LEU  20  -0.915   4.049  -8.664
  155   HD13  LEU  20          3HD1      LEU  20   0.312   5.001  -7.833
  156   HD21  LEU  20          3HD2      LEU  20   1.689   3.965  -5.997
  157   HD22  LEU  20          1HD2      LEU  20   1.370   2.317  -5.464
  158   HD23  LEU  20          2HD2      LEU  20   0.233   3.611  -5.068
  159    H    LYS  21           H        LYS  21  -3.694   2.556  -6.920
  160    HA   LYS  21           HA       LYS  21  -3.642   5.292  -6.373
  161    HB2  LYS  21           2HB      LYS  21  -4.847   4.286  -8.281
  162    HB3  LYS  21           3HB      LYS  21  -5.984   3.526  -7.175
  163    HG2  LYS  21           2HG      LYS  21  -6.732   5.812  -6.447
  164    HG3  LYS  21           3HG      LYS  21  -5.668   6.504  -7.671
  165    HD2  LYS  21           2HD      LYS  21  -7.833   6.489  -8.651
  166    HD3  LYS  21           3HD      LYS  21  -6.984   5.138  -9.400
  167    HE2  LYS  21           2HE      LYS  21  -8.971   4.928  -7.113
  168    HE3  LYS  21           3HE      LYS  21  -9.316   4.575  -8.800
  169    HZ1  LYS  21           3HZ      LYS  21  -7.570   2.819  -8.640
  170    HZ2  LYS  21           1HZ      LYS  21  -8.960   2.546  -7.724
  171    HZ3  LYS  21           2HZ      LYS  21  -7.547   3.074  -6.966
  172    H    GLU  22           H        GLU  22  -5.317   2.626  -4.746
  173    HA   GLU  22           HA       GLU  22  -6.825   4.279  -2.957
  174    HB2  GLU  22           2HB      GLU  22  -6.235   1.295  -2.843
  175    HB3  GLU  22           3HB      GLU  22  -7.353   2.136  -1.776
  176    HG2  GLU  22           2HG      GLU  22  -7.623   1.763  -4.766
  177    HG3  GLU  22           3HG      GLU  22  -8.602   1.017  -3.507
  178    H    MET  23           H        MET  23  -3.708   2.548  -2.684
  179    HA   MET  23           HA       MET  23  -3.246   3.100   0.058
  180    HB2  MET  23           2HB      MET  23  -1.349   2.533  -2.244
  181    HB3  MET  23           3HB      MET  23  -0.761   2.817  -0.613
  182    HG2  MET  23           2HG      MET  23  -2.833   0.698  -0.913
  183    HG3  MET  23           3HG      MET  23  -1.245   0.367  -1.586
  184    HE1  MET  23           3HE      MET  23  -2.063   1.044   2.923
  185    HE2  MET  23           1HE      MET  23  -3.333   0.885   1.711
  186    HE3  MET  23           2HE      MET  23  -2.323   2.333   1.749
  187    H    ILE  24           H        ILE  24  -2.535   4.964  -2.886
  188    HA   ILE  24           HA       ILE  24  -1.225   7.155  -1.667
  189    HB   ILE  24           HB       ILE  24  -2.986   7.098  -4.174
  190   HG12  ILE  24          2HG1      ILE  24   0.048   6.930  -3.841
  191   HG13  ILE  24          3HG1      ILE  24  -1.016   5.675  -4.463
  192   HG21  ILE  24          1HG2      ILE  24  -1.108   9.308  -3.265
  193   HG22  ILE  24          2HG2      ILE  24  -2.869   9.392  -3.299
  194   HG23  ILE  24          3HG2      ILE  24  -1.966   9.258  -4.806
  195   HD11  ILE  24          3HD1      ILE  24  -1.512   7.102  -6.414
  196   HD12  ILE  24          1HD1      ILE  24   0.196   6.691  -6.267
  197   HD13  ILE  24          2HD1      ILE  24  -0.363   8.296  -5.803
  198    H    ARG  25           H        ARG  25  -4.633   6.504  -2.402
  199    HA   ARG  25           HA       ARG  25  -5.873   8.791  -1.427
  200    HB2  ARG  25           2HB      ARG  25  -6.980   7.056  -2.788
  201    HB3  ARG  25           3HB      ARG  25  -6.866   5.911  -1.460
  202    HG2  ARG  25           2HG      ARG  25  -8.424   7.311  -0.129
  203    HG3  ARG  25           3HG      ARG  25  -8.549   8.437  -1.483
  204    HD2  ARG  25           2HD      ARG  25  -9.446   6.593  -2.902
  205    HD3  ARG  25           3HD      ARG  25  -9.384   5.512  -1.505
  206    HE   ARG  25           HE       ARG  25 -10.906   7.897  -1.020
  207   HH11  ARG  25          1HH1      ARG  25 -11.118   4.668  -2.449
  208   HH12  ARG  25          2HH1      ARG  25 -12.840   4.565  -2.251
  209   HH21  ARG  25          1HH2      ARG  25 -13.169   7.746  -0.777
  210   HH22  ARG  25          2HH2      ARG  25 -14.002   6.317  -1.300
  211    H    GLN  26           H        GLN  26  -4.923   5.830   0.356
  212    HA   GLN  26           HA       GLN  26  -6.103   6.651   2.851
  213    HB2  GLN  26           2HB      GLN  26  -3.892   4.574   2.618
  214    HB3  GLN  26           3HB      GLN  26  -5.103   4.721   3.876
  215    HG2  GLN  26           2HG      GLN  26  -5.411   3.616   1.091
  216    HG3  GLN  26           3HG      GLN  26  -5.719   2.820   2.623
  217   HE21  GLN  26          1HE2      GLN  26  -7.428   3.136   0.222
  218   HE22  GLN  26          2HE2      GLN  26  -8.893   3.851   0.794
  219    H    ALA  27           H        ALA  27  -2.831   6.743   1.455
  220    HA   ALA  27           HA       ALA  27  -1.456   7.784   3.713
  221    HB1  ALA  27           3HB      ALA  27   0.345   8.336   2.122
  222    HB2  ALA  27           1HB      ALA  27  -0.757   8.063   0.762
  223    HB3  ALA  27           2HB      ALA  27  -0.293   6.725   1.810
  224    H    ARG  28           H        ARG  28  -3.432   9.287   1.250
  225    HA   ARG  28           HA       ARG  28  -2.604  12.010   1.812
  226    HB2  ARG  28           2HB      ARG  28  -4.862  10.911   0.081
  227    HB3  ARG  28           3HB      ARG  28  -4.485  12.626   0.234
  228    HG2  ARG  28           2HG      ARG  28  -2.191  12.150  -0.691
  229    HG3  ARG  28           3HG      ARG  28  -2.686  10.483  -0.934
  230    HD2  ARG  28           2HD      ARG  28  -3.987  12.898  -2.234
  231    HD3  ARG  28           3HD      ARG  28  -2.854  11.791  -3.014
  232    HE   ARG  28           HE       ARG  28  -5.209  10.515  -1.915
  233   HH11  ARG  28          1HH1      ARG  28  -3.896  12.067  -4.796
  234   HH12  ARG  28          2HH1      ARG  28  -5.030  11.309  -5.864
  235   HH21  ARG  28          1HH2      ARG  28  -6.717   9.575  -3.314
  236   HH22  ARG  28          2HH2      ARG  28  -6.642   9.887  -5.018
  237    H    LYS  29           H        LYS  29  -5.354   9.894   2.751
  238    HA   LYS  29           HA       LYS  29  -6.791  11.982   4.122
  239    HB2  LYS  29           2HB      LYS  29  -8.267  10.324   4.976
  240    HB3  LYS  29           3HB      LYS  29  -7.802   9.730   3.391
  241    HG2  LYS  29           2HG      LYS  29  -6.139   8.228   4.512
  242    HG3  LYS  29           3HG      LYS  29  -6.768   8.758   6.069
  243    HD2  LYS  29           2HD      LYS  29  -9.009   7.839   5.444
  244    HD3  LYS  29           3HD      LYS  29  -8.333   7.279   3.910
  245    HE2  LYS  29           2HE      LYS  29  -6.724   5.852   5.194
  246    HE3  LYS  29           3HE      LYS  29  -7.518   6.346   6.688
  247    HZ1  LYS  29           3HZ      LYS  29  -8.261   4.172   5.796
  248    HZ2  LYS  29           1HZ      LYS  29  -8.906   4.971   4.455
  249    HZ3  LYS  29           2HZ      LYS  29  -9.523   5.278   5.994
  250    H    PHE  30           H        PHE  30  -4.225   9.753   4.998
  251    HA   PHE  30           HA       PHE  30  -4.066  10.594   7.774
  252    HB2  PHE  30           2HB      PHE  30  -2.256   8.867   6.035
  253    HB3  PHE  30           3HB      PHE  30  -1.928   9.203   7.731
  254    HD1  PHE  30           HD1      PHE  30  -4.492   8.890   9.069
  255    HD2  PHE  30           HD2      PHE  30  -2.849   6.592   5.859
  256    HE1  PHE  30           HE1      PHE  30  -5.809   6.940   9.772
  257    HE2  PHE  30           HE2      PHE  30  -4.185   4.650   6.564
  258    HZ   PHE  30           HZ       PHE  30  -5.668   4.824   8.523
  259    H    ALA  31           H        ALA  31  -3.162  11.970   4.852
  260    HA   ALA  31           HA       ALA  31  -2.260  13.962   4.346
  261    HB1  ALA  31           3HB      ALA  31  -1.775  15.614   6.083
  262    HB2  ALA  31           1HB      ALA  31  -1.816  14.355   7.324
  263    HB3  ALA  31           2HB      ALA  31  -3.286  14.778   6.444
  264    H    GLY  32           H        GLY  32  -0.575  11.422   5.032
  265    HA2  GLY  32           2HA      GLY  32   2.103  12.500   5.452
  266    HA3  GLY  32           3HA      GLY  32   1.650  10.817   5.228
  267    H    THR  33           H        THR  33   3.649  10.949   3.899
  268    HA   THR  33           HA       THR  33   3.342  12.058   1.180
  269    HB   THR  33           HB       THR  33   5.851  10.972   2.584
  270    HG1  THR  33           HG1      THR  33   4.598  13.314   2.933
  271   HG21  THR  33          3HG2      THR  33   6.033  10.898   0.122
  272   HG22  THR  33          1HG2      THR  33   7.098  12.141   0.786
  273   HG23  THR  33          2HG2      THR  33   5.573  12.600   0.025
  274    H    VAL  34           H        VAL  34   3.618  10.573  -0.594
  275    HA   VAL  34           HA       VAL  34   3.815   7.703   0.028
  276    HB   VAL  34           HB       VAL  34   1.403   8.292  -0.193
  277   HG11  VAL  34          1HG1      VAL  34   2.052   9.122  -3.032
  278   HG12  VAL  34          2HG1      VAL  34   1.536  10.184  -1.721
  279   HG13  VAL  34          3HG1      VAL  34   0.431   8.959  -2.349
  280   HG21  VAL  34          3HG2      VAL  34   2.430   6.525  -2.439
  281   HG22  VAL  34          1HG2      VAL  34   0.774   6.543  -1.817
  282   HG23  VAL  34          2HG2      VAL  34   2.105   6.029  -0.776
  283    H    THR  35           H        THR  35   4.884   6.525  -1.470
  284    HA   THR  35           HA       THR  35   5.812   7.664  -4.031
  285    HB   THR  35           HB       THR  35   7.664   6.318  -1.983
  286    HG1  THR  35           HG1      THR  35   7.076   9.015  -2.481
  287   HG21  THR  35          3HG2      THR  35   8.345   7.709  -4.604
  288   HG22  THR  35          1HG2      THR  35   8.416   5.968  -4.315
  289   HG23  THR  35          2HG2      THR  35   9.508   7.052  -3.451
  290    H    TYR  36           H        TYR  36   6.454   5.861  -5.537
  291    HA   TYR  36           HA       TYR  36   6.218   3.134  -4.574
  292    HB2  TYR  36           2HB      TYR  36   4.460   2.392  -6.063
  293    HB3  TYR  36           3HB      TYR  36   3.846   3.710  -5.078
  294    HD1  TYR  36           HD2      TYR  36   3.732   6.078  -6.179
  295    HD2  TYR  36           HD1      TYR  36   4.274   2.485  -8.441
  296    HE1  TYR  36           HE2      TYR  36   2.939   7.233  -8.200
  297    HE2  TYR  36           HE1      TYR  36   3.486   3.647 -10.454
  298    HH   TYR  36           HH       TYR  36   3.247   6.947 -10.722
  299    H    THR  37           H        THR  37   6.810   1.522  -6.110
  300    HA   THR  37           HA       THR  37   7.958   2.369  -8.696
  301    HB   THR  37           HB       THR  37   9.193   0.325  -6.785
  302    HG1  THR  37           HG1      THR  37  10.093   2.889  -7.663
  303   HG21  THR  37          3HG2      THR  37  11.047   0.171  -8.436
  304   HG22  THR  37          1HG2      THR  37  10.145   1.203  -9.541
  305   HG23  THR  37          2HG2      THR  37   9.523  -0.395  -9.121
  306    H    LEU  38           H        LEU  38   6.959   1.301 -10.314
  307    HA   LEU  38           HA       LEU  38   5.688  -1.335  -9.830
  308    HB2  LEU  38           2HB      LEU  38   4.990   0.959 -11.689
  309    HB3  LEU  38           3HB      LEU  38   4.440  -0.667 -12.065
  310    HG   LEU  38           HG       LEU  38   3.808   0.695  -9.422
  311   HD11  LEU  38          1HD1      LEU  38   2.845   2.027 -11.228
  312   HD12  LEU  38          2HD1      LEU  38   1.600   1.203 -10.295
  313   HD13  LEU  38          3HD1      LEU  38   2.054   0.590 -11.889
  314   HD21  LEU  38          3HD2      LEU  38   2.067  -1.021  -9.262
  315   HD22  LEU  38          1HD2      LEU  38   3.675  -1.735  -9.378
  316   HD23  LEU  38          2HD2      LEU  38   2.606  -1.731 -10.788
  317    H    ASP  39           H        ASP  39   6.751  -2.995 -10.668
  318    HA   ASP  39           HA       ASP  39   7.863  -2.865 -13.355
  319    HB2  ASP  39           2HB      ASP  39   9.777  -2.215 -11.858
  320    HB3  ASP  39           3HB      ASP  39   9.593  -3.729 -10.988
  321    H    GLY  40           H        GLY  40   6.688  -4.442 -14.214
  322    HA2  GLY  40           2HA      GLY  40   5.953  -6.544 -14.737
  323    HA3  GLY  40           3HA      GLY  40   7.026  -7.177 -13.498
  324    H    ASN  41           H        ASN  41   5.819  -8.457 -12.192
  325    HA   ASN  41           HA       ASN  41   3.043  -7.697 -11.520
  326    HB2  ASN  41           2HB      ASN  41   4.471 -10.378 -11.273
  327    HB3  ASN  41           3HB      ASN  41   2.808 -10.081 -10.770
  328   HD21  ASN  41          1HD2      ASN  41   1.248  -9.491 -12.444
  329   HD22  ASN  41          2HD2      ASN  41   1.478 -10.075 -14.057
  330    H    ASP  42           H        ASP  42   5.416  -6.421 -10.235
  331    HA   ASP  42           HA       ASP  42   4.293  -6.691  -7.548
  332    HB2  ASP  42           2HB      ASP  42   6.453  -6.682  -6.381
  333    HB3  ASP  42           3HB      ASP  42   6.288  -8.106  -7.393
  334    H    LEU  43           H        LEU  43   4.345  -4.973  -6.342
  335    HA   LEU  43           HA       LEU  43   5.107  -2.320  -7.393
  336    HB2  LEU  43           2HB      LEU  43   2.711  -2.564  -7.575
  337    HB3  LEU  43           3HB      LEU  43   2.592  -3.365  -6.020
  338    HG   LEU  43           HG       LEU  43   3.030  -1.234  -4.858
  339   HD11  LEU  43          1HD1      LEU  43   3.102   0.904  -6.024
  340   HD12  LEU  43          2HD1      LEU  43   3.079   0.080  -7.581
  341   HD13  LEU  43          3HD1      LEU  43   4.459  -0.116  -6.500
  342   HD21  LEU  43          3HD2      LEU  43   0.897  -0.143  -5.395
  343   HD22  LEU  43          1HD2      LEU  43   0.735  -1.898  -5.334
  344   HD23  LEU  43          2HD2      LEU  43   0.793  -1.071  -6.894
  345    H    GLU  44           H        GLU  44   6.355  -1.158  -5.910
  346    HA   GLU  44           HA       GLU  44   6.326  -1.984  -3.055
  347    HB2  GLU  44           2HB      GLU  44   8.426  -2.699  -4.198
  348    HB3  GLU  44           3HB      GLU  44   8.757  -1.021  -4.626
  349    HG2  GLU  44           2HG      GLU  44   8.947  -0.417  -2.249
  350    HG3  GLU  44           3HG      GLU  44   8.516  -2.062  -1.775
  351    H    ILE  45           H        ILE  45   5.108  -0.472  -2.214
  352    HA   ILE  45           HA       ILE  45   5.258   2.371  -2.931
  353    HB   ILE  45           HB       ILE  45   3.411   0.877  -0.997
  354   HG12  ILE  45          2HG1      ILE  45   2.883   1.832  -3.842
  355   HG13  ILE  45          3HG1      ILE  45   3.139   0.161  -3.356
  356   HG21  ILE  45          1HG2      ILE  45   3.592   3.256  -0.397
  357   HG22  ILE  45          2HG2      ILE  45   1.987   2.891  -1.031
  358   HG23  ILE  45          3HG2      ILE  45   3.169   3.718  -2.048
  359   HD11  ILE  45          3HD1      ILE  45   0.826   1.908  -2.544
  360   HD12  ILE  45          1HD1      ILE  45   1.095   0.242  -2.022
  361   HD13  ILE  45          2HD1      ILE  45   0.812   0.599  -3.724
  362    H    ARG  46           H        ARG  46   6.191   3.880  -1.578
  363    HA   ARG  46           HA       ARG  46   7.204   3.039   1.079
  364    HB2  ARG  46           2HB      ARG  46   8.499   5.070  -0.801
  365    HB3  ARG  46           3HB      ARG  46   9.183   4.406   0.684
  366    HG2  ARG  46           2HG      ARG  46   9.376   2.196  -0.345
  367    HG3  ARG  46           3HG      ARG  46   8.563   2.777  -1.798
  368    HD2  ARG  46           2HD      ARG  46  10.493   4.392  -2.119
  369    HD3  ARG  46           3HD      ARG  46  11.321   3.549  -0.802
  370    HE   ARG  46           HE       ARG  46  11.470   1.607  -2.136
  371   HH11  ARG  46          1HH1      ARG  46  10.046   4.277  -3.940
  372   HH12  ARG  46          2HH1      ARG  46  10.305   3.523  -5.481
  373   HH21  ARG  46          1HH2      ARG  46  11.746   0.621  -4.161
  374   HH22  ARG  46          2HH2      ARG  46  11.265   1.464  -5.604
  375    H    ILE  47           H        ILE  47   5.666   3.879   2.354
  376    HA   ILE  47           HA       ILE  47   4.618   6.602   1.912
  377    HB   ILE  47           HB       ILE  47   3.601   4.407   3.781
  378   HG12  ILE  47          2HG1      ILE  47   2.511   5.454   1.128
  379   HG13  ILE  47          3HG1      ILE  47   3.231   3.876   1.401
  380   HG21  ILE  47          1HG2      ILE  47   1.637   5.857   4.172
  381   HG22  ILE  47          2HG2      ILE  47   2.371   7.126   3.191
  382   HG23  ILE  47          3HG2      ILE  47   3.123   6.644   4.712
  383   HD11  ILE  47          3HD1      ILE  47   0.848   3.700   1.219
  384   HD12  ILE  47          1HD1      ILE  47   0.616   4.855   2.531
  385   HD13  ILE  47          2HD1      ILE  47   1.351   3.282   2.856
  386    H    THR  48           H        THR  48   5.511   8.189   3.003
  387    HA   THR  48           HA       THR  48   7.153   7.690   5.422
  388    HB   THR  48           HB       THR  48   7.688   9.789   3.259
  389    HG1  THR  48           HG1      THR  48   8.422   7.082   3.373
  390   HG21  THR  48          3HG2      THR  48   9.966   9.866   4.214
  391   HG22  THR  48          1HG2      THR  48   9.517   8.660   5.416
  392   HG23  THR  48          2HG2      THR  48   8.764  10.257   5.448
  393    H    GLY  49           H        GLY  49   7.256   9.631   6.868
  394    HA2  GLY  49           2HA      GLY  49   6.622  11.675   7.738
  395    HA3  GLY  49           3HA      GLY  49   5.668  11.990   6.301
  396    H    VAL  50           H        VAL  50   4.610   9.053   7.282
  397    HA   VAL  50           HA       VAL  50   2.371  10.099   8.825
  398    HB   VAL  50           HB       VAL  50   1.468   7.759   8.709
  399   HG11  VAL  50          1HG1      VAL  50   0.900   7.792   6.307
  400   HG12  VAL  50          2HG1      VAL  50   2.192   8.959   6.013
  401   HG13  VAL  50          3HG1      VAL  50   0.813   9.406   7.018
  402   HG21  VAL  50          3HG2      VAL  50   3.886   7.153   6.965
  403   HG22  VAL  50          1HG2      VAL  50   2.496   6.087   7.214
  404   HG23  VAL  50          2HG2      VAL  50   3.561   6.482   8.565
  405    HA   PRO  51           HA       PRO  51   4.259   9.310  12.904
  406    HB2  PRO  51           2HB      PRO  51   1.372   8.631  13.527
  407    HB3  PRO  51           3HB      PRO  51   2.520   9.629  14.455
  408    HG2  PRO  51           2HG      PRO  51   0.668  10.795  12.990
  409    HG3  PRO  51           3HG      PRO  51   2.324  11.448  12.994
  410    HD2  PRO  51           2HD      PRO  51   0.927   9.847  10.867
  411    HD3  PRO  51           3HD      PRO  51   2.118  11.156  10.693
  412    H    GLU  52           H        GLU  52   4.520   7.591  14.469
  413    HA   GLU  52           HA       GLU  52   4.982   5.053  13.426
  414    HB2  GLU  52           2HB      GLU  52   6.145   5.907  15.405
  415    HB3  GLU  52           3HB      GLU  52   4.639   5.956  16.315
  416    HG2  GLU  52           2HG      GLU  52   6.011   4.056  17.010
  417    HG3  GLU  52           3HG      GLU  52   4.515   3.495  16.260
  418    H    GLN  53           H        GLN  53   2.205   6.276  15.290
  419    HA   GLN  53           HA       GLN  53   0.848   3.775  15.580
  420    HB2  GLN  53           2HB      GLN  53  -1.127   5.099  16.216
  421    HB3  GLN  53           3HB      GLN  53   0.308   5.722  17.022
  422    HG2  GLN  53           2HG      GLN  53   0.379   7.667  15.669
  423    HG3  GLN  53           3HG      GLN  53  -0.698   6.976  14.459
  424   HE21  GLN  53          1HE2      GLN  53  -2.943   6.964  14.854
  425   HE22  GLN  53          2HE2      GLN  53  -3.660   7.950  16.078
  426    H    VAL  54           H        VAL  54   0.927   6.251  13.116
  427    HA   VAL  54           HA       VAL  54  -1.381   5.324  11.667
  428    HB   VAL  54           HB       VAL  54   0.692   7.449  10.974
  429   HG11  VAL  54          1HG1      VAL  54  -0.924   8.247   9.273
  430   HG12  VAL  54          2HG1      VAL  54  -1.945   6.844   9.598
  431   HG13  VAL  54          3HG1      VAL  54  -0.335   6.622   8.913
  432   HG21  VAL  54          3HG2      VAL  54  -1.085   9.071  11.578
  433   HG22  VAL  54          1HG2      VAL  54  -0.635   8.052  12.947
  434   HG23  VAL  54          2HG2      VAL  54  -2.132   7.736  12.068
  435    H    ARG  55           H        ARG  55   2.114   4.776  11.503
  436    HA   ARG  55           HA       ARG  55   2.261   3.593   8.932
  437    HB2  ARG  55           2HB      ARG  55   3.859   2.764  11.405
  438    HB3  ARG  55           3HB      ARG  55   4.258   2.373   9.738
  439    HG2  ARG  55           2HG      ARG  55   4.470   4.911   9.364
  440    HG3  ARG  55           3HG      ARG  55   4.421   5.050  11.120
  441    HD2  ARG  55           2HD      ARG  55   6.498   3.622   9.435
  442    HD3  ARG  55           3HD      ARG  55   6.730   5.038  10.460
  443    HE   ARG  55           HE       ARG  55   5.993   3.248  12.294
  444   HH11  ARG  55          1HH1      ARG  55   8.289   2.846   9.642
  445   HH12  ARG  55          2HH1      ARG  55   9.251   1.679  10.490
  446   HH21  ARG  55          1HH2      ARG  55   7.298   1.723  13.401
  447   HH22  ARG  55          2HH2      ARG  55   8.690   1.046  12.609
  448    H    LYS  56           H        LYS  56   1.489   2.315  12.131
  449    HA   LYS  56           HA       LYS  56   1.017  -0.382  11.405
  450    HB2  LYS  56           2HB      LYS  56  -0.152   1.169  13.745
  451    HB3  LYS  56           3HB      LYS  56  -0.016  -0.581  13.618
  452    HG2  LYS  56           2HG      LYS  56   2.433  -0.427  13.695
  453    HG3  LYS  56           3HG      LYS  56   2.336   1.335  13.731
  454    HD2  LYS  56           2HD      LYS  56   1.124   1.208  15.903
  455    HD3  LYS  56           3HD      LYS  56   1.262  -0.553  15.868
  456    HE2  LYS  56           2HE      LYS  56   3.706  -0.381  15.969
  457    HE3  LYS  56           3HE      LYS  56   3.601   1.382  15.937
  458    HZ1  LYS  56           3HZ      LYS  56   2.461  -0.350  18.071
  459    HZ2  LYS  56           1HZ      LYS  56   2.446   1.340  18.043
  460    HZ3  LYS  56           2HZ      LYS  56   3.910   0.511  18.188
  461    H    GLU  57           H        GLU  57  -1.001   2.500  11.281
  462    HA   GLU  57           HA       GLU  57  -3.510   1.182  10.832
  463    HB2  GLU  57           2HB      GLU  57  -2.590   4.039  10.298
  464    HB3  GLU  57           3HB      GLU  57  -4.244   3.495  10.025
  465    HG2  GLU  57           2HG      GLU  57  -4.485   2.937  12.406
  466    HG3  GLU  57           3HG      GLU  57  -2.803   3.379  12.687
  467    H    LEU  58           H        LEU  58  -1.020   2.588   8.660
  468    HA   LEU  58           HA       LEU  58  -2.270   1.939   6.207
  469    HB2  LEU  58           2HB      LEU  58   0.603   2.525   6.946
  470    HB3  LEU  58           3HB      LEU  58   0.266   1.859   5.363
  471    HG   LEU  58           HG       LEU  58   0.429   4.156   4.975
  472   HD11  LEU  58          1HD1      LEU  58  -1.529   3.244   3.864
  473   HD12  LEU  58          2HD1      LEU  58  -1.778   4.937   4.277
  474   HD13  LEU  58          3HD1      LEU  58  -2.552   3.673   5.239
  475   HD21  LEU  58          3HD2      LEU  58   0.455   4.951   7.266
  476   HD22  LEU  58          1HD2      LEU  58  -1.294   4.739   7.394
  477   HD23  LEU  58          2HD2      LEU  58  -0.622   5.936   6.279
  478    H    ALA  59           H        ALA  59  -0.574  -0.040   8.504
  479    HA   ALA  59           HA       ALA  59  -0.001  -2.272   6.878
  480    HB1  ALA  59           3HB      ALA  59   0.943  -1.956   9.127
  481    HB2  ALA  59           1HB      ALA  59   0.143  -3.520   8.981
  482    HB3  ALA  59           2HB      ALA  59  -0.650  -2.201   9.845
  483    H    LYS  60           H        LYS  60  -2.906  -1.433   8.814
  484    HA   LYS  60           HA       LYS  60  -4.384  -3.777   8.010
  485    HB2  LYS  60           2HB      LYS  60  -5.202  -1.242   9.451
  486    HB3  LYS  60           3HB      LYS  60  -6.420  -2.375   8.886
  487    HG2  LYS  60           2HG      LYS  60  -6.157  -3.087  11.067
  488    HG3  LYS  60           3HG      LYS  60  -5.019  -4.151  10.243
  489    HD2  LYS  60           2HD      LYS  60  -3.929  -3.364  12.221
  490    HD3  LYS  60           3HD      LYS  60  -3.187  -2.495  10.875
  491    HE2  LYS  60           2HE      LYS  60  -4.473  -0.494  11.387
  492    HE3  LYS  60           3HE      LYS  60  -5.419  -1.354  12.607
  493    HZ1  LYS  60           3HZ      LYS  60  -3.657   0.020  13.578
  494    HZ2  LYS  60           1HZ      LYS  60  -2.489  -0.885  12.757
  495    HZ3  LYS  60           2HZ      LYS  60  -3.445  -1.619  13.941
  496    H    GLU  61           H        GLU  61  -3.967  -0.542   6.707
  497    HA   GLU  61           HA       GLU  61  -6.109  -0.672   4.808
  498    HB2  GLU  61           2HB      GLU  61  -3.578   1.024   4.726
  499    HB3  GLU  61           3HB      GLU  61  -4.994   1.256   3.709
  500    HG2  GLU  61           2HG      GLU  61  -4.846   1.605   6.711
  501    HG3  GLU  61           3HG      GLU  61  -4.987   2.885   5.512
  502    H    ALA  62           H        ALA  62  -2.696  -1.574   4.794
  503    HA   ALA  62           HA       ALA  62  -2.400  -2.415   2.128
  504    HB1  ALA  62           3HB      ALA  62  -1.052  -3.507   4.629
  505    HB2  ALA  62           1HB      ALA  62  -0.524  -2.099   3.706
  506    HB3  ALA  62           2HB      ALA  62  -0.481  -3.699   2.969
  507    H    GLU  63           H        GLU  63  -3.454  -4.170   5.051
  508    HA   GLU  63           HA       GLU  63  -3.741  -6.738   3.905
  509    HB2  GLU  63           2HB      GLU  63  -5.078  -5.523   6.354
  510    HB3  GLU  63           3HB      GLU  63  -5.150  -7.230   5.934
  511    HG2  GLU  63           2HG      GLU  63  -2.659  -7.346   6.139
  512    HG3  GLU  63           3HG      GLU  63  -2.663  -5.666   6.670
  513    H    ARG  64           H        ARG  64  -6.106  -4.077   4.340
  514    HA   ARG  64           HA       ARG  64  -8.372  -5.628   3.560
  515    HB2  ARG  64           2HB      ARG  64  -9.650  -3.549   3.516
  516    HB3  ARG  64           3HB      ARG  64  -8.640  -3.599   4.954
  517    HG2  ARG  64           2HG      ARG  64  -7.027  -2.081   3.851
  518    HG3  ARG  64           3HG      ARG  64  -8.079  -2.003   2.442
  519    HD2  ARG  64           2HD      ARG  64  -8.948  -1.132   5.217
  520    HD3  ARG  64           3HD      ARG  64  -8.219  -0.040   4.042
  521    HE   ARG  64           HE       ARG  64 -10.707  -1.508   3.417
  522   HH11  ARG  64          1HH1      ARG  64  -9.000   1.579   3.761
  523   HH12  ARG  64          2HH1      ARG  64 -10.311   2.502   3.091
  524   HH21  ARG  64          1HH2      ARG  64 -12.420  -0.269   2.595
  525   HH22  ARG  64          2HH2      ARG  64 -12.253   1.451   2.431
  526    H    LEU  65           H        LEU  65  -6.109  -3.517   1.788
  527    HA   LEU  65           HA       LEU  65  -7.563  -3.720  -0.710
  528    HB2  LEU  65           2HB      LEU  65  -4.711  -2.806  -0.175
  529    HB3  LEU  65           3HB      LEU  65  -5.576  -2.601  -1.693
  530    HG   LEU  65           HG       LEU  65  -6.305  -1.303   0.961
  531   HD11  LEU  65          1HD1      LEU  65  -5.699   0.815  -0.124
  532   HD12  LEU  65          2HD1      LEU  65  -5.162  -0.069  -1.557
  533   HD13  LEU  65          3HD1      LEU  65  -4.332  -0.293  -0.013
  534   HD21  LEU  65          3HD2      LEU  65  -8.034  -0.066  -0.272
  535   HD22  LEU  65          1HD2      LEU  65  -8.338  -1.802  -0.280
  536   HD23  LEU  65          2HD2      LEU  65  -7.690  -1.013  -1.720
  537    H    ALA  66           H        ALA  66  -5.110  -5.604   0.891
  538    HA   ALA  66           HA       ALA  66  -4.219  -7.159  -1.310
  539    HB1  ALA  66           3HB      ALA  66  -3.020  -7.077   0.840
  540    HB2  ALA  66           1HB      ALA  66  -3.394  -8.739   0.379
  541    HB3  ALA  66           2HB      ALA  66  -4.351  -7.930   1.625
  542    H    LYS  67           H        LYS  67  -6.869  -7.666   1.058
  543    HA   LYS  67           HA       LYS  67  -7.742 -10.139  -0.183
  544    HB2  LYS  67           2HB      LYS  67  -9.547 -10.152   1.470
  545    HB3  LYS  67           3HB      LYS  67  -8.008  -9.816   2.247
  546    HG2  LYS  67           2HG      LYS  67  -8.600  -7.404   2.341
  547    HG3  LYS  67           3HG      LYS  67 -10.162  -7.772   1.613
  548    HD2  LYS  67           2HD      LYS  67  -9.169  -8.784   4.311
  549    HD3  LYS  67           3HD      LYS  67 -10.358  -7.507   4.053
  550    HE2  LYS  67           2HE      LYS  67 -10.719 -10.403   3.209
  551    HE3  LYS  67           3HE      LYS  67 -11.408  -9.668   4.656
  552    HZ1  LYS  67           3HZ      LYS  67 -11.988  -8.805   1.874
  553    HZ2  LYS  67           1HZ      LYS  67 -12.667  -8.162   3.280
  554    HZ3  LYS  67           2HZ      LYS  67 -12.999  -9.755   2.832
  555    H    GLU  68           H        GLU  68  -8.526  -6.761  -0.509
  556    HA   GLU  68           HA       GLU  68 -11.102  -6.966  -1.719
  557    HB2  GLU  68           2HB      GLU  68 -10.231  -4.878  -0.711
  558    HB3  GLU  68           3HB      GLU  68  -8.960  -4.802  -1.922
  559    HG2  GLU  68           2HG      GLU  68 -10.643  -3.199  -2.507
  560    HG3  GLU  68           3HG      GLU  68 -10.728  -4.514  -3.675
  561    H    PHE  69           H        PHE  69  -7.852  -6.448  -3.048
  562    HA   PHE  69           HA       PHE  69  -8.798  -6.792  -5.805
  563    HB2  PHE  69           2HB      PHE  69  -6.100  -5.863  -4.726
  564    HB3  PHE  69           3HB      PHE  69  -6.581  -5.856  -6.421
  565    HD1  PHE  69           HD1      PHE  69  -8.918  -4.554  -6.866
  566    HD2  PHE  69           HD2      PHE  69  -6.296  -3.816  -3.577
  567    HE1  PHE  69           HE1      PHE  69  -9.880  -2.314  -6.588
  568    HE2  PHE  69           HE2      PHE  69  -7.266  -1.573  -3.309
  569    HZ   PHE  69           HZ       PHE  69  -9.061  -0.816  -4.814
  570    H    ASN  70           H        ASN  70  -7.707  -8.787  -3.431
  571    HA   ASN  70           HA       ASN  70  -7.013 -10.917  -3.305
  572    HB2  ASN  70           2HB      ASN  70  -8.910 -11.174  -4.978
  573    HB3  ASN  70           3HB      ASN  70  -7.713 -11.145  -6.267
  574   HD21  ASN  70          1HD2      ASN  70  -6.334 -12.970  -6.532
  575   HD22  ASN  70          2HD2      ASN  70  -6.695 -14.493  -5.795
  576    H    ILE  71           H        ILE  71  -4.976  -9.405  -3.283
  577    HA   ILE  71           HA       ILE  71  -2.871 -10.733  -4.880
  578    HB   ILE  71           HB       ILE  71  -1.610  -8.504  -4.865
  579   HG12  ILE  71          2HG1      ILE  71  -4.345  -7.417  -4.044
  580   HG13  ILE  71          3HG1      ILE  71  -2.856  -7.316  -3.115
  581   HG21  ILE  71          1HG2      ILE  71  -4.184  -8.538  -6.479
  582   HG22  ILE  71          2HG2      ILE  71  -2.680  -9.347  -6.919
  583   HG23  ILE  71          3HG2      ILE  71  -2.741  -7.586  -6.846
  584   HD11  ILE  71          3HD1      ILE  71  -3.371  -5.188  -4.093
  585   HD12  ILE  71          1HD1      ILE  71  -3.454  -5.892  -5.709
  586   HD13  ILE  71          2HD1      ILE  71  -1.913  -5.828  -4.847
  587    H    THR  72           H        THR  72  -0.731 -10.641  -3.813
  588    HA   THR  72           HA       THR  72  -0.922 -11.026  -0.930
  589    HB   THR  72           HB       THR  72   1.565 -11.664  -1.216
  590    HG1  THR  72           HG1      THR  72   1.250 -10.565  -3.559
  591   HG21  THR  72          3HG2      THR  72  -0.224 -13.391  -1.117
  592   HG22  THR  72          1HG2      THR  72   1.086 -13.857  -2.201
  593   HG23  THR  72          2HG2      THR  72  -0.437 -13.263  -2.867
  594    H    VAL  73           H        VAL  73   0.342  -9.890   0.574
  595    HA   VAL  73           HA       VAL  73   1.759  -7.460  -0.316
  596    HB   VAL  73           HB       VAL  73  -0.575  -6.830   0.375
  597   HG11  VAL  73          1HG1      VAL  73  -1.243  -6.866   2.742
  598   HG12  VAL  73          2HG1      VAL  73   0.220  -7.767   3.149
  599   HG13  VAL  73          3HG1      VAL  73  -1.002  -8.496   2.105
  600   HG21  VAL  73          3HG2      VAL  73   0.070  -4.919   1.772
  601   HG22  VAL  73          1HG2      VAL  73   1.257  -5.204   0.499
  602   HG23  VAL  73          2HG2      VAL  73   1.607  -5.698   2.158
  603    H    THR  74           H        THR  74   3.420  -6.797   1.047
  604    HA   THR  74           HA       THR  74   3.924  -8.127   3.583
  605    HB   THR  74           HB       THR  74   5.132  -9.617   2.053
  606    HG1  THR  74           HG1      THR  74   6.120  -9.039   4.079
  607   HG21  THR  74          3HG2      THR  74   6.662  -7.174   1.083
  608   HG22  THR  74          1HG2      THR  74   5.483  -8.089   0.138
  609   HG23  THR  74          2HG2      THR  74   6.994  -8.849   0.638
  610    H    TYR  75           H        TYR  75   5.098  -6.850   4.966
  611    HA   TYR  75           HA       TYR  75   6.295  -4.343   4.185
  612    HB2  TYR  75           2HB      TYR  75   4.729  -2.982   5.689
  613    HB3  TYR  75           3HB      TYR  75   4.031  -3.518   4.171
  614    HD1  TYR  75           HD1      TYR  75   4.078  -4.193   7.851
  615    HD2  TYR  75           HD2      TYR  75   2.054  -4.919   4.151
  616    HE1  TYR  75           HE1      TYR  75   2.206  -5.204   9.069
  617    HE2  TYR  75           HE2      TYR  75   0.180  -5.929   5.376
  618    HH   TYR  75           HH       TYR  75  -0.296  -6.953   7.489
  619    H    THR  76           H        THR  76   7.142  -3.179   6.146
  620    HA   THR  76           HA       THR  76   7.508  -4.896   8.515
  621    HB   THR  76           HB       THR  76   9.844  -3.478   7.148
  622    HG1  THR  76           HG1      THR  76   9.031  -5.358   6.008
  623   HG21  THR  76          3HG2      THR  76   9.797  -5.448   9.474
  624   HG22  THR  76          1HG2      THR  76  10.132  -3.715   9.604
  625   HG23  THR  76          2HG2      THR  76  11.244  -4.769   8.732
  626    H    ILE  77           H        ILE  77   7.351  -3.835  10.356
  627    HA   ILE  77           HA       ILE  77   7.846  -1.001  10.658
  628    HB   ILE  77           HB       ILE  77   5.466  -0.857  11.932
  629   HG12  ILE  77          2HG1      ILE  77   4.869  -2.854   9.693
  630   HG13  ILE  77          3HG1      ILE  77   4.737  -3.155  11.423
  631   HG21  ILE  77          1HG2      ILE  77   6.210   0.712  10.220
  632   HG22  ILE  77          2HG2      ILE  77   4.509   0.309  10.007
  633   HG23  ILE  77          3HG2      ILE  77   5.724  -0.409   8.950
  634   HD11  ILE  77          3HD1      ILE  77   2.561  -2.802  10.442
  635   HD12  ILE  77          1HD1      ILE  77   3.048  -1.217   9.842
  636   HD13  ILE  77          2HD1      ILE  77   2.934  -1.512  11.581
  637    H    ARG  78           H        ARG  78   9.097  -1.007  12.351
  638    HA   ARG  78           HA       ARG  78   8.719  -2.938  14.546
  639    HB2  ARG  78           2HB      ARG  78  11.072  -1.093  13.961
  640    HB3  ARG  78           3HB      ARG  78  11.011  -2.337  15.198
  641    HG2  ARG  78           2HG      ARG  78  10.963  -2.812  12.202
  642    HG3  ARG  78           3HG      ARG  78  12.334  -3.078  13.279
  643    HD2  ARG  78           2HD      ARG  78  11.090  -4.841  14.460
  644    HD3  ARG  78           3HD      ARG  78   9.677  -4.544  13.440
  645    HE   ARG  78           HE       ARG  78  12.179  -5.291  12.118
  646   HH11  ARG  78          1HH1      ARG  78   8.975  -6.345  13.205
  647   HH12  ARG  78          2HH1      ARG  78   8.979  -7.752  12.179
  648   HH21  ARG  78          1HH2      ARG  78  12.130  -7.129  10.784
  649   HH22  ARG  78          2HH2      ARG  78  10.755  -8.193  10.818
  650    H    GLY  79           H        GLY  79   6.939  -1.908  15.427
  651    HA2  GLY  79           2HA      GLY  79   7.350   0.716  16.764
  652    HA3  GLY  79           3HA      GLY  79   5.798  -0.040  16.429
  653    H    SER  80           H        SER  80   6.978  -2.688  17.316
  654    HA   SER  80           HA       SER  80   6.310  -2.455  20.145
  655    HB2  SER  80           2HB      SER  80   6.934  -4.943  18.487
  656    HB3  SER  80           3HB      SER  80   6.202  -4.910  20.094
  657    HG   SER  80           HG       SER  80   4.882  -5.008  17.950
  658    H    LEU  81           H        LEU  81   8.993  -1.575  18.877
  659    HA   LEU  81           HA       LEU  81  11.130  -3.124  19.779
  660    HB2  LEU  81           2HB      LEU  81  10.909  -0.112  19.455
  661    HB3  LEU  81           3HB      LEU  81  12.427  -0.938  19.772
  662    HG   LEU  81           HG       LEU  81  10.702  -1.362  17.300
  663   HD11  LEU  81          1HD1      LEU  81  11.703   0.872  17.320
  664   HD12  LEU  81          2HD1      LEU  81  12.430  -0.138  16.075
  665   HD13  LEU  81          3HD1      LEU  81  13.305   0.174  17.579
  666   HD21  LEU  81          3HD2      LEU  81  13.464  -2.444  17.957
  667   HD22  LEU  81          1HD2      LEU  81  12.608  -2.634  16.425
  668   HD23  LEU  81          2HD2      LEU  81  11.964  -3.376  17.886
  669    H    GLU  82           H        GLU  82   9.066  -0.886  21.503
  670    HA   GLU  82           HA       GLU  82  10.391  -0.904  24.006
  671    HB2  GLU  82           2HB      GLU  82   7.409  -0.637  23.391
  672    HB3  GLU  82           3HB      GLU  82   8.160  -0.267  24.939
  673    HG2  GLU  82           2HG      GLU  82   9.474   1.536  23.884
  674    HG3  GLU  82           3HG      GLU  82   8.733   1.171  22.327
  675    H    HIS  83           H        HIS  83  11.134  -3.056  24.208
  676    HA   HIS  83           HA       HIS  83   9.456  -5.360  24.286
  677    HB2  HIS  83           2HB      HIS  83  11.466  -6.519  25.239
  678    HB3  HIS  83           3HB      HIS  83  11.777  -5.668  23.739
  679    HD1  HIS  83           HD1      HIS  83  13.116  -6.117  27.057
  680    HD2  HIS  83           HD2      HIS  83  13.227  -3.108  24.192
  681    HE1  HIS  83           HE1      HIS  83  15.113  -4.711  27.627
  682    HE2  HIS  83           HE2      HIS  83  15.099  -2.840  25.954
  683    H    HIS  84           H        HIS  84  10.143  -2.914  26.575
  684    HA   HIS  84           HA       HIS  84   8.558  -4.249  28.662
  685    HB2  HIS  84           2HB      HIS  84   9.728  -1.418  28.487
  686    HB3  HIS  84           3HB      HIS  84   8.800  -2.030  29.851
  687    HD1  HIS  84           HD1      HIS  84  10.340  -2.542  31.745
  688    HD2  HIS  84           HD2      HIS  84  12.079  -3.428  28.074
  689    HE1  HIS  84           HE1      HIS  84  12.639  -3.412  32.267
  690    HE2  HIS  84           HE2      HIS  84  13.608  -4.072  30.048
  691    H    HIS  85           H        HIS  85   6.706  -4.587  27.381
  692    HA   HIS  85           HA       HIS  85   5.451  -2.624  25.744
  693    HB2  HIS  85           2HB      HIS  85   4.284  -5.200  26.889
  694    HB3  HIS  85           3HB      HIS  85   3.591  -4.254  25.570
  695    HD1  HIS  85           HD1      HIS  85   6.074  -6.869  26.305
  696    HD2  HIS  85           HD2      HIS  85   5.143  -4.371  23.114
  697    HE1  HIS  85           HE1      HIS  85   7.290  -7.821  24.329
  698    HE2  HIS  85           HE2      HIS  85   6.559  -6.402  22.385
  699    H    HIS  86           H        HIS  86   4.926  -3.705  29.076
  700    HA   HIS  86           HA       HIS  86   2.718  -1.908  29.557
  701    HB2  HIS  86           2HB      HIS  86   3.075  -4.006  30.896
  702    HB3  HIS  86           3HB      HIS  86   4.521  -3.292  31.600
  703    HD1  HIS  86           HD1      HIS  86   4.194  -1.799  33.600
  704    HD2  HIS  86           HD2      HIS  86   0.613  -2.678  31.687
  705    HE1  HIS  86           HE1      HIS  86   2.397  -0.880  35.090
  706    HE2  HIS  86           HE2      HIS  86   0.243  -1.347  33.870
  707    H    HIS  87           H        HIS  87   3.014   0.221  29.590
  708    HA   HIS  87           HA       HIS  87   5.529   1.528  29.636
  709    HB2  HIS  87           2HB      HIS  87   3.658   2.535  28.459
  710    HB3  HIS  87           3HB      HIS  87   2.689   2.602  29.930
  711    HD1  HIS  87           HD1      HIS  87   3.006   4.631  31.447
  712    HD2  HIS  87           HD2      HIS  87   5.798   4.471  28.376
  713    HE1  HIS  87           HE1      HIS  87   4.235   6.817  31.543
  714    HE2  HIS  87           HE2      HIS  87   5.917   6.696  29.674
  715    H    HIS  88           H        HIS  88   6.779   1.812  31.360
  716    HA   HIS  88           HA       HIS  88   5.921   3.247  33.656
  717    HB2  HIS  88           2HB      HIS  88   5.201   0.941  34.343
  718    HB3  HIS  88           3HB      HIS  88   6.863   0.389  34.174
  719    HD1  HIS  88           HD1      HIS  88   8.485   0.922  36.083
  720    HD2  HIS  88           HD2      HIS  88   4.741   2.647  36.604
  721    HE1  HIS  88           HE1      HIS  88   8.436   1.725  38.455
  722    HE2  HIS  88           HE2      HIS  88   6.236   2.909  38.691
  Start of MODEL    9
    1    H1   MET   1           1H       MET   1   9.267   1.846  13.049
    2    H2   MET   1           2H       MET   1   8.017   2.825  12.467
    3    H3   MET   1           3H       MET   1   8.292   2.692  14.123
    4    HA   MET   1           HA       MET   1   9.086   4.793  13.139
    5    HB2  MET   1           2HB      MET   1  11.191   4.808  14.381
    6    HB3  MET   1           3HB      MET   1  10.007   3.872  15.277
    7    HG2  MET   1           2HG      MET   1  11.056   1.780  14.484
    8    HG3  MET   1           3HG      MET   1  12.244   2.719  13.581
    9    HE1  MET   1           3HE      MET   1  14.218   1.095  16.586
   10    HE2  MET   1           1HE      MET   1  14.060   1.173  14.834
   11    HE3  MET   1           2HE      MET   1  12.805   0.393  15.799
   12    H    GLY   2           H        GLY   2  11.401   5.584  12.307
   13    HA2  GLY   2           2HA      GLY   2  12.896   5.777  10.577
   14    HA3  GLY   2           3HA      GLY   2  12.679   4.061  10.230
   15    H    GLU   3           H        GLU   3  10.792   3.425   9.004
   16    HA   GLU   3           HA       GLU   3   9.055   5.292   7.709
   17    HB2  GLU   3           2HB      GLU   3  11.253   5.589   6.454
   18    HB3  GLU   3           3HB      GLU   3  11.128   3.912   5.945
   19    HG2  GLU   3           2HG      GLU   3   9.012   4.446   4.757
   20    HG3  GLU   3           3HG      GLU   3   9.177   6.134   5.247
   21    H    MET   4           H        MET   4   7.634   4.032   6.045
   22    HA   MET   4           HA       MET   4   7.482   1.141   6.684
   23    HB2  MET   4           2HB      MET   4   5.530   2.413   7.575
   24    HB3  MET   4           3HB      MET   4   5.186   3.022   5.960
   25    HG2  MET   4           2HG      MET   4   4.685   0.775   5.175
   26    HG3  MET   4           3HG      MET   4   5.163   0.096   6.733
   27    HE1  MET   4           3HE      MET   4   1.425  -0.576   7.202
   28    HE2  MET   4           1HE      MET   4   3.066  -1.155   7.485
   29    HE3  MET   4           2HE      MET   4   2.474  -0.949   5.835
   30    H    ASP   5           H        ASP   5   7.599  -0.257   4.930
   31    HA   ASP   5           HA       ASP   5   7.255   0.809   2.191
   32    HB2  ASP   5           2HB      ASP   5   9.547  -0.136   2.755
   33    HB3  ASP   5           3HB      ASP   5   8.788  -1.681   3.114
   34    H    ILE   6           H        ILE   6   5.416   0.019   1.232
   35    HA   ILE   6           HA       ILE   6   4.108  -2.424   2.303
   36    HB   ILE   6           HB       ILE   6   2.750  -0.001   1.028
   37   HG12  ILE   6          2HG1      ILE   6   2.832  -0.871   3.955
   38   HG13  ILE   6          3HG1      ILE   6   3.646   0.534   3.282
   39   HG21  ILE   6          1HG2      ILE   6   0.633  -1.114   1.694
   40   HG22  ILE   6          2HG2      ILE   6   1.546  -2.496   2.294
   41   HG23  ILE   6          3HG2      ILE   6   1.557  -2.112   0.571
   42   HD11  ILE   6          3HD1      ILE   6   1.443   1.473   2.709
   43   HD12  ILE   6          1HD1      ILE   6   1.700   1.225   4.435
   44   HD13  ILE   6          2HD1      ILE   6   0.690   0.101   3.529
   45    H    ARG   7           H        ARG   7   4.184  -4.019   0.831
   46    HA   ARG   7           HA       ARG   7   4.661  -3.324  -2.010
   47    HB2  ARG   7           2HB      ARG   7   6.706  -4.048  -0.681
   48    HB3  ARG   7           3HB      ARG   7   5.957  -5.632  -0.507
   49    HG2  ARG   7           2HG      ARG   7   6.101  -6.058  -2.869
   50    HG3  ARG   7           3HG      ARG   7   6.505  -4.372  -3.215
   51    HD2  ARG   7           2HD      ARG   7   8.237  -6.408  -1.782
   52    HD3  ARG   7           3HD      ARG   7   8.532  -5.680  -3.367
   53    HE   ARG   7           HE       ARG   7   8.329  -3.663  -1.365
   54   HH11  ARG   7          1HH1      ARG   7  10.620  -6.092  -2.519
   55   HH12  ARG   7          2HH1      ARG   7  11.998  -5.218  -1.925
   56   HH21  ARG   7          1HH2      ARG   7  10.063  -2.587  -0.567
   57   HH22  ARG   7          2HH2      ARG   7  11.678  -3.196  -0.794
   58    H    PHE   8           H        PHE   8   3.215  -4.163  -3.292
   59    HA   PHE   8           HA       PHE   8   1.556  -6.487  -2.501
   60    HB2  PHE   8           2HB      PHE   8   1.042  -4.237  -4.505
   61    HB3  PHE   8           3HB      PHE   8   0.008  -5.650  -4.335
   62    HD1  PHE   8           HD2      PHE   8  -1.368  -5.975  -2.295
   63    HD2  PHE   8           HD1      PHE   8   0.958  -2.422  -2.853
   64    HE1  PHE   8           HE2      PHE   8  -2.653  -4.855  -0.529
   65    HE2  PHE   8           HE1      PHE   8  -0.333  -1.314  -1.074
   66    HZ   PHE   8           HZ       PHE   8  -2.137  -2.526   0.089
   67    H    ARG   9           H        ARG   9   1.179  -8.090  -4.171
   68    HA   ARG   9           HA       ARG   9   2.639  -7.889  -6.681
   69    HB2  ARG   9           2HB      ARG   9   4.236  -8.931  -4.904
   70    HB3  ARG   9           3HB      ARG   9   3.180 -10.335  -4.931
   71    HG2  ARG   9           2HG      ARG   9   3.630 -10.741  -7.261
   72    HG3  ARG   9           3HG      ARG   9   4.476  -9.204  -7.425
   73    HD2  ARG   9           2HD      ARG   9   6.183 -10.132  -5.752
   74    HD3  ARG   9           3HD      ARG   9   5.404 -11.703  -5.991
   75    HE   ARG   9           HE       ARG   9   6.043 -10.553  -8.499
   76   HH11  ARG   9          1HH1      ARG   9   7.649 -12.100  -5.782
   77   HH12  ARG   9          2HH1      ARG   9   8.976 -12.675  -6.741
   78   HH21  ARG   9          1HH2      ARG   9   7.767 -11.274  -9.734
   79   HH22  ARG   9          2HH2      ARG   9   9.040 -12.199  -9.004
   80    H    GLY  10           H        GLY  10   1.596  -9.001  -8.282
   81    HA2  GLY  10           2HA      GLY  10  -0.207 -11.198  -7.772
   82    HA3  GLY  10           3HA      GLY  10  -1.041  -9.693  -8.164
   83    H    ASP  11           H        ASP  11  -1.038 -12.127  -9.648
   84    HA   ASP  11           HA       ASP  11   0.620 -12.067 -11.942
   85    HB2  ASP  11           2HB      ASP  11  -0.762 -14.042 -11.105
   86    HB3  ASP  11           3HB      ASP  11  -2.197 -13.228 -11.706
   87    H    ASP  12           H        ASP  12  -2.089 -10.157 -10.987
   88    HA   ASP  12           HA       ASP  12  -2.312  -8.930 -13.670
   89    HB2  ASP  12           2HB      ASP  12  -4.456  -9.791 -12.835
   90    HB3  ASP  12           3HB      ASP  12  -4.254  -8.919 -11.320
   91    H    LEU  13           H        LEU  13  -1.023  -7.199 -13.811
   92    HA   LEU  13           HA       LEU  13   0.074  -5.662 -11.709
   93    HB2  LEU  13           2HB      LEU  13   0.904  -6.007 -14.110
   94    HB3  LEU  13           3HB      LEU  13  -0.267  -4.812 -14.608
   95    HG   LEU  13           HG       LEU  13   2.119  -3.989 -14.437
   96   HD11  LEU  13          1HD1      LEU  13   0.314  -2.336 -14.408
   97   HD12  LEU  13          2HD1      LEU  13   1.678  -1.822 -13.420
   98   HD13  LEU  13          3HD1      LEU  13   0.219  -2.450 -12.648
   99   HD21  LEU  13          3HD2      LEU  13   2.850  -5.223 -12.449
  100   HD22  LEU  13          1HD2      LEU  13   1.758  -4.274 -11.434
  101   HD23  LEU  13          2HD2      LEU  13   3.118  -3.494 -12.246
  102    H    GLU  14           H        GLU  14  -2.972  -5.460 -13.426
  103    HA   GLU  14           HA       GLU  14  -3.570  -2.705 -12.903
  104    HB2  GLU  14           2HB      GLU  14  -5.290  -5.013 -13.872
  105    HB3  GLU  14           3HB      GLU  14  -6.037  -3.494 -13.380
  106    HG2  GLU  14           2HG      GLU  14  -4.567  -2.314 -15.044
  107    HG3  GLU  14           3HG      GLU  14  -4.044  -3.896 -15.627
  108    H    ALA  15           H        ALA  15  -4.335  -5.752 -11.222
  109    HA   ALA  15           HA       ALA  15  -6.069  -4.772  -9.254
  110    HB1  ALA  15           3HB      ALA  15  -5.661  -7.169  -9.643
  111    HB2  ALA  15           1HB      ALA  15  -5.417  -6.758  -7.944
  112    HB3  ALA  15           2HB      ALA  15  -4.026  -7.009  -9.005
  113    H    LEU  16           H        LEU  16  -2.593  -4.703  -9.512
  114    HA   LEU  16           HA       LEU  16  -1.974  -3.780  -6.897
  115    HB2  LEU  16           2HB      LEU  16  -0.329  -3.389  -9.426
  116    HB3  LEU  16           3HB      LEU  16   0.252  -3.343  -7.769
  117    HG   LEU  16           HG       LEU  16  -0.724  -5.803  -9.268
  118   HD11  LEU  16          1HD1      LEU  16   2.032  -5.050  -8.265
  119   HD12  LEU  16          2HD1      LEU  16   1.494  -5.062  -9.945
  120   HD13  LEU  16          3HD1      LEU  16   1.594  -6.572  -9.046
  121   HD21  LEU  16          3HD2      LEU  16   0.254  -5.622  -6.403
  122   HD22  LEU  16          1HD2      LEU  16  -0.098  -7.108  -7.285
  123   HD23  LEU  16          2HD2      LEU  16  -1.397  -5.979  -6.918
  124    H    GLU  17           H        GLU  17  -2.832  -2.212  -9.957
  125    HA   GLU  17           HA       GLU  17  -2.079   0.464  -9.187
  126    HB2  GLU  17           2HB      GLU  17  -3.894  -0.444 -11.476
  127    HB3  GLU  17           3HB      GLU  17  -3.189   1.161 -11.288
  128    HG2  GLU  17           2HG      GLU  17  -0.928   0.219 -11.528
  129    HG3  GLU  17           3HG      GLU  17  -1.614  -1.395 -11.687
  130    H    LYS  18           H        LYS  18  -5.117  -1.386  -9.091
  131    HA   LYS  18           HA       LYS  18  -6.772   0.811  -8.257
  132    HB2  LYS  18           2HB      LYS  18  -7.129  -2.199  -8.158
  133    HB3  LYS  18           3HB      LYS  18  -8.276  -1.140  -7.354
  134    HG2  LYS  18           2HG      LYS  18  -9.212  -1.714  -9.465
  135    HG3  LYS  18           3HG      LYS  18  -8.706  -0.028  -9.574
  136    HD2  LYS  18           2HD      LYS  18  -6.672  -0.723 -10.799
  137    HD3  LYS  18           3HD      LYS  18  -7.171  -2.411 -10.665
  138    HE2  LYS  18           2HE      LYS  18  -9.210  -1.872 -11.997
  139    HE3  LYS  18           3HE      LYS  18  -8.613  -0.224 -12.193
  140    HZ1  LYS  18           3HZ      LYS  18  -6.595  -1.225 -13.206
  141    HZ2  LYS  18           1HZ      LYS  18  -8.012  -1.428 -14.102
  142    HZ3  LYS  18           2HZ      LYS  18  -7.394  -2.712 -13.203
  143    H    ALA  19           H        ALA  19  -5.069  -1.808  -6.524
  144    HA   ALA  19           HA       ALA  19  -5.650  -1.044  -3.881
  145    HB1  ALA  19           3HB      ALA  19  -3.147  -2.404  -4.942
  146    HB2  ALA  19           1HB      ALA  19  -4.640  -3.211  -4.457
  147    HB3  ALA  19           2HB      ALA  19  -3.662  -2.368  -3.253
  148    H    LEU  20           H        LEU  20  -3.001  -0.136  -6.035
  149    HA   LEU  20           HA       LEU  20  -1.415   1.497  -4.473
  150    HB2  LEU  20           2HB      LEU  20  -0.804   0.792  -6.739
  151    HB3  LEU  20           3HB      LEU  20  -2.107   1.745  -7.427
  152    HG   LEU  20           HG       LEU  20  -0.957   3.831  -6.708
  153   HD11  LEU  20          1HD1      LEU  20   1.350   3.767  -5.864
  154   HD12  LEU  20          2HD1      LEU  20   1.262   2.011  -5.735
  155   HD13  LEU  20          3HD1      LEU  20   0.220   3.024  -4.735
  156   HD21  LEU  20          3HD2      LEU  20   0.886   3.759  -8.330
  157   HD22  LEU  20          1HD2      LEU  20  -0.557   2.966  -8.965
  158   HD23  LEU  20          2HD2      LEU  20   0.796   1.996  -8.373
  159    H    LYS  21           H        LYS  21  -4.223   2.395  -6.449
  160    HA   LYS  21           HA       LYS  21  -4.205   5.158  -6.138
  161    HB2  LYS  21           2HB      LYS  21  -5.642   3.901  -7.740
  162    HB3  LYS  21           3HB      LYS  21  -6.607   3.309  -6.396
  163    HG2  LYS  21           2HG      LYS  21  -7.022   5.859  -5.888
  164    HG3  LYS  21           3HG      LYS  21  -6.467   6.097  -7.548
  165    HD2  LYS  21           2HD      LYS  21  -8.911   5.963  -7.499
  166    HD3  LYS  21           3HD      LYS  21  -8.257   4.562  -8.351
  167    HE2  LYS  21           2HE      LYS  21  -8.585   3.162  -6.354
  168    HE3  LYS  21           3HE      LYS  21  -9.161   4.556  -5.440
  169    HZ1  LYS  21           3HZ      LYS  21 -10.990   3.213  -6.215
  170    HZ2  LYS  21           1HZ      LYS  21 -10.482   3.367  -7.815
  171    HZ3  LYS  21           2HZ      LYS  21 -11.027   4.719  -6.972
  172    H    GLU  22           H        GLU  22  -5.761   2.639  -4.188
  173    HA   GLU  22           HA       GLU  22  -6.954   4.407  -2.313
  174    HB2  GLU  22           2HB      GLU  22  -6.441   1.428  -2.320
  175    HB3  GLU  22           3HB      GLU  22  -7.199   2.232  -0.951
  176    HG2  GLU  22           2HG      GLU  22  -8.250   2.239  -3.788
  177    HG3  GLU  22           3HG      GLU  22  -8.851   1.221  -2.484
  178    H    MET  23           H        MET  23  -3.902   2.448  -2.150
  179    HA   MET  23           HA       MET  23  -3.278   3.114   0.518
  180    HB2  MET  23           2HB      MET  23  -1.381   2.407  -1.754
  181    HB3  MET  23           3HB      MET  23  -0.952   2.411  -0.044
  182    HG2  MET  23           2HG      MET  23  -2.949   0.599  -1.406
  183    HG3  MET  23           3HG      MET  23  -1.374   0.145  -0.775
  184    HE1  MET  23           3HE      MET  23  -0.836  -0.085   1.789
  185    HE2  MET  23           1HE      MET  23  -1.966   0.322   3.080
  186    HE3  MET  23           2HE      MET  23  -1.298   1.596   2.058
  187    H    ILE  24           H        ILE  24  -2.348   4.713  -2.509
  188    HA   ILE  24           HA       ILE  24  -0.772   6.810  -1.535
  189    HB   ILE  24           HB       ILE  24  -2.604   6.628  -3.977
  190   HG12  ILE  24          2HG1      ILE  24   0.443   6.524  -3.707
  191   HG13  ILE  24          3HG1      ILE  24  -0.611   5.167  -4.089
  192   HG21  ILE  24          1HG2      ILE  24  -1.572   8.694  -4.861
  193   HG22  ILE  24          2HG2      ILE  24  -0.709   8.909  -3.337
  194   HG23  ILE  24          3HG2      ILE  24  -2.469   9.003  -3.371
  195   HD11  ILE  24          3HD1      ILE  24  -1.216   6.271  -6.210
  196   HD12  ILE  24          1HD1      ILE  24   0.511   5.934  -6.076
  197   HD13  ILE  24          2HD1      ILE  24  -0.087   7.574  -5.829
  198    H    ARG  25           H        ARG  25  -4.262   6.634  -2.139
  199    HA   ARG  25           HA       ARG  25  -5.117   9.124  -1.284
  200    HB2  ARG  25           2HB      ARG  25  -6.587   7.673  -2.498
  201    HB3  ARG  25           3HB      ARG  25  -6.435   6.393  -1.304
  202    HG2  ARG  25           2HG      ARG  25  -7.671   7.896   0.325
  203    HG3  ARG  25           3HG      ARG  25  -7.963   8.997  -1.025
  204    HD2  ARG  25           2HD      ARG  25  -9.181   7.251  -2.228
  205    HD3  ARG  25           3HD      ARG  25  -8.818   6.083  -0.949
  206    HE   ARG  25           HE       ARG  25 -10.171   8.368   0.086
  207   HH11  ARG  25          1HH1      ARG  25 -10.769   5.397  -1.700
  208   HH12  ARG  25          2HH1      ARG  25 -12.427   5.291  -1.182
  209   HH21  ARG  25          1HH2      ARG  25 -12.311   8.216   0.766
  210   HH22  ARG  25          2HH2      ARG  25 -13.304   6.893   0.221
  211    H    GLN  26           H        GLN  26  -4.519   6.177   0.654
  212    HA   GLN  26           HA       GLN  26  -5.628   7.143   3.094
  213    HB2  GLN  26           2HB      GLN  26  -3.370   5.107   2.922
  214    HB3  GLN  26           3HB      GLN  26  -4.544   5.296   4.213
  215    HG2  GLN  26           2HG      GLN  26  -4.978   4.142   1.462
  216    HG3  GLN  26           3HG      GLN  26  -5.101   3.318   3.005
  217   HE21  GLN  26          1HE2      GLN  26  -7.055   3.561   0.791
  218   HE22  GLN  26          2HE2      GLN  26  -8.484   4.217   1.507
  219    H    ALA  27           H        ALA  27  -2.231   6.876   1.979
  220    HA   ALA  27           HA       ALA  27  -1.005   8.111   4.182
  221    HB1  ALA  27           3HB      ALA  27   0.187   6.729   2.556
  222    HB2  ALA  27           1HB      ALA  27   0.970   8.299   2.734
  223    HB3  ALA  27           2HB      ALA  27  -0.034   7.967   1.318
  224    H    ARG  28           H        ARG  28  -2.494   9.515   1.347
  225    HA   ARG  28           HA       ARG  28  -1.476  12.182   1.699
  226    HB2  ARG  28           2HB      ARG  28  -3.736  11.093  -0.024
  227    HB3  ARG  28           3HB      ARG  28  -3.249  12.788  -0.015
  228    HG2  ARG  28           2HG      ARG  28  -0.962  12.095  -0.738
  229    HG3  ARG  28           3HG      ARG  28  -1.539  10.429  -0.852
  230    HD2  ARG  28           2HD      ARG  28  -1.543  11.444  -3.056
  231    HD3  ARG  28           3HD      ARG  28  -3.205  11.153  -2.544
  232    HE   ARG  28           HE       ARG  28  -2.892  13.706  -1.808
  233   HH11  ARG  28          1HH1      ARG  28  -2.106  12.140  -4.852
  234   HH12  ARG  28          2HH1      ARG  28  -2.346  13.574  -5.798
  235   HH21  ARG  28          1HH2      ARG  28  -3.240  15.573  -3.023
  236   HH22  ARG  28          2HH2      ARG  28  -3.000  15.557  -4.744
  237    H    LYS  29           H        LYS  29  -4.518  10.486   2.567
  238    HA   LYS  29           HA       LYS  29  -5.872  12.855   3.458
  239    HB2  LYS  29           2HB      LYS  29  -7.670  11.462   4.136
  240    HB3  LYS  29           3HB      LYS  29  -6.981  10.624   2.755
  241    HG2  LYS  29           2HG      LYS  29  -5.803   9.090   4.290
  242    HG3  LYS  29           3HG      LYS  29  -6.523   9.918   5.667
  243    HD2  LYS  29           2HD      LYS  29  -8.787   9.245   4.823
  244    HD3  LYS  29           3HD      LYS  29  -7.998   8.342   3.521
  245    HE2  LYS  29           2HE      LYS  29  -6.846   6.938   5.212
  246    HE3  LYS  29           3HE      LYS  29  -7.667   7.817   6.501
  247    HZ1  LYS  29           3HZ      LYS  29  -8.797   5.779   6.076
  248    HZ2  LYS  29           1HZ      LYS  29  -8.924   6.115   4.427
  249    HZ3  LYS  29           2HZ      LYS  29  -9.787   7.041   5.545
  250    H    PHE  30           H        PHE  30  -3.790  10.477   4.997
  251    HA   PHE  30           HA       PHE  30  -4.068  11.424   7.700
  252    HB2  PHE  30           2HB      PHE  30  -1.968   9.667   6.359
  253    HB3  PHE  30           3HB      PHE  30  -1.974  10.025   8.082
  254    HD1  PHE  30           HD1      PHE  30  -4.563   9.630   9.104
  255    HD2  PHE  30           HD2      PHE  30  -2.724   7.497   5.887
  256    HE1  PHE  30           HE1      PHE  30  -5.988   7.676   9.565
  257    HE2  PHE  30           HE2      PHE  30  -4.169   5.559   6.353
  258    HZ   PHE  30           HZ       PHE  30  -5.793   5.642   8.198
  259    H    ALA  31           H        ALA  31  -2.485  12.642   4.955
  260    HA   ALA  31           HA       ALA  31  -1.263  14.469   4.523
  261    HB1  ALA  31           3HB      ALA  31  -1.467  15.142   7.466
  262    HB2  ALA  31           1HB      ALA  31  -2.609  15.626   6.213
  263    HB3  ALA  31           2HB      ALA  31  -0.953  16.237   6.179
  264    H    GLY  32           H        GLY  32   0.229  12.713   4.075
  265    HA2  GLY  32           2HA      GLY  32   2.825  13.300   5.355
  266    HA3  GLY  32           3HA      GLY  32   2.304  11.618   5.201
  267    H    THR  33           H        THR  33   4.031  11.106   3.781
  268    HA   THR  33           HA       THR  33   3.663  12.042   0.983
  269    HB   THR  33           HB       THR  33   6.267  11.269   2.396
  270    HG1  THR  33           HG1      THR  33   5.017  13.685   1.779
  271   HG21  THR  33          3HG2      THR  33   7.425  11.884   0.302
  272   HG22  THR  33          1HG2      THR  33   5.870  12.135  -0.494
  273   HG23  THR  33          2HG2      THR  33   6.338  10.518   0.038
  274    H    VAL  34           H        VAL  34   3.720  10.410  -0.629
  275    HA   VAL  34           HA       VAL  34   4.233   7.631   0.152
  276    HB   VAL  34           HB       VAL  34   1.841   7.808   0.447
  277   HG11  VAL  34          1HG1      VAL  34   0.259   8.528  -1.299
  278   HG12  VAL  34          2HG1      VAL  34   1.604   8.949  -2.359
  279   HG13  VAL  34          3HG1      VAL  34   1.359   9.834  -0.853
  280   HG21  VAL  34          3HG2      VAL  34   1.009   6.123  -1.146
  281   HG22  VAL  34          1HG2      VAL  34   2.628   5.718  -0.570
  282   HG23  VAL  34          2HG2      VAL  34   2.409   6.399  -2.184
  283    H    THR  35           H        THR  35   5.591   6.810  -1.275
  284    HA   THR  35           HA       THR  35   5.586   7.671  -4.121
  285    HB   THR  35           HB       THR  35   7.988   6.860  -4.124
  286    HG1  THR  35           HG1      THR  35   7.612   6.805  -1.290
  287   HG21  THR  35          3HG2      THR  35   7.435   9.164  -2.205
  288   HG22  THR  35          1HG2      THR  35   7.548   9.283  -3.966
  289   HG23  THR  35          2HG2      THR  35   8.966   8.842  -3.019
  290    H    TYR  36           H        TYR  36   6.261   5.853  -5.624
  291    HA   TYR  36           HA       TYR  36   5.875   3.132  -4.653
  292    HB2  TYR  36           2HB      TYR  36   3.958   2.635  -6.102
  293    HB3  TYR  36           3HB      TYR  36   3.553   3.930  -4.980
  294    HD1  TYR  36           HD2      TYR  36   3.340   6.300  -5.812
  295    HD2  TYR  36           HD1      TYR  36   3.989   3.035  -8.515
  296    HE1  TYR  36           HE2      TYR  36   2.688   7.723  -7.705
  297    HE2  TYR  36           HE1      TYR  36   3.339   4.476 -10.389
  298    HH   TYR  36           HH       TYR  36   2.074   6.519 -10.803
  299    H    THR  37           H        THR  37   6.161   1.511  -6.320
  300    HA   THR  37           HA       THR  37   7.337   2.398  -8.880
  301    HB   THR  37           HB       THR  37   8.470   0.142  -7.143
  302    HG1  THR  37           HG1      THR  37   9.305   2.833  -7.553
  303   HG21  THR  37          3HG2      THR  37  10.341   0.111  -8.760
  304   HG22  THR  37          1HG2      THR  37   9.543   1.355  -9.728
  305   HG23  THR  37          2HG2      THR  37   8.817  -0.246  -9.568
  306    H    LEU  38           H        LEU  38   6.075   1.564 -10.474
  307    HA   LEU  38           HA       LEU  38   4.748  -1.060 -10.137
  308    HB2  LEU  38           2HB      LEU  38   4.479   1.116 -12.258
  309    HB3  LEU  38           3HB      LEU  38   3.710  -0.458 -12.404
  310    HG   LEU  38           HG       LEU  38   3.156   1.499 -10.137
  311   HD11  LEU  38          1HD1      LEU  38   1.469   0.925 -12.590
  312   HD12  LEU  38          2HD1      LEU  38   2.351   2.419 -12.260
  313   HD13  LEU  38          3HD1      LEU  38   1.008   1.943 -11.222
  314   HD21  LEU  38          3HD2      LEU  38   1.729  -1.074 -10.904
  315   HD22  LEU  38          1HD2      LEU  38   1.227   0.048  -9.634
  316   HD23  LEU  38          2HD2      LEU  38   2.746  -0.830  -9.480
  317    H    ASP  39           H        ASP  39   6.004  -2.789 -10.743
  318    HA   ASP  39           HA       ASP  39   7.612  -2.658 -13.206
  319    HB2  ASP  39           2HB      ASP  39   9.163  -1.962 -11.354
  320    HB3  ASP  39           3HB      ASP  39   8.798  -3.454 -10.502
  321    H    GLY  40           H        GLY  40   7.227  -4.495 -14.321
  322    HA2  GLY  40           2HA      GLY  40   6.728  -6.640 -14.896
  323    HA3  GLY  40           3HA      GLY  40   7.422  -7.118 -13.352
  324    H    ASN  41           H        ASN  41   6.067  -7.661 -11.681
  325    HA   ASN  41           HA       ASN  41   3.142  -7.322 -11.895
  326    HB2  ASN  41           2HB      ASN  41   4.625  -9.957 -11.571
  327    HB3  ASN  41           3HB      ASN  41   2.972  -9.770 -10.990
  328   HD21  ASN  41          1HD2      ASN  41   1.311  -9.329 -12.531
  329   HD22  ASN  41          2HD2      ASN  41   1.504  -9.807 -14.183
  330    H    ASP  42           H        ASP  42   5.474  -6.247 -10.294
  331    HA   ASP  42           HA       ASP  42   4.335  -6.674  -7.611
  332    HB2  ASP  42           2HB      ASP  42   6.625  -6.397  -6.642
  333    HB3  ASP  42           3HB      ASP  42   6.488  -7.827  -7.657
  334    H    LEU  43           H        LEU  43   4.151  -4.925  -6.344
  335    HA   LEU  43           HA       LEU  43   4.765  -2.235  -7.405
  336    HB2  LEU  43           2HB      LEU  43   2.380  -2.529  -7.524
  337    HB3  LEU  43           3HB      LEU  43   2.321  -3.300  -5.945
  338    HG   LEU  43           HG       LEU  43   2.889  -1.115  -4.870
  339   HD11  LEU  43          1HD1      LEU  43   2.761   0.988  -6.129
  340   HD12  LEU  43          2HD1      LEU  43   2.612   0.090  -7.639
  341   HD13  LEU  43          3HD1      LEU  43   4.098  -0.011  -6.696
  342   HD21  LEU  43          3HD2      LEU  43   0.688  -0.101  -5.176
  343   HD22  LEU  43          1HD2      LEU  43   0.574  -1.858  -5.069
  344   HD23  LEU  43          2HD2      LEU  43   0.438  -1.057  -6.638
  345    H    GLU  44           H        GLU  44   6.309  -1.317  -6.142
  346    HA   GLU  44           HA       GLU  44   6.489  -1.987  -3.257
  347    HB2  GLU  44           2HB      GLU  44   8.544  -2.402  -4.566
  348    HB3  GLU  44           3HB      GLU  44   8.536  -0.741  -5.153
  349    HG2  GLU  44           2HG      GLU  44   8.730  -0.025  -2.691
  350    HG3  GLU  44           3HG      GLU  44   9.064  -1.715  -2.327
  351    H    ILE  45           H        ILE  45   5.226  -0.538  -2.194
  352    HA   ILE  45           HA       ILE  45   5.268   2.342  -2.878
  353    HB   ILE  45           HB       ILE  45   3.547   0.821  -0.852
  354   HG12  ILE  45          2HG1      ILE  45   2.759   1.886  -3.604
  355   HG13  ILE  45          3HG1      ILE  45   3.074   0.194  -3.235
  356   HG21  ILE  45          1HG2      ILE  45   2.178   2.877  -0.714
  357   HG22  ILE  45          2HG2      ILE  45   3.301   3.698  -1.799
  358   HG23  ILE  45          3HG2      ILE  45   3.842   3.177  -0.203
  359   HD11  ILE  45          3HD1      ILE  45   0.712   0.629  -3.322
  360   HD12  ILE  45          1HD1      ILE  45   0.859   1.878  -2.087
  361   HD13  ILE  45          2HD1      ILE  45   1.188   0.190  -1.682
  362    H    ARG  46           H        ARG  46   6.411   3.766  -1.570
  363    HA   ARG  46           HA       ARG  46   7.294   2.869   1.124
  364    HB2  ARG  46           2HB      ARG  46   8.758   4.777  -0.752
  365    HB3  ARG  46           3HB      ARG  46   9.286   4.309   0.861
  366    HG2  ARG  46           2HG      ARG  46   9.466   1.935   0.052
  367    HG3  ARG  46           3HG      ARG  46   9.078   2.512  -1.572
  368    HD2  ARG  46           2HD      ARG  46  11.500   2.236  -1.308
  369    HD3  ARG  46           3HD      ARG  46  11.095   3.939  -1.546
  370    HE   ARG  46           HE       ARG  46  11.175   3.934   1.063
  371   HH11  ARG  46          1HH1      ARG  46  13.449   2.271  -1.047
  372   HH12  ARG  46          2HH1      ARG  46  14.758   2.386   0.093
  373   HH21  ARG  46          1HH2      ARG  46  12.846   4.101   2.519
  374   HH22  ARG  46          2HH2      ARG  46  14.417   3.434   2.143
  375    H    ILE  47           H        ILE  47   6.000   3.849   2.514
  376    HA   ILE  47           HA       ILE  47   4.936   6.552   1.981
  377    HB   ILE  47           HB       ILE  47   4.035   4.498   4.060
  378   HG12  ILE  47          2HG1      ILE  47   2.859   5.367   1.383
  379   HG13  ILE  47          3HG1      ILE  47   3.475   3.771   1.783
  380   HG21  ILE  47          1HG2      ILE  47   3.637   6.824   4.844
  381   HG22  ILE  47          2HG2      ILE  47   2.111   6.024   4.460
  382   HG23  ILE  47          3HG2      ILE  47   2.803   7.191   3.332
  383   HD11  ILE  47          3HD1      ILE  47   1.098   3.736   1.702
  384   HD12  ILE  47          1HD1      ILE  47   0.982   5.070   2.847
  385   HD13  ILE  47          2HD1      ILE  47   1.607   3.507   3.374
  386    H    THR  48           H        THR  48   5.751   8.229   3.005
  387    HA   THR  48           HA       THR  48   7.668   7.879   5.241
  388    HB   THR  48           HB       THR  48   7.799  10.047   3.094
  389    HG1  THR  48           HG1      THR  48   9.277   7.622   2.994
  390   HG21  THR  48          3HG2      THR  48   9.173  10.427   5.127
  391   HG22  THR  48          1HG2      THR  48  10.177  10.177   3.696
  392   HG23  THR  48          2HG2      THR  48   9.974   8.875   4.868
  393    H    GLY  49           H        GLY  49   7.766   9.755   6.730
  394    HA2  GLY  49           2HA      GLY  49   7.161  11.809   7.607
  395    HA3  GLY  49           3HA      GLY  49   5.925  11.988   6.378
  396    H    VAL  50           H        VAL  50   4.399   9.676   6.840
  397    HA   VAL  50           HA       VAL  50   2.629  10.544   8.795
  398    HB   VAL  50           HB       VAL  50   1.483   8.346   8.545
  399   HG11  VAL  50          1HG1      VAL  50   1.009   8.466   6.115
  400   HG12  VAL  50          2HG1      VAL  50   2.404   9.525   5.896
  401   HG13  VAL  50          3HG1      VAL  50   1.027  10.067   6.858
  402   HG21  VAL  50          3HG2      VAL  50   2.393   6.604   7.048
  403   HG22  VAL  50          1HG2      VAL  50   3.443   6.867   8.444
  404   HG23  VAL  50          2HG2      VAL  50   3.885   7.534   6.871
  405    HA   PRO  51           HA       PRO  51   4.433   9.173  12.676
  406    HB2  PRO  51           2HB      PRO  51   2.172   9.107  14.283
  407    HB3  PRO  51           3HB      PRO  51   2.993  10.603  13.795
  408    HG2  PRO  51           2HG      PRO  51   0.536   9.350  12.653
  409    HG3  PRO  51           3HG      PRO  51   0.885  11.063  12.967
  410    HD2  PRO  51           2HD      PRO  51   1.053   9.986  10.476
  411    HD3  PRO  51           3HD      PRO  51   2.090  11.327  11.007
  412    H    GLU  52           H        GLU  52   4.095   7.538  14.457
  413    HA   GLU  52           HA       GLU  52   4.541   5.032  13.343
  414    HB2  GLU  52           2HB      GLU  52   5.413   5.865  15.560
  415    HB3  GLU  52           3HB      GLU  52   3.801   5.640  16.231
  416    HG2  GLU  52           2HG      GLU  52   5.112   3.753  16.893
  417    HG3  GLU  52           3HG      GLU  52   3.986   3.195  15.653
  418    H    GLN  53           H        GLN  53   1.768   6.074  15.341
  419    HA   GLN  53           HA       GLN  53   0.223   3.782  15.296
  420    HB2  GLN  53           2HB      GLN  53  -1.719   5.291  15.755
  421    HB3  GLN  53           3HB      GLN  53  -0.307   5.654  16.744
  422    HG2  GLN  53           2HG      GLN  53   0.205   7.618  15.524
  423    HG3  GLN  53           3HG      GLN  53  -0.880   7.187  14.202
  424   HE21  GLN  53          1HE2      GLN  53  -3.114   7.536  14.458
  425   HE22  GLN  53          2HE2      GLN  53  -3.749   8.524  15.731
  426    H    VAL  54           H        VAL  54   0.421   6.326  12.857
  427    HA   VAL  54           HA       VAL  54  -1.815   5.483  11.301
  428    HB   VAL  54           HB       VAL  54   0.473   7.417  10.799
  429   HG11  VAL  54          1HG1      VAL  54  -0.736   8.216   8.796
  430   HG12  VAL  54          2HG1      VAL  54  -1.868   6.871   8.948
  431   HG13  VAL  54          3HG1      VAL  54  -0.167   6.556   8.599
  432   HG21  VAL  54          3HG2      VAL  54  -1.309   9.117  11.028
  433   HG22  VAL  54          1HG2      VAL  54  -1.190   8.104  12.470
  434   HG23  VAL  54          2HG2      VAL  54  -2.491   7.836  11.307
  435    H    ARG  55           H        ARG  55   1.694   4.861  11.160
  436    HA   ARG  55           HA       ARG  55   1.733   3.461   8.697
  437    HB2  ARG  55           2HB      ARG  55   3.488   2.980  11.145
  438    HB3  ARG  55           3HB      ARG  55   3.831   2.439   9.503
  439    HG2  ARG  55           2HG      ARG  55   3.931   4.806   8.769
  440    HG3  ARG  55           3HG      ARG  55   3.671   5.308  10.441
  441    HD2  ARG  55           2HD      ARG  55   5.774   4.169  11.096
  442    HD3  ARG  55           3HD      ARG  55   6.040   3.707   9.408
  443    HE   ARG  55           HE       ARG  55   6.396   6.316  10.614
  444   HH11  ARG  55          1HH1      ARG  55   6.000   4.629   7.565
  445   HH12  ARG  55          2HH1      ARG  55   6.723   5.901   6.638
  446   HH21  ARG  55          1HH2      ARG  55   7.304   7.959   9.404
  447   HH22  ARG  55          2HH2      ARG  55   7.464   7.791   7.687
  448    H    LYS  56           H        LYS  56   1.133   2.397  12.030
  449    HA   LYS  56           HA       LYS  56   0.706  -0.348  11.535
  450    HB2  LYS  56           2HB      LYS  56  -0.495   1.369  13.749
  451    HB3  LYS  56           3HB      LYS  56  -0.317  -0.384  13.773
  452    HG2  LYS  56           2HG      LYS  56   2.132  -0.165  13.756
  453    HG3  LYS  56           3HG      LYS  56   1.984   1.586  13.651
  454    HD2  LYS  56           2HD      LYS  56   2.457   1.245  15.924
  455    HD3  LYS  56           3HD      LYS  56   0.703   1.407  15.919
  456    HE2  LYS  56           2HE      LYS  56   2.221  -1.226  15.995
  457    HE3  LYS  56           3HE      LYS  56   1.491  -0.432  17.385
  458    HZ1  LYS  56           3HZ      LYS  56   0.055  -1.516  15.028
  459    HZ2  LYS  56           1HZ      LYS  56  -0.678  -0.663  16.288
  460    HZ3  LYS  56           2HZ      LYS  56   0.060  -2.153  16.589
  461    H    GLU  57           H        GLU  57  -1.382   2.458  11.167
  462    HA   GLU  57           HA       GLU  57  -3.833   1.012  10.736
  463    HB2  GLU  57           2HB      GLU  57  -3.091   3.881  10.037
  464    HB3  GLU  57           3HB      GLU  57  -4.712   3.203   9.891
  465    HG2  GLU  57           2HG      GLU  57  -4.786   2.778  12.310
  466    HG3  GLU  57           3HG      GLU  57  -3.145   3.388  12.476
  467    H    LEU  58           H        LEU  58  -1.292   2.302   8.646
  468    HA   LEU  58           HA       LEU  58  -2.450   1.636   6.139
  469    HB2  LEU  58           2HB      LEU  58   0.307   2.380   7.088
  470    HB3  LEU  58           3HB      LEU  58   0.190   1.588   5.531
  471    HG   LEU  58           HG       LEU  58   0.291   3.959   5.154
  472   HD11  LEU  58          1HD1      LEU  58  -1.750   4.399   3.869
  473   HD12  LEU  58          2HD1      LEU  58  -2.557   3.038   4.654
  474   HD13  LEU  58          3HD1      LEU  58  -1.159   2.760   3.612
  475   HD21  LEU  58          3HD2      LEU  58  -2.101   4.323   6.981
  476   HD22  LEU  58          1HD2      LEU  58  -1.329   5.586   6.016
  477   HD23  LEU  58          2HD2      LEU  58  -0.439   4.806   7.321
  478    H    ALA  59           H        ALA  59  -0.804  -0.269   8.561
  479    HA   ALA  59           HA       ALA  59  -0.216  -2.579   7.087
  480    HB1  ALA  59           3HB      ALA  59   0.553  -2.193   9.387
  481    HB2  ALA  59           1HB      ALA  59  -0.279  -3.740   9.248
  482    HB3  ALA  59           2HB      ALA  59  -1.098  -2.360   9.987
  483    H    LYS  60           H        LYS  60  -3.223  -1.678   8.828
  484    HA   LYS  60           HA       LYS  60  -4.697  -3.983   8.038
  485    HB2  LYS  60           2HB      LYS  60  -5.604  -1.285   9.072
  486    HB3  LYS  60           3HB      LYS  60  -6.769  -2.478   8.522
  487    HG2  LYS  60           2HG      LYS  60  -6.739  -2.837  10.825
  488    HG3  LYS  60           3HG      LYS  60  -5.634  -4.079  10.240
  489    HD2  LYS  60           2HD      LYS  60  -4.640  -3.086  12.205
  490    HD3  LYS  60           3HD      LYS  60  -3.718  -2.514  10.809
  491    HE2  LYS  60           2HE      LYS  60  -4.128  -0.663  12.353
  492    HE3  LYS  60           3HE      LYS  60  -5.001  -0.390  10.850
  493    HZ1  LYS  60           3HZ      LYS  60  -6.141  -1.327  13.422
  494    HZ2  LYS  60           1HZ      LYS  60  -7.016  -1.211  11.980
  495    HZ3  LYS  60           2HZ      LYS  60  -6.376   0.178  12.693
  496    H    GLU  61           H        GLU  61  -4.226  -0.759   6.540
  497    HA   GLU  61           HA       GLU  61  -6.181  -1.047   4.510
  498    HB2  GLU  61           2HB      GLU  61  -3.608   0.585   4.478
  499    HB3  GLU  61           3HB      GLU  61  -4.923   0.757   3.322
  500    HG2  GLU  61           2HG      GLU  61  -4.976   1.390   6.274
  501    HG3  GLU  61           3HG      GLU  61  -5.116   2.523   4.931
  502    H    ALA  62           H        ALA  62  -2.745  -1.823   4.613
  503    HA   ALA  62           HA       ALA  62  -2.315  -2.706   2.026
  504    HB1  ALA  62           3HB      ALA  62  -1.069  -3.779   4.585
  505    HB2  ALA  62           1HB      ALA  62  -0.571  -2.313   3.736
  506    HB3  ALA  62           2HB      ALA  62  -0.386  -3.883   2.961
  507    H    GLU  63           H        GLU  63  -3.258  -4.671   4.866
  508    HA   GLU  63           HA       GLU  63  -3.371  -7.147   3.454
  509    HB2  GLU  63           2HB      GLU  63  -4.447  -6.311   6.169
  510    HB3  GLU  63           3HB      GLU  63  -4.449  -7.975   5.588
  511    HG2  GLU  63           2HG      GLU  63  -1.987  -7.958   5.468
  512    HG3  GLU  63           3HG      GLU  63  -1.968  -6.270   5.974
  513    H    ARG  64           H        ARG  64  -5.880  -4.730   4.278
  514    HA   ARG  64           HA       ARG  64  -8.082  -6.434   3.617
  515    HB2  ARG  64           2HB      ARG  64  -9.516  -4.470   3.788
  516    HB3  ARG  64           3HB      ARG  64  -8.378  -4.494   5.129
  517    HG2  ARG  64           2HG      ARG  64  -7.004  -2.804   4.028
  518    HG3  ARG  64           3HG      ARG  64  -8.088  -2.791   2.641
  519    HD2  ARG  64           2HD      ARG  64  -8.980  -2.082   5.449
  520    HD3  ARG  64           3HD      ARG  64  -8.370  -0.892   4.296
  521    HE   ARG  64           HE       ARG  64 -10.737  -2.582   3.719
  522   HH11  ARG  64          1HH1      ARG  64  -9.248   0.611   3.884
  523   HH12  ARG  64          2HH1      ARG  64 -10.625   1.403   3.170
  524   HH21  ARG  64          1HH2      ARG  64 -12.488  -1.540   2.744
  525   HH22  ARG  64          2HH2      ARG  64 -12.456   0.188   2.525
  526    H    LEU  65           H        LEU  65  -6.119  -4.116   1.795
  527    HA   LEU  65           HA       LEU  65  -7.718  -4.292  -0.611
  528    HB2  LEU  65           2HB      LEU  65  -4.927  -3.211  -0.107
  529    HB3  LEU  65           3HB      LEU  65  -5.755  -3.096  -1.650
  530    HG   LEU  65           HG       LEU  65  -6.644  -1.785   0.952
  531   HD11  LEU  65          1HD1      LEU  65  -4.694  -0.731  -0.097
  532   HD12  LEU  65          2HD1      LEU  65  -6.107   0.317  -0.145
  533   HD13  LEU  65          3HD1      LEU  65  -5.595  -0.541  -1.602
  534   HD21  LEU  65          3HD2      LEU  65  -8.419  -0.691  -0.375
  535   HD22  LEU  65          1HD2      LEU  65  -8.619  -2.442  -0.348
  536   HD23  LEU  65          2HD2      LEU  65  -7.966  -1.653  -1.785
  537    H    ALA  66           H        ALA  66  -4.990  -6.011   0.754
  538    HA   ALA  66           HA       ALA  66  -4.169  -7.409  -1.578
  539    HB1  ALA  66           3HB      ALA  66  -3.910  -8.261   1.321
  540    HB2  ALA  66           1HB      ALA  66  -2.769  -7.250   0.432
  541    HB3  ALA  66           2HB      ALA  66  -3.015  -8.930  -0.047
  542    H    LYS  67           H        LYS  67  -6.499  -8.241   1.007
  543    HA   LYS  67           HA       LYS  67  -7.202 -10.764  -0.218
  544    HB2  LYS  67           2HB      LYS  67  -8.841 -10.985   1.568
  545    HB3  LYS  67           3HB      LYS  67  -7.311 -10.432   2.233
  546    HG2  LYS  67           2HG      LYS  67  -8.238  -8.102   2.285
  547    HG3  LYS  67           3HG      LYS  67  -9.796  -8.750   1.771
  548    HD2  LYS  67           2HD      LYS  67  -8.323  -9.428   4.350
  549    HD3  LYS  67           3HD      LYS  67  -9.758  -8.415   4.207
  550    HE2  LYS  67           2HE      LYS  67 -11.081 -10.353   3.459
  551    HE3  LYS  67           3HE      LYS  67  -9.643 -11.378   3.529
  552    HZ1  LYS  67           3HZ      LYS  67  -9.530 -11.004   5.906
  553    HZ2  LYS  67           1HZ      LYS  67 -11.041 -11.634   5.490
  554    HZ3  LYS  67           2HZ      LYS  67 -10.878  -9.993   5.849
  555    H    GLU  68           H        GLU  68  -8.313  -7.467  -0.428
  556    HA   GLU  68           HA       GLU  68 -10.917  -7.874  -1.511
  557    HB2  GLU  68           2HB      GLU  68 -10.110  -5.729  -0.504
  558    HB3  GLU  68           3HB      GLU  68  -9.016  -5.509  -1.863
  559    HG2  GLU  68           2HG      GLU  68 -10.931  -4.084  -2.161
  560    HG3  GLU  68           3HG      GLU  68 -10.993  -5.360  -3.378
  561    H    PHE  69           H        PHE  69  -7.796  -7.067  -3.064
  562    HA   PHE  69           HA       PHE  69  -8.913  -7.499  -5.749
  563    HB2  PHE  69           2HB      PHE  69  -6.215  -6.375  -4.864
  564    HB3  PHE  69           3HB      PHE  69  -6.774  -6.469  -6.535
  565    HD1  PHE  69           HD1      PHE  69  -9.106  -5.312  -7.030
  566    HD2  PHE  69           HD2      PHE  69  -6.643  -4.352  -3.659
  567    HE1  PHE  69           HE1      PHE  69 -10.265  -3.157  -6.782
  568    HE2  PHE  69           HE2      PHE  69  -7.811  -2.193  -3.432
  569    HZ   PHE  69           HZ       PHE  69  -9.625  -1.600  -4.988
  570    H    ASN  70           H        ASN  70  -7.618  -9.457  -3.483
  571    HA   ASN  70           HA       ASN  70  -6.768 -11.536  -3.412
  572    HB2  ASN  70           2HB      ASN  70  -8.705 -11.927  -4.994
  573    HB3  ASN  70           3HB      ASN  70  -7.592 -11.737  -6.348
  574   HD21  ASN  70          1HD2      ASN  70  -8.076 -13.835  -7.042
  575   HD22  ASN  70          2HD2      ASN  70  -7.467 -15.242  -6.245
  576    H    ILE  71           H        ILE  71  -4.903  -9.757  -3.530
  577    HA   ILE  71           HA       ILE  71  -2.695 -10.925  -5.129
  578    HB   ILE  71           HB       ILE  71  -1.601  -8.627  -4.983
  579   HG12  ILE  71          2HG1      ILE  71  -4.377  -7.782  -4.011
  580   HG13  ILE  71          3HG1      ILE  71  -2.860  -7.612  -3.139
  581   HG21  ILE  71          1HG2      ILE  71  -4.202  -8.701  -6.548
  582   HG22  ILE  71          2HG2      ILE  71  -2.662  -9.383  -7.076
  583   HG23  ILE  71          3HG2      ILE  71  -2.827  -7.639  -6.869
  584   HD11  ILE  71          3HD1      ILE  71  -3.700  -6.094  -5.608
  585   HD12  ILE  71          1HD1      ILE  71  -2.124  -5.953  -4.823
  586   HD13  ILE  71          2HD1      ILE  71  -3.587  -5.476  -3.961
  587    H    THR  72           H        THR  72  -0.585 -10.724  -4.025
  588    HA   THR  72           HA       THR  72  -0.747 -11.313  -1.178
  589    HB   THR  72           HB       THR  72   1.806 -11.669  -1.485
  590    HG1  THR  72           HG1      THR  72   1.152 -11.586  -4.245
  591   HG21  THR  72          3HG2      THR  72   1.548 -13.835  -2.631
  592   HG22  THR  72          1HG2      THR  72  -0.050 -13.354  -3.202
  593   HG23  THR  72          2HG2      THR  72   0.239 -13.584  -1.476
  594    H    VAL  73           H        VAL  73   0.216 -10.043   0.455
  595    HA   VAL  73           HA       VAL  73   1.613  -7.571  -0.354
  596    HB   VAL  73           HB       VAL  73  -0.767  -7.057   0.377
  597   HG11  VAL  73          1HG1      VAL  73  -1.341  -7.085   2.779
  598   HG12  VAL  73          2HG1      VAL  73   0.180  -7.901   3.142
  599   HG13  VAL  73          3HG1      VAL  73  -1.047  -8.718   2.174
  600   HG21  VAL  73          3HG2      VAL  73   1.024  -5.362   0.424
  601   HG22  VAL  73          1HG2      VAL  73   1.409  -5.816   2.088
  602   HG23  VAL  73          2HG2      VAL  73  -0.160  -5.103   1.705
  603    H    THR  74           H        THR  74   3.297  -6.973   0.919
  604    HA   THR  74           HA       THR  74   3.757  -8.199   3.529
  605    HB   THR  74           HB       THR  74   5.163  -9.539   1.983
  606    HG1  THR  74           HG1      THR  74   6.641  -9.517   3.464
  607   HG21  THR  74          3HG2      THR  74   5.476  -7.916   0.143
  608   HG22  THR  74          1HG2      THR  74   7.027  -8.546   0.712
  609   HG23  THR  74          2HG2      THR  74   6.504  -6.931   1.187
  610    H    TYR  75           H        TYR  75   4.362  -6.608   4.942
  611    HA   TYR  75           HA       TYR  75   5.107  -3.948   3.896
  612    HB2  TYR  75           2HB      TYR  75   3.515  -2.838   5.441
  613    HB3  TYR  75           3HB      TYR  75   2.671  -3.847   4.272
  614    HD1  TYR  75           HD1      TYR  75   3.638  -3.554   7.866
  615    HD2  TYR  75           HD2      TYR  75   1.361  -5.787   5.003
  616    HE1  TYR  75           HE1      TYR  75   2.490  -4.725   9.685
  617    HE2  TYR  75           HE2      TYR  75   0.217  -6.947   6.849
  618    HH   TYR  75           HH       TYR  75   0.440  -7.424   9.153
  619    H    THR  76           H        THR  76   6.283  -2.676   5.373
  620    HA   THR  76           HA       THR  76   7.545  -4.178   7.590
  621    HB   THR  76           HB       THR  76   8.746  -2.040   5.770
  622    HG1  THR  76           HG1      THR  76   8.540  -3.893   4.583
  623   HG21  THR  76          3HG2      THR  76  10.073  -3.815   7.847
  624   HG22  THR  76          1HG2      THR  76   9.806  -2.076   8.010
  625   HG23  THR  76          2HG2      THR  76  10.902  -2.692   6.771
  626    H    ILE  77           H        ILE  77   7.008  -3.368   9.530
  627    HA   ILE  77           HA       ILE  77   7.312  -0.519  10.081
  628    HB   ILE  77           HB       ILE  77   5.244  -0.633  11.675
  629   HG12  ILE  77          2HG1      ILE  77   4.405  -2.847   9.742
  630   HG13  ILE  77          3HG1      ILE  77   4.769  -3.068  11.447
  631   HG21  ILE  77          1HG2      ILE  77   4.752  -0.440   8.698
  632   HG22  ILE  77          2HG2      ILE  77   5.325   0.859   9.746
  633   HG23  ILE  77          3HG2      ILE  77   3.703   0.201   9.963
  634   HD11  ILE  77          3HD1      ILE  77   2.384  -3.061  11.064
  635   HD12  ILE  77          1HD1      ILE  77   2.476  -1.466  10.314
  636   HD13  ILE  77          2HD1      ILE  77   2.845  -1.661  12.030
  637    H    ARG  78           H        ARG  78   8.888  -0.565  11.543
  638    HA   ARG  78           HA       ARG  78   8.874  -2.584  13.700
  639    HB2  ARG  78           2HB      ARG  78  11.035  -0.610  12.858
  640    HB3  ARG  78           3HB      ARG  78  11.169  -1.775  14.175
  641    HG2  ARG  78           2HG      ARG  78  10.793  -3.620  12.504
  642    HG3  ARG  78           3HG      ARG  78  10.874  -2.411  11.221
  643    HD2  ARG  78           2HD      ARG  78  13.179  -1.901  11.776
  644    HD3  ARG  78           3HD      ARG  78  13.097  -2.933  13.213
  645    HE   ARG  78           HE       ARG  78  12.435  -4.556  11.073
  646   HH11  ARG  78          1HH1      ARG  78  15.303  -2.764  12.048
  647   HH12  ARG  78          2HH1      ARG  78  16.392  -3.848  11.244
  648   HH21  ARG  78          1HH2      ARG  78  13.826  -5.947  10.029
  649   HH22  ARG  78          2HH2      ARG  78  15.541  -5.679  10.082
  650    H    GLY  79           H        GLY  79   7.260  -1.808  14.915
  651    HA2  GLY  79           2HA      GLY  79   6.961   1.015  15.540
  652    HA3  GLY  79           3HA      GLY  79   5.886  -0.287  16.013
  653    H    SER  80           H        SER  80   6.935  -1.863  17.592
  654    HA   SER  80           HA       SER  80   8.568  -0.524  19.632
  655    HB2  SER  80           2HB      SER  80   6.941  -1.325  21.410
  656    HB3  SER  80           3HB      SER  80   6.311  -0.047  20.376
  657    HG   SER  80           HG       SER  80   5.726  -2.478  19.344
  658    H    LEU  81           H        LEU  81  10.111  -1.903  18.646
  659    HA   LEU  81           HA       LEU  81  10.010  -4.771  19.257
  660    HB2  LEU  81           2HB      LEU  81  12.172  -3.078  17.950
  661    HB3  LEU  81           3HB      LEU  81  12.217  -4.828  18.110
  662    HG   LEU  81           HG       LEU  81  10.318  -3.199  16.384
  663   HD11  LEU  81          1HD1      LEU  81  11.357  -4.390  14.517
  664   HD12  LEU  81          2HD1      LEU  81  12.453  -5.214  15.629
  665   HD13  LEU  81          3HD1      LEU  81  12.544  -3.460  15.429
  666   HD21  LEU  81          3HD2      LEU  81  10.287  -6.202  16.853
  667   HD22  LEU  81          1HD2      LEU  81   9.345  -5.341  15.632
  668   HD23  LEU  81          2HD2      LEU  81   9.042  -5.048  17.340
  669    H    GLU  82           H        GLU  82  10.194  -2.448  21.254
  670    HA   GLU  82           HA       GLU  82  12.719  -2.967  22.590
  671    HB2  GLU  82           2HB      GLU  82  11.887  -1.274  24.256
  672    HB3  GLU  82           3HB      GLU  82  12.030  -0.658  22.618
  673    HG2  GLU  82           2HG      GLU  82   9.645  -0.638  22.320
  674    HG3  GLU  82           3HG      GLU  82   9.386  -1.568  23.795
  675    H    HIS  83           H        HIS  83  12.825  -4.814  23.786
  676    HA   HIS  83           HA       HIS  83  10.741  -5.331  25.804
  677    HB2  HIS  83           2HB      HIS  83  11.946  -7.299  24.859
  678    HB3  HIS  83           3HB      HIS  83  13.483  -6.623  25.385
  679    HD1  HIS  83           HD1      HIS  83  10.260  -8.015  26.847
  680    HD2  HIS  83           HD2      HIS  83  14.191  -7.286  27.987
  681    HE1  HIS  83           HE1      HIS  83  10.518  -9.056  29.116
  682    HE2  HIS  83           HE2      HIS  83  12.934  -8.744  29.699
  683    H    HIS  84           H        HIS  84  10.859  -3.158  26.427
  684    HA   HIS  84           HA       HIS  84  13.159  -1.702  27.092
  685    HB2  HIS  84           2HB      HIS  84  10.770  -0.871  26.494
  686    HB3  HIS  84           3HB      HIS  84  10.361  -1.160  28.176
  687    HD1  HIS  84           HD1      HIS  84  11.964   1.272  25.911
  688    HD2  HIS  84           HD2      HIS  84  11.664   0.648  30.009
  689    HE1  HIS  84           HE1      HIS  84  12.647   3.435  26.979
  690    HE2  HIS  84           HE2      HIS  84  12.403   3.057  29.449
  691    H    HIS  85           H        HIS  85  10.652  -3.006  29.235
  692    HA   HIS  85           HA       HIS  85  12.669  -4.268  30.946
  693    HB2  HIS  85           2HB      HIS  85  10.480  -2.381  31.944
  694    HB3  HIS  85           3HB      HIS  85  11.251  -3.560  33.000
  695    HD1  HIS  85           HD1      HIS  85  13.942  -3.235  33.232
  696    HD2  HIS  85           HD2      HIS  85  11.825   0.031  31.783
  697    HE1  HIS  85           HE1      HIS  85  15.467  -1.268  33.506
  698    HE2  HIS  85           HE2      HIS  85  14.216   0.668  32.512
  699    H    HIS  86           H        HIS  86  11.295  -5.803  32.549
  700    HA   HIS  86           HA       HIS  86   9.505  -7.417  31.039
  701    HB2  HIS  86           2HB      HIS  86   9.073  -8.661  33.095
  702    HB3  HIS  86           3HB      HIS  86  10.790  -8.303  32.996
  703    HD1  HIS  86           HD1      HIS  86  11.793  -6.803  34.832
  704    HD2  HIS  86           HD2      HIS  86   7.702  -7.390  35.247
  705    HE1  HIS  86           HE1      HIS  86  11.222  -5.993  37.129
  706    HE2  HIS  86           HE2      HIS  86   8.796  -6.544  37.428
  707    H    HIS  87           H        HIS  87   7.271  -7.361  30.891
  708    HA   HIS  87           HA       HIS  87   6.095  -4.796  31.199
  709    HB2  HIS  87           2HB      HIS  87   4.059  -5.699  30.223
  710    HB3  HIS  87           3HB      HIS  87   5.435  -6.351  29.345
  711    HD1  HIS  87           HD1      HIS  87   5.685  -8.884  29.284
  712    HD2  HIS  87           HD2      HIS  87   2.666  -7.643  31.858
  713    HE1  HIS  87           HE1      HIS  87   4.425 -10.959  29.916
  714    HE2  HIS  87           HE2      HIS  87   2.527 -10.165  31.346
  715    H    HIS  88           H        HIS  88   4.639  -4.001  32.662
  716    HA   HIS  88           HA       HIS  88   4.440  -5.171  35.262
  717    HB2  HIS  88           2HB      HIS  88   4.550  -2.759  35.006
  718    HB3  HIS  88           3HB      HIS  88   3.092  -2.730  34.021
  719    HD1  HIS  88           HD1      HIS  88   0.846  -2.747  35.249
  720    HD2  HIS  88           HD2      HIS  88   4.079  -3.178  37.825
  721    HE1  HIS  88           HE1      HIS  88  -0.091  -2.470  37.554
  722    HE2  HIS  88           HE2      HIS  88   1.854  -2.849  39.096
  Start of MODEL   10
    1    H1   MET   1           1H       MET   1  13.712   5.005   6.590
    2    H2   MET   1           2H       MET   1  15.395   4.988   6.756
    3    H3   MET   1           3H       MET   1  14.536   6.430   6.974
    4    HA   MET   1           HA       MET   1  14.243   4.020   8.659
    5    HB2  MET   1           2HB      MET   1  15.553   5.240  10.370
    6    HB3  MET   1           3HB      MET   1  16.497   4.990   8.908
    7    HG2  MET   1           2HG      MET   1  16.070   7.326   8.234
    8    HG3  MET   1           3HG      MET   1  15.134   7.574   9.710
    9    HE1  MET   1           3HE      MET   1  18.387   9.655  10.378
   10    HE2  MET   1           1HE      MET   1  16.626   9.692  10.317
   11    HE3  MET   1           2HE      MET   1  17.557   9.458   8.835
   12    H    GLY   2           H        GLY   2  12.460   6.356   7.351
   13    HA2  GLY   2           2HA      GLY   2  10.784   6.799   9.754
   14    HA3  GLY   2           3HA      GLY   2  11.311   8.184   8.803
   15    H    GLU   3           H        GLU   3  10.348   4.982   7.679
   16    HA   GLU   3           HA       GLU   3   7.906   6.005   6.402
   17    HB2  GLU   3           2HB      GLU   3   8.529   5.217   4.177
   18    HB3  GLU   3           3HB      GLU   3   9.712   6.387   4.729
   19    HG2  GLU   3           2HG      GLU   3  10.094   3.380   4.709
   20    HG3  GLU   3           3HG      GLU   3  10.731   4.498   3.507
   21    H    MET   4           H        MET   4   6.776   4.200   5.233
   22    HA   MET   4           HA       MET   4   7.225   1.509   6.381
   23    HB2  MET   4           2HB      MET   4   5.191   2.564   7.371
   24    HB3  MET   4           3HB      MET   4   4.544   2.849   5.765
   25    HG2  MET   4           2HG      MET   4   4.451   0.400   5.410
   26    HG3  MET   4           3HG      MET   4   5.046   0.162   7.059
   27    HE1  MET   4           3HE      MET   4   1.322  -0.840   7.501
   28    HE2  MET   4           1HE      MET   4   3.001  -1.302   7.765
   29    HE3  MET   4           2HE      MET   4   2.359  -1.198   6.123
   30    H    ASP   5           H        ASP   5   8.006   0.295   4.657
   31    HA   ASP   5           HA       ASP   5   7.245   0.822   1.937
   32    HB2  ASP   5           2HB      ASP   5   9.508  -0.058   2.742
   33    HB3  ASP   5           3HB      ASP   5   8.722  -1.583   3.126
   34    H    ILE   6           H        ILE   6   5.249   0.193   1.265
   35    HA   ILE   6           HA       ILE   6   4.022  -2.299   2.339
   36    HB   ILE   6           HB       ILE   6   2.595   0.128   1.126
   37   HG12  ILE   6          2HG1      ILE   6   2.750  -0.751   4.052
   38   HG13  ILE   6          3HG1      ILE   6   3.641   0.598   3.363
   39   HG21  ILE   6          1HG2      ILE   6   1.464  -2.365   2.464
   40   HG22  ILE   6          2HG2      ILE   6   1.387  -1.989   0.741
   41   HG23  ILE   6          3HG2      ILE   6   0.518  -0.985   1.901
   42   HD11  ILE   6          3HD1      ILE   6   0.661   0.381   3.635
   43   HD12  ILE   6          1HD1      ILE   6   1.522   1.714   2.861
   44   HD13  ILE   6          2HD1      ILE   6   1.756   1.390   4.578
   45    H    ARG   7           H        ARG   7   4.183  -3.865   0.876
   46    HA   ARG   7           HA       ARG   7   4.758  -3.159  -1.935
   47    HB2  ARG   7           2HB      ARG   7   6.773  -3.736  -0.544
   48    HB3  ARG   7           3HB      ARG   7   6.088  -5.333  -0.260
   49    HG2  ARG   7           2HG      ARG   7   6.267  -5.893  -2.612
   50    HG3  ARG   7           3HG      ARG   7   6.744  -4.241  -3.016
   51    HD2  ARG   7           2HD      ARG   7   8.339  -6.215  -1.351
   52    HD3  ARG   7           3HD      ARG   7   8.694  -5.703  -3.006
   53    HE   ARG   7           HE       ARG   7   8.555  -3.529  -1.105
   54   HH11  ARG   7          1HH1      ARG   7  10.726  -5.890  -2.582
   55   HH12  ARG   7          2HH1      ARG   7  12.145  -4.967  -2.212
   56   HH21  ARG   7          1HH2      ARG   7  10.404  -2.395  -0.577
   57   HH22  ARG   7          2HH2      ARG   7  11.962  -2.984  -1.075
   58    H    PHE   8           H        PHE   8   3.325  -4.002  -3.232
   59    HA   PHE   8           HA       PHE   8   1.701  -6.365  -2.484
   60    HB2  PHE   8           2HB      PHE   8   1.180  -4.087  -4.459
   61    HB3  PHE   8           3HB      PHE   8   0.170  -5.524  -4.358
   62    HD1  PHE   8           HD2      PHE   8  -1.332  -5.882  -2.438
   63    HD2  PHE   8           HD1      PHE   8   1.055  -2.337  -2.709
   64    HE1  PHE   8           HE2      PHE   8  -2.725  -4.809  -0.717
   65    HE2  PHE   8           HE1      PHE   8  -0.342  -1.279  -0.981
   66    HZ   PHE   8           HZ       PHE   8  -2.232  -2.507   0.015
   67    H    ARG   9           H        ARG   9   1.334  -7.961  -4.177
   68    HA   ARG   9           HA       ARG   9   2.792  -7.777  -6.687
   69    HB2  ARG   9           2HB      ARG   9   4.431  -8.815  -4.991
   70    HB3  ARG   9           3HB      ARG   9   3.339 -10.183  -4.875
   71    HG2  ARG   9           2HG      ARG   9   3.654 -10.728  -7.216
   72    HG3  ARG   9           3HG      ARG   9   4.594  -9.258  -7.480
   73    HD2  ARG   9           2HD      ARG   9   6.335 -10.157  -5.910
   74    HD3  ARG   9           3HD      ARG   9   5.407 -11.661  -5.810
   75    HE   ARG   9           HE       ARG   9   5.728 -11.332  -8.476
   76   HH11  ARG   9          1HH1      ARG   9   8.089 -11.380  -5.844
   77   HH12  ARG   9          2HH1      ARG   9   9.355 -11.996  -6.862
   78   HH21  ARG   9          1HH2      ARG   9   7.407 -12.109  -9.763
   79   HH22  ARG   9          2HH2      ARG   9   8.969 -12.405  -9.070
   80    H    GLY  10           H        GLY  10   1.719  -8.871  -8.270
   81    HA2  GLY  10           2HA      GLY  10  -0.120 -11.028  -7.808
   82    HA3  GLY  10           3HA      GLY  10  -0.960  -9.498  -8.063
   83    H    ASP  11           H        ASP  11  -1.042 -11.853  -9.718
   84    HA   ASP  11           HA       ASP  11   0.621 -11.698 -11.993
   85    HB2  ASP  11           2HB      ASP  11  -0.638 -13.733 -11.367
   86    HB3  ASP  11           3HB      ASP  11  -2.156 -12.930 -11.744
   87    H    ASP  12           H        ASP  12  -2.115  -9.810 -11.107
   88    HA   ASP  12           HA       ASP  12  -2.181  -8.553 -13.786
   89    HB2  ASP  12           2HB      ASP  12  -4.394  -9.405 -13.122
   90    HB3  ASP  12           3HB      ASP  12  -4.322  -8.496 -11.612
   91    H    LEU  13           H        LEU  13  -0.964  -6.865 -13.851
   92    HA   LEU  13           HA       LEU  13   0.220  -5.441 -11.767
   93    HB2  LEU  13           2HB      LEU  13   0.735  -5.654 -14.353
   94    HB3  LEU  13           3HB      LEU  13  -0.250  -4.217 -14.504
   95    HG   LEU  13           HG       LEU  13   2.316  -4.416 -12.867
   96   HD11  LEU  13          1HD1      LEU  13   2.791  -4.667 -15.235
   97   HD12  LEU  13          2HD1      LEU  13   3.357  -3.097 -14.677
   98   HD13  LEU  13          3HD1      LEU  13   1.865  -3.213 -15.617
   99   HD21  LEU  13          3HD2      LEU  13   0.870  -2.654 -11.978
  100   HD22  LEU  13          1HD2      LEU  13   0.702  -1.946 -13.585
  101   HD23  LEU  13          2HD2      LEU  13   2.275  -1.959 -12.779
  102    H    GLU  14           H        GLU  14  -2.947  -5.089 -13.211
  103    HA   GLU  14           HA       GLU  14  -3.266  -2.298 -12.454
  104    HB2  GLU  14           2HB      GLU  14  -5.245  -4.215 -13.746
  105    HB3  GLU  14           3HB      GLU  14  -5.639  -2.560 -13.283
  106    HG2  GLU  14           2HG      GLU  14  -3.611  -1.879 -14.769
  107    HG3  GLU  14           3HG      GLU  14  -3.752  -3.506 -15.439
  108    H    ALA  15           H        ALA  15  -4.166  -5.470 -11.174
  109    HA   ALA  15           HA       ALA  15  -6.041  -4.619  -9.226
  110    HB1  ALA  15           3HB      ALA  15  -4.122  -6.988  -9.137
  111    HB2  ALA  15           1HB      ALA  15  -5.743  -6.996  -9.833
  112    HB3  ALA  15           2HB      ALA  15  -5.531  -6.768  -8.096
  113    H    LEU  16           H        LEU  16  -2.550  -4.692  -9.360
  114    HA   LEU  16           HA       LEU  16  -1.952  -3.928  -6.686
  115    HB2  LEU  16           2HB      LEU  16  -0.286  -3.342  -9.166
  116    HB3  LEU  16           3HB      LEU  16   0.285  -3.434  -7.507
  117    HG   LEU  16           HG       LEU  16  -0.687  -5.752  -9.214
  118   HD11  LEU  16          1HD1      LEU  16   1.529  -4.952  -9.839
  119   HD12  LEU  16          2HD1      LEU  16   1.630  -6.541  -9.087
  120   HD13  LEU  16          3HD1      LEU  16   2.083  -5.101  -8.167
  121   HD21  LEU  16          3HD2      LEU  16   0.287  -5.824  -6.344
  122   HD22  LEU  16          1HD2      LEU  16  -0.086  -7.220  -7.355
  123   HD23  LEU  16          2HD2      LEU  16  -1.368  -6.108  -6.891
  124    H    GLU  17           H        GLU  17  -2.606  -2.168  -9.690
  125    HA   GLU  17           HA       GLU  17  -1.987   0.462  -8.774
  126    HB2  GLU  17           2HB      GLU  17  -3.725  -0.459 -11.109
  127    HB3  GLU  17           3HB      GLU  17  -3.244   1.214 -10.828
  128    HG2  GLU  17           2HG      GLU  17  -0.911   0.685 -11.184
  129    HG3  GLU  17           3HG      GLU  17  -1.269  -1.042 -11.245
  130    H    LYS  18           H        LYS  18  -4.947  -1.463  -8.664
  131    HA   LYS  18           HA       LYS  18  -6.693   0.677  -7.823
  132    HB2  LYS  18           2HB      LYS  18  -6.967  -2.339  -7.916
  133    HB3  LYS  18           3HB      LYS  18  -8.128  -1.404  -6.988
  134    HG2  LYS  18           2HG      LYS  18  -9.053  -1.875  -9.154
  135    HG3  LYS  18           3HG      LYS  18  -8.736  -0.143  -9.034
  136    HD2  LYS  18           2HD      LYS  18  -6.756  -0.355 -10.420
  137    HD3  LYS  18           3HD      LYS  18  -6.882  -2.120 -10.385
  138    HE2  LYS  18           2HE      LYS  18  -8.934  -0.281 -11.658
  139    HE3  LYS  18           3HE      LYS  18  -7.652  -1.119 -12.534
  140    HZ1  LYS  18           3HZ      LYS  18  -8.603  -3.225 -11.591
  141    HZ2  LYS  18           1HZ      LYS  18  -9.564  -2.435 -12.733
  142    HZ3  LYS  18           2HZ      LYS  18  -9.939  -2.318 -11.091
  143    H    ALA  19           H        ALA  19  -4.946  -1.959  -6.126
  144    HA   ALA  19           HA       ALA  19  -5.517  -1.246  -3.473
  145    HB1  ALA  19           3HB      ALA  19  -3.427  -2.434  -2.905
  146    HB2  ALA  19           1HB      ALA  19  -2.939  -2.395  -4.607
  147    HB3  ALA  19           2HB      ALA  19  -4.351  -3.328  -4.113
  148    H    LEU  20           H        LEU  20  -2.924  -0.183  -5.630
  149    HA   LEU  20           HA       LEU  20  -1.496   1.602  -4.043
  150    HB2  LEU  20           2HB      LEU  20  -0.702   0.764  -6.204
  151    HB3  LEU  20           3HB      LEU  20  -1.993   1.598  -7.045
  152    HG   LEU  20           HG       LEU  20  -0.963   3.787  -6.431
  153   HD11  LEU  20          1HD1      LEU  20   1.308   3.899  -5.522
  154   HD12  LEU  20          2HD1      LEU  20   1.306   2.154  -5.259
  155   HD13  LEU  20          3HD1      LEU  20   0.183   3.186  -4.369
  156   HD21  LEU  20          3HD2      LEU  20  -0.463   2.760  -8.600
  157   HD22  LEU  20          1HD2      LEU  20   0.912   1.901  -7.901
  158   HD23  LEU  20          2HD2      LEU  20   0.924   3.664  -7.999
  159    H    LYS  21           H        LYS  21  -4.353   2.163  -6.065
  160    HA   LYS  21           HA       LYS  21  -4.608   4.937  -6.016
  161    HB2  LYS  21           2HB      LYS  21  -6.039   3.409  -7.370
  162    HB3  LYS  21           3HB      LYS  21  -6.812   2.828  -5.901
  163    HG2  LYS  21           2HG      LYS  21  -7.581   5.258  -5.525
  164    HG3  LYS  21           3HG      LYS  21  -7.072   5.569  -7.184
  165    HD2  LYS  21           2HD      LYS  21  -9.234   3.660  -6.230
  166    HD3  LYS  21           3HD      LYS  21  -9.452   5.123  -7.187
  167    HE2  LYS  21           2HE      LYS  21  -8.099   2.564  -8.104
  168    HE3  LYS  21           3HE      LYS  21  -9.692   3.135  -8.588
  169    HZ1  LYS  21           3HZ      LYS  21  -8.039   3.611 -10.267
  170    HZ2  LYS  21           1HZ      LYS  21  -7.129   4.516  -9.169
  171    HZ3  LYS  21           2HZ      LYS  21  -8.663   5.043  -9.633
  172    H    GLU  22           H        GLU  22  -5.831   2.509  -3.753
  173    HA   GLU  22           HA       GLU  22  -7.028   4.356  -1.929
  174    HB2  GLU  22           2HB      GLU  22  -6.383   1.393  -1.684
  175    HB3  GLU  22           3HB      GLU  22  -7.234   2.309  -0.445
  176    HG2  GLU  22           2HG      GLU  22  -8.188   1.882  -3.290
  177    HG3  GLU  22           3HG      GLU  22  -8.785   1.037  -1.861
  178    H    MET  23           H        MET  23  -3.859   2.567  -1.936
  179    HA   MET  23           HA       MET  23  -3.110   3.405   0.666
  180    HB2  MET  23           2HB      MET  23  -1.262   2.600  -1.623
  181    HB3  MET  23           3HB      MET  23  -0.841   2.639   0.088
  182    HG2  MET  23           2HG      MET  23  -2.772   0.772  -1.288
  183    HG3  MET  23           3HG      MET  23  -1.246   0.355  -0.520
  184    HE1  MET  23           3HE      MET  23  -2.130   0.599   3.272
  185    HE2  MET  23           1HE      MET  23  -1.336   1.829   2.289
  186    HE3  MET  23           2HE      MET  23  -0.921   0.127   2.076
  187    H    ILE  24           H        ILE  24  -2.706   4.951  -2.486
  188    HA   ILE  24           HA       ILE  24  -1.089   7.152  -1.612
  189    HB   ILE  24           HB       ILE  24  -2.975   6.935  -4.023
  190   HG12  ILE  24          2HG1      ILE  24   0.073   6.747  -3.871
  191   HG13  ILE  24          3HG1      ILE  24  -1.021   5.397  -4.132
  192   HG21  ILE  24          1HG2      ILE  24  -0.957   9.138  -3.431
  193   HG22  ILE  24          2HG2      ILE  24  -2.713   9.312  -3.420
  194   HG23  ILE  24          3HG2      ILE  24  -1.869   8.966  -4.930
  195   HD11  ILE  24          3HD1      ILE  24   0.025   6.063  -6.194
  196   HD12  ILE  24          1HD1      ILE  24  -0.575   7.711  -6.007
  197   HD13  ILE  24          2HD1      ILE  24  -1.708   6.382  -6.266
  198    H    ARG  25           H        ARG  25  -4.585   6.616  -2.039
  199    HA   ARG  25           HA       ARG  25  -5.644   9.078  -1.280
  200    HB2  ARG  25           2HB      ARG  25  -7.032   7.313  -2.248
  201    HB3  ARG  25           3HB      ARG  25  -6.728   6.256  -0.878
  202    HG2  ARG  25           2HG      ARG  25  -7.981   7.912   0.569
  203    HG3  ARG  25           3HG      ARG  25  -8.404   8.787  -0.904
  204    HD2  ARG  25           2HD      ARG  25  -9.572   6.788  -1.766
  205    HD3  ARG  25           3HD      ARG  25  -9.124   5.889  -0.310
  206    HE   ARG  25           HE       ARG  25 -10.639   8.343   0.084
  207   HH11  ARG  25          1HH1      ARG  25 -10.822   4.829  -0.184
  208   HH12  ARG  25          2HH1      ARG  25 -12.370   4.748   0.591
  209   HH21  ARG  25          1HH2      ARG  25 -12.669   8.199   1.083
  210   HH22  ARG  25          2HH2      ARG  25 -13.416   6.649   1.307
  211    H    GLN  26           H        GLN  26  -4.658   6.323   0.724
  212    HA   GLN  26           HA       GLN  26  -5.496   7.367   3.236
  213    HB2  GLN  26           2HB      GLN  26  -3.365   5.263   2.655
  214    HB3  GLN  26           3HB      GLN  26  -4.061   5.598   4.235
  215    HG2  GLN  26           2HG      GLN  26  -5.490   4.435   1.839
  216    HG3  GLN  26           3HG      GLN  26  -5.043   3.587   3.310
  217   HE21  GLN  26          1HE2      GLN  26  -7.665   4.018   1.994
  218   HE22  GLN  26          2HE2      GLN  26  -8.679   4.708   3.209
  219    H    ALA  27           H        ALA  27  -2.347   7.250   1.562
  220    HA   ALA  27           HA       ALA  27  -0.823   8.563   3.540
  221    HB1  ALA  27           3HB      ALA  27   0.158   7.223   1.740
  222    HB2  ALA  27           1HB      ALA  27   0.864   8.837   1.781
  223    HB3  ALA  27           2HB      ALA  27  -0.338   8.428   0.551
  224    H    ARG  28           H        ARG  28  -3.013   9.860   1.145
  225    HA   ARG  28           HA       ARG  28  -2.037  12.590   1.306
  226    HB2  ARG  28           2HB      ARG  28  -4.631  11.498   0.131
  227    HB3  ARG  28           3HB      ARG  28  -4.083  13.166  -0.010
  228    HG2  ARG  28           2HG      ARG  28  -2.058  12.326  -1.262
  229    HG3  ARG  28           3HG      ARG  28  -2.760  10.717  -1.209
  230    HD2  ARG  28           2HD      ARG  28  -4.008  13.145  -2.537
  231    HD3  ARG  28           3HD      ARG  28  -3.208  11.808  -3.365
  232    HE   ARG  28           HE       ARG  28  -5.003  10.347  -2.638
  233   HH11  ARG  28          1HH1      ARG  28  -5.665  13.802  -2.369
  234   HH12  ARG  28          2HH1      ARG  28  -7.389  13.587  -2.369
  235   HH21  ARG  28          1HH2      ARG  28  -7.269  10.100  -2.581
  236   HH22  ARG  28          2HH2      ARG  28  -8.289  11.498  -2.489
  237    H    LYS  29           H        LYS  29  -4.860  10.775   2.611
  238    HA   LYS  29           HA       LYS  29  -5.987  13.036   3.987
  239    HB2  LYS  29           2HB      LYS  29  -7.521  11.415   5.064
  240    HB3  LYS  29           3HB      LYS  29  -7.449  11.196   3.322
  241    HG2  LYS  29           2HG      LYS  29  -6.030   9.239   3.573
  242    HG3  LYS  29           3HG      LYS  29  -5.944   9.477   5.316
  243    HD2  LYS  29           2HD      LYS  29  -8.503   8.864   3.775
  244    HD3  LYS  29           3HD      LYS  29  -7.535   7.669   4.640
  245    HE2  LYS  29           2HE      LYS  29  -7.921   8.919   6.755
  246    HE3  LYS  29           3HE      LYS  29  -8.944  10.055   5.874
  247    HZ1  LYS  29           3HZ      LYS  29  -9.455   7.146   6.177
  248    HZ2  LYS  29           1HZ      LYS  29 -10.439   8.227   5.338
  249    HZ3  LYS  29           2HZ      LYS  29 -10.250   8.378   7.013
  250    H    PHE  30           H        PHE  30  -3.699  10.531   4.903
  251    HA   PHE  30           HA       PHE  30  -3.613  11.294   7.718
  252    HB2  PHE  30           2HB      PHE  30  -1.946   9.334   6.082
  253    HB3  PHE  30           3HB      PHE  30  -1.697   9.616   7.802
  254    HD1  PHE  30           HD1      PHE  30  -4.239   9.604   9.057
  255    HD2  PHE  30           HD2      PHE  30  -2.968   7.254   5.727
  256    HE1  PHE  30           HE1      PHE  30  -5.920   7.893   9.611
  257    HE2  PHE  30           HE2      PHE  30  -4.656   5.545   6.285
  258    HZ   PHE  30           HZ       PHE  30  -6.135   5.868   8.227
  259    H    ALA  31           H        ALA  31  -2.440  12.656   4.954
  260    HA   ALA  31           HA       ALA  31  -1.005  14.288   4.433
  261    HB1  ALA  31           3HB      ALA  31  -0.954  14.850   7.413
  262    HB2  ALA  31           1HB      ALA  31  -2.146  15.466   6.267
  263    HB3  ALA  31           2HB      ALA  31  -0.458  15.961   6.132
  264    H    GLY  32           H        GLY  32   0.339  12.439   3.855
  265    HA2  GLY  32           2HA      GLY  32   3.051  12.758   4.953
  266    HA3  GLY  32           3HA      GLY  32   2.371  11.138   4.792
  267    H    THR  33           H        THR  33   4.450  11.148   3.412
  268    HA   THR  33           HA       THR  33   4.019  12.080   0.652
  269    HB   THR  33           HB       THR  33   6.492  10.925   2.052
  270    HG1  THR  33           HG1      THR  33   5.645  13.545   1.377
  271   HG21  THR  33          3HG2      THR  33   6.538  10.383  -0.366
  272   HG22  THR  33          1HG2      THR  33   7.759  11.594   0.038
  273   HG23  THR  33          2HG2      THR  33   6.261  12.082  -0.754
  274    H    VAL  34           H        VAL  34   3.884  10.542  -1.046
  275    HA   VAL  34           HA       VAL  34   4.067   7.683  -0.393
  276    HB   VAL  34           HB       VAL  34   1.685   8.192  -0.249
  277   HG11  VAL  34          1HG1      VAL  34   0.347   9.029  -2.127
  278   HG12  VAL  34          2HG1      VAL  34   1.817   9.269  -3.074
  279   HG13  VAL  34          3HG1      VAL  34   1.551  10.213  -1.606
  280   HG21  VAL  34          3HG2      VAL  34   2.310   6.649  -2.787
  281   HG22  VAL  34          1HG2      VAL  34   0.792   6.577  -1.886
  282   HG23  VAL  34          2HG2      VAL  34   2.286   5.999  -1.146
  283    H    THR  35           H        THR  35   5.450   6.824  -1.712
  284    HA   THR  35           HA       THR  35   5.683   7.680  -4.542
  285    HB   THR  35           HB       THR  35   8.020   6.632  -2.858
  286    HG1  THR  35           HG1      THR  35   7.122   9.309  -3.219
  287   HG21  THR  35          3HG2      THR  35   7.949   8.264  -5.426
  288   HG22  THR  35          1HG2      THR  35   8.286   6.532  -5.327
  289   HG23  THR  35          2HG2      THR  35   9.398   7.691  -4.596
  290    H    TYR  36           H        TYR  36   6.403   5.818  -5.947
  291    HA   TYR  36           HA       TYR  36   6.167   3.149  -4.823
  292    HB2  TYR  36           2HB      TYR  36   4.301   2.452  -6.297
  293    HB3  TYR  36           3HB      TYR  36   3.808   3.682  -5.146
  294    HD1  TYR  36           HD2      TYR  36   3.160   5.936  -5.913
  295    HD2  TYR  36           HD1      TYR  36   4.380   2.953  -8.733
  296    HE1  TYR  36           HE2      TYR  36   2.267   7.297  -7.749
  297    HE2  TYR  36           HE1      TYR  36   3.479   4.325 -10.562
  298    HH   TYR  36           HH       TYR  36   1.899   6.104 -10.935
  299    H    THR  37           H        THR  37   6.576   1.459  -6.351
  300    HA   THR  37           HA       THR  37   7.827   2.211  -8.918
  301    HB   THR  37           HB       THR  37   8.960   0.233  -6.871
  302    HG1  THR  37           HG1      THR  37   9.541   2.880  -7.589
  303   HG21  THR  37          3HG2      THR  37   9.358  -0.598  -9.171
  304   HG22  THR  37          1HG2      THR  37  10.865  -0.035  -8.444
  305   HG23  THR  37          2HG2      THR  37  10.029   0.967  -9.630
  306    H    LEU  38           H        LEU  38   6.421   1.368 -10.358
  307    HA   LEU  38           HA       LEU  38   5.237  -1.307 -10.001
  308    HB2  LEU  38           2HB      LEU  38   4.840   0.878 -12.090
  309    HB3  LEU  38           3HB      LEU  38   4.083  -0.703 -12.213
  310    HG   LEU  38           HG       LEU  38   3.605   1.247  -9.922
  311   HD11  LEU  38          1HD1      LEU  38   1.833   0.682 -12.322
  312   HD12  LEU  38          2HD1      LEU  38   2.715   2.178 -11.999
  313   HD13  LEU  38          3HD1      LEU  38   1.409   1.681 -10.928
  314   HD21  LEU  38          3HD2      LEU  38   2.194  -1.344 -10.630
  315   HD22  LEU  38          1HD2      LEU  38   1.715  -0.225  -9.352
  316   HD23  LEU  38          2HD2      LEU  38   3.258  -1.068  -9.248
  317    H    ASP  39           H        ASP  39   6.499  -2.978 -10.622
  318    HA   ASP  39           HA       ASP  39   8.022  -2.839 -13.155
  319    HB2  ASP  39           2HB      ASP  39   9.612  -2.546 -11.234
  320    HB3  ASP  39           3HB      ASP  39   9.059  -4.070 -10.549
  321    H    GLY  40           H        GLY  40   6.748  -4.171 -14.357
  322    HA2  GLY  40           2HA      GLY  40   6.100  -6.155 -15.284
  323    HA3  GLY  40           3HA      GLY  40   7.024  -6.987 -14.045
  324    H    ASN  41           H        ASN  41   5.963  -7.424 -11.992
  325    HA   ASN  41           HA       ASN  41   3.033  -7.159 -11.858
  326    HB2  ASN  41           2HB      ASN  41   4.534  -9.801 -11.848
  327    HB3  ASN  41           3HB      ASN  41   2.955  -9.646 -11.082
  328   HD21  ASN  41          1HD2      ASN  41   1.220  -8.776 -12.468
  329   HD22  ASN  41          2HD2      ASN  41   1.166  -9.301 -14.113
  330    H    ASP  42           H        ASP  42   5.499  -6.101 -10.412
  331    HA   ASP  42           HA       ASP  42   4.427  -6.587  -7.712
  332    HB2  ASP  42           2HB      ASP  42   6.711  -6.608  -6.733
  333    HB3  ASP  42           3HB      ASP  42   6.415  -7.973  -7.794
  334    H    LEU  43           H        LEU  43   4.466  -4.922  -6.354
  335    HA   LEU  43           HA       LEU  43   5.106  -2.210  -7.344
  336    HB2  LEU  43           2HB      LEU  43   2.733  -2.482  -7.547
  337    HB3  LEU  43           3HB      LEU  43   2.612  -3.326  -6.012
  338    HG   LEU  43           HG       LEU  43   3.067  -1.200  -4.806
  339   HD11  LEU  43          1HD1      LEU  43   3.005   0.146  -7.517
  340   HD12  LEU  43          2HD1      LEU  43   4.411  -0.018  -6.466
  341   HD13  LEU  43          3HD1      LEU  43   3.039   0.960  -5.951
  342   HD21  LEU  43          3HD2      LEU  43   0.766  -1.917  -5.217
  343   HD22  LEU  43          1HD2      LEU  43   0.747  -1.039  -6.749
  344   HD23  LEU  43          2HD2      LEU  43   0.889  -0.160  -5.224
  345    H    GLU  44           H        GLU  44   6.459  -1.162  -5.994
  346    HA   GLU  44           HA       GLU  44   6.647  -1.881  -3.115
  347    HB2  GLU  44           2HB      GLU  44   8.764  -2.261  -4.321
  348    HB3  GLU  44           3HB      GLU  44   8.702  -0.644  -5.019
  349    HG2  GLU  44           2HG      GLU  44   8.804   0.219  -2.581
  350    HG3  GLU  44           3HG      GLU  44   9.264  -1.424  -2.144
  351    H    ILE  45           H        ILE  45   5.153  -0.442  -2.205
  352    HA   ILE  45           HA       ILE  45   5.202   2.433  -2.895
  353    HB   ILE  45           HB       ILE  45   3.475   1.028  -0.787
  354   HG12  ILE  45          2HG1      ILE  45   2.667   1.717  -3.652
  355   HG13  ILE  45          3HG1      ILE  45   3.075   0.100  -3.091
  356   HG21  ILE  45          1HG2      ILE  45   2.031   3.032  -0.930
  357   HG22  ILE  45          2HG2      ILE  45   3.135   3.754  -2.101
  358   HG23  ILE  45          3HG2      ILE  45   3.675   3.460  -0.448
  359   HD11  ILE  45          3HD1      ILE  45   0.687   0.392  -3.229
  360   HD12  ILE  45          1HD1      ILE  45   0.757   1.766  -2.124
  361   HD13  ILE  45          2HD1      ILE  45   1.179   0.148  -1.555
  362    H    ARG  46           H        ARG  46   6.164   3.947  -1.545
  363    HA   ARG  46           HA       ARG  46   7.042   3.169   1.182
  364    HB2  ARG  46           2HB      ARG  46   8.409   5.177  -0.674
  365    HB3  ARG  46           3HB      ARG  46   8.966   4.681   0.921
  366    HG2  ARG  46           2HG      ARG  46   9.379   2.390   0.053
  367    HG3  ARG  46           3HG      ARG  46   8.825   2.907  -1.540
  368    HD2  ARG  46           2HD      ARG  46  10.680   4.613  -1.561
  369    HD3  ARG  46           3HD      ARG  46  11.276   3.909  -0.053
  370    HE   ARG  46           HE       ARG  46  10.976   1.943  -2.106
  371   HH11  ARG  46          1HH1      ARG  46  13.157   4.499  -1.022
  372   HH12  ARG  46          2HH1      ARG  46  14.547   3.783  -1.772
  373   HH21  ARG  46          1HH2      ARG  46  12.812   1.036  -3.093
  374   HH22  ARG  46          2HH2      ARG  46  14.353   1.826  -2.943
  375    H    ILE  47           H        ILE  47   5.588   4.092   2.487
  376    HA   ILE  47           HA       ILE  47   4.575   6.820   1.960
  377    HB   ILE  47           HB       ILE  47   3.439   4.725   3.873
  378   HG12  ILE  47          2HG1      ILE  47   2.470   5.677   1.130
  379   HG13  ILE  47          3HG1      ILE  47   3.104   4.082   1.510
  380   HG21  ILE  47          1HG2      ILE  47   1.524   6.282   4.130
  381   HG22  ILE  47          2HG2      ILE  47   2.339   7.462   3.100
  382   HG23  ILE  47          3HG2      ILE  47   3.028   7.036   4.667
  383   HD11  ILE  47          3HD1      ILE  47   0.512   5.256   2.488
  384   HD12  ILE  47          1HD1      ILE  47   1.158   3.678   2.952
  385   HD13  ILE  47          2HD1      ILE  47   0.728   3.998   1.273
  386    H    THR  48           H        THR  48   5.636   8.357   2.974
  387    HA   THR  48           HA       THR  48   7.349   7.739   5.315
  388    HB   THR  48           HB       THR  48   7.854   9.835   3.142
  389    HG1  THR  48           HG1      THR  48   8.206   7.107   3.077
  390   HG21  THR  48          3HG2      THR  48   9.769   8.548   5.130
  391   HG22  THR  48          1HG2      THR  48   9.122  10.188   5.254
  392   HG23  THR  48          2HG2      THR  48  10.189   9.756   3.917
  393    H    GLY  49           H        GLY  49   7.716   9.548   6.811
  394    HA2  GLY  49           2HA      GLY  49   7.368  11.640   7.771
  395    HA3  GLY  49           3HA      GLY  49   6.127  11.997   6.584
  396    H    VAL  50           H        VAL  50   4.508   9.681   7.001
  397    HA   VAL  50           HA       VAL  50   2.968  10.331   9.260
  398    HB   VAL  50           HB       VAL  50   1.727   8.219   8.839
  399   HG11  VAL  50          1HG1      VAL  50   1.152  10.206   7.510
  400   HG12  VAL  50          2HG1      VAL  50   0.907   8.734   6.572
  401   HG13  VAL  50          3HG1      VAL  50   2.324   9.745   6.273
  402   HG21  VAL  50          3HG2      VAL  50   2.343   6.696   7.000
  403   HG22  VAL  50          1HG2      VAL  50   3.598   6.735   8.240
  404   HG23  VAL  50          2HG2      VAL  50   3.831   7.608   6.724
  405    HA   PRO  51           HA       PRO  51   5.386   8.190  12.468
  406    HB2  PRO  51           2HB      PRO  51   3.524   8.254  14.495
  407    HB3  PRO  51           3HB      PRO  51   4.459   9.681  14.003
  408    HG2  PRO  51           2HG      PRO  51   1.656   8.928  13.264
  409    HG3  PRO  51           3HG      PRO  51   2.305  10.513  13.742
  410    HD2  PRO  51           2HD      PRO  51   1.845   9.863  11.139
  411    HD3  PRO  51           3HD      PRO  51   3.171  10.950  11.627
  412    H    GLU  52           H        GLU  52   5.172   6.179  13.843
  413    HA   GLU  52           HA       GLU  52   4.352   4.121  12.073
  414    HB2  GLU  52           2HB      GLU  52   6.361   3.937  13.549
  415    HB3  GLU  52           3HB      GLU  52   5.297   3.760  14.944
  416    HG2  GLU  52           2HG      GLU  52   4.358   1.694  13.975
  417    HG3  GLU  52           3HG      GLU  52   5.382   1.888  12.554
  418    H    GLN  53           H        GLN  53   2.788   5.552  14.858
  419    HA   GLN  53           HA       GLN  53   0.769   3.677  15.381
  420    HB2  GLN  53           2HB      GLN  53  -0.579   5.575  16.243
  421    HB3  GLN  53           3HB      GLN  53   1.083   5.660  16.811
  422    HG2  GLN  53           2HG      GLN  53   1.606   7.489  15.383
  423    HG3  GLN  53           3HG      GLN  53   0.165   7.237  14.397
  424   HE21  GLN  53          1HE2      GLN  53  -1.856   7.941  15.189
  425   HE22  GLN  53          2HE2      GLN  53  -1.981   9.097  16.469
  426    H    VAL  54           H        VAL  54   1.010   6.153  12.877
  427    HA   VAL  54           HA       VAL  54  -1.604   5.712  11.734
  428    HB   VAL  54           HB       VAL  54   0.818   7.285  10.732
  429   HG11  VAL  54          1HG1      VAL  54  -0.526   6.596   8.802
  430   HG12  VAL  54          2HG1      VAL  54  -0.686   8.329   9.075
  431   HG13  VAL  54          3HG1      VAL  54  -1.987   7.239   9.561
  432   HG21  VAL  54          3HG2      VAL  54  -0.194   8.214  12.770
  433   HG22  VAL  54          1HG2      VAL  54  -1.780   8.241  11.994
  434   HG23  VAL  54          2HG2      VAL  54  -0.483   9.279  11.394
  435    H    ARG  55           H        ARG  55   1.722   4.666  11.104
  436    HA   ARG  55           HA       ARG  55   1.319   3.336   8.641
  437    HB2  ARG  55           2HB      ARG  55   3.315   2.702  10.850
  438    HB3  ARG  55           3HB      ARG  55   3.393   2.095   9.204
  439    HG2  ARG  55           2HG      ARG  55   3.730   4.373   8.347
  440    HG3  ARG  55           3HG      ARG  55   3.573   5.019   9.984
  441    HD2  ARG  55           2HD      ARG  55   5.568   3.419  10.552
  442    HD3  ARG  55           3HD      ARG  55   5.821   3.384   8.806
  443    HE   ARG  55           HE       ARG  55   5.756   6.007   9.218
  444   HH11  ARG  55          1HH1      ARG  55   7.418   3.486  10.997
  445   HH12  ARG  55          2HH1      ARG  55   8.710   4.510  11.513
  446   HH21  ARG  55          1HH2      ARG  55   7.420   7.399   9.983
  447   HH22  ARG  55          2HH2      ARG  55   8.713   6.739  10.936
  448    H    LYS  56           H        LYS  56   0.696   2.349  11.981
  449    HA   LYS  56           HA       LYS  56   0.149  -0.388  11.572
  450    HB2  LYS  56           2HB      LYS  56  -1.161   1.518  13.568
  451    HB3  LYS  56           3HB      LYS  56  -1.262  -0.238  13.639
  452    HG2  LYS  56           2HG      LYS  56   1.260   1.405  13.915
  453    HG3  LYS  56           3HG      LYS  56   0.370   0.666  15.240
  454    HD2  LYS  56           2HD      LYS  56   0.902  -1.580  14.366
  455    HD3  LYS  56           3HD      LYS  56   1.722  -0.861  12.975
  456    HE2  LYS  56           2HE      LYS  56   3.412   0.126  14.437
  457    HE3  LYS  56           3HE      LYS  56   2.569  -0.470  15.868
  458    HZ1  LYS  56           3HZ      LYS  56   3.777  -2.186  13.758
  459    HZ2  LYS  56           1HZ      LYS  56   3.021  -2.728  15.168
  460    HZ3  LYS  56           2HZ      LYS  56   4.465  -1.857  15.266
  461    H    GLU  57           H        GLU  57  -1.868   2.514  11.160
  462    HA   GLU  57           HA       GLU  57  -4.317   1.225  10.505
  463    HB2  GLU  57           2HB      GLU  57  -3.409   3.937   9.411
  464    HB3  GLU  57           3HB      GLU  57  -5.064   3.383   9.636
  465    HG2  GLU  57           2HG      GLU  57  -3.063   4.088  11.788
  466    HG3  GLU  57           3HG      GLU  57  -4.510   4.995  11.348
  467    H    LEU  58           H        LEU  58  -1.603   2.426   8.573
  468    HA   LEU  58           HA       LEU  58  -2.552   1.810   5.986
  469    HB2  LEU  58           2HB      LEU  58   0.180   2.361   7.149
  470    HB3  LEU  58           3HB      LEU  58   0.079   1.738   5.519
  471    HG   LEU  58           HG       LEU  58   0.310   4.124   5.381
  472   HD11  LEU  58          1HD1      LEU  58  -1.661   4.769   4.088
  473   HD12  LEU  58          2HD1      LEU  58  -2.560   3.395   4.736
  474   HD13  LEU  58          3HD1      LEU  58  -1.150   3.126   3.708
  475   HD21  LEU  58          3HD2      LEU  58  -0.449   4.786   7.601
  476   HD22  LEU  58          1HD2      LEU  58  -2.121   4.410   7.174
  477   HD23  LEU  58          2HD2      LEU  58  -1.271   5.730   6.362
  478    H    ALA  59           H        ALA  59  -1.006  -0.206   8.415
  479    HA   ALA  59           HA       ALA  59  -0.387  -2.457   6.833
  480    HB1  ALA  59           3HB      ALA  59  -1.205  -2.368   9.763
  481    HB2  ALA  59           1HB      ALA  59   0.434  -2.185   9.137
  482    HB3  ALA  59           2HB      ALA  59  -0.412  -3.721   8.949
  483    H    LYS  60           H        LYS  60  -3.334  -1.546   8.620
  484    HA   LYS  60           HA       LYS  60  -4.768  -3.958   7.998
  485    HB2  LYS  60           2HB      LYS  60  -5.591  -1.332   9.277
  486    HB3  LYS  60           3HB      LYS  60  -6.798  -2.541   8.861
  487    HG2  LYS  60           2HG      LYS  60  -6.241  -2.786  11.197
  488    HG3  LYS  60           3HG      LYS  60  -5.615  -4.189  10.326
  489    HD2  LYS  60           2HD      LYS  60  -3.358  -3.117  10.306
  490    HD3  LYS  60           3HD      LYS  60  -4.015  -1.780  11.253
  491    HE2  LYS  60           2HE      LYS  60  -2.817  -3.323  12.688
  492    HE3  LYS  60           3HE      LYS  60  -4.536  -3.360  13.083
  493    HZ1  LYS  60           3HZ      LYS  60  -3.512  -5.580  12.987
  494    HZ2  LYS  60           1HZ      LYS  60  -3.145  -5.346  11.351
  495    HZ3  LYS  60           2HZ      LYS  60  -4.758  -5.417  11.856
  496    H    GLU  61           H        GLU  61  -4.490  -0.791   6.496
  497    HA   GLU  61           HA       GLU  61  -6.614  -1.115   4.608
  498    HB2  GLU  61           2HB      GLU  61  -4.145   0.674   4.517
  499    HB3  GLU  61           3HB      GLU  61  -5.464   0.747   3.353
  500    HG2  GLU  61           2HG      GLU  61  -5.624   1.348   6.313
  501    HG3  GLU  61           3HG      GLU  61  -5.721   2.515   4.996
  502    H    ALA  62           H        ALA  62  -3.129  -1.789   4.582
  503    HA   ALA  62           HA       ALA  62  -2.841  -2.760   1.966
  504    HB1  ALA  62           3HB      ALA  62  -0.804  -3.857   2.810
  505    HB2  ALA  62           1HB      ALA  62  -1.340  -3.598   4.474
  506    HB3  ALA  62           2HB      ALA  62  -0.948  -2.222   3.445
  507    H    GLU  63           H        GLU  63  -3.778  -4.444   4.973
  508    HA   GLU  63           HA       GLU  63  -3.884  -7.084   3.977
  509    HB2  GLU  63           2HB      GLU  63  -5.349  -5.828   6.339
  510    HB3  GLU  63           3HB      GLU  63  -5.267  -7.560   6.024
  511    HG2  GLU  63           2HG      GLU  63  -2.814  -7.514   6.299
  512    HG3  GLU  63           3HG      GLU  63  -2.881  -5.774   6.570
  513    H    ARG  64           H        ARG  64  -6.456  -4.598   4.289
  514    HA   ARG  64           HA       ARG  64  -8.585  -6.359   3.515
  515    HB2  ARG  64           2HB      ARG  64 -10.043  -4.394   3.481
  516    HB3  ARG  64           3HB      ARG  64  -9.024  -4.363   4.915
  517    HG2  ARG  64           2HG      ARG  64  -7.525  -2.741   3.761
  518    HG3  ARG  64           3HG      ARG  64  -8.650  -2.710   2.405
  519    HD2  ARG  64           2HD      ARG  64  -9.396  -1.946   5.242
  520    HD3  ARG  64           3HD      ARG  64  -8.861  -0.794   4.020
  521    HE   ARG  64           HE       ARG  64 -11.204  -2.461   3.426
  522   HH11  ARG  64          1HH1      ARG  64  -9.939   0.720   4.291
  523   HH12  ARG  64          2HH1      ARG  64 -11.414   1.538   3.880
  524   HH21  ARG  64          1HH2      ARG  64 -13.121  -1.364   2.902
  525   HH22  ARG  64          2HH2      ARG  64 -13.210   0.358   3.096
  526    H    LEU  65           H        LEU  65  -6.450  -4.171   1.738
  527    HA   LEU  65           HA       LEU  65  -7.859  -4.413  -0.782
  528    HB2  LEU  65           2HB      LEU  65  -5.022  -3.494  -0.167
  529    HB3  LEU  65           3HB      LEU  65  -5.823  -3.318  -1.724
  530    HG   LEU  65           HG       LEU  65  -6.775  -2.011   0.855
  531   HD11  LEU  65          1HD1      LEU  65  -4.624  -1.087   0.161
  532   HD12  LEU  65          2HD1      LEU  65  -5.920   0.090  -0.016
  533   HD13  LEU  65          3HD1      LEU  65  -5.275  -0.730  -1.441
  534   HD21  LEU  65          3HD2      LEU  65  -8.253  -0.672  -0.595
  535   HD22  LEU  65          1HD2      LEU  65  -8.625  -2.393  -0.680
  536   HD23  LEU  65          2HD2      LEU  65  -7.742  -1.617  -1.996
  537    H    ALA  66           H        ALA  66  -5.210  -6.103   0.825
  538    HA   ALA  66           HA       ALA  66  -4.217  -7.617  -1.346
  539    HB1  ALA  66           3HB      ALA  66  -4.227  -8.348   1.601
  540    HB2  ALA  66           1HB      ALA  66  -3.018  -7.352   0.791
  541    HB3  ALA  66           2HB      ALA  66  -3.192  -9.051   0.352
  542    H    LYS  67           H        LYS  67  -6.699  -8.379   1.093
  543    HA   LYS  67           HA       LYS  67  -7.307 -10.992   0.068
  544    HB2  LYS  67           2HB      LYS  67  -9.113 -11.030   1.707
  545    HB3  LYS  67           3HB      LYS  67  -7.667 -10.358   2.448
  546    HG2  LYS  67           2HG      LYS  67  -8.650  -8.054   2.017
  547    HG3  LYS  67           3HG      LYS  67 -10.146  -8.861   1.558
  548    HD2  LYS  67           2HD      LYS  67  -8.798  -8.997   4.285
  549    HD3  LYS  67           3HD      LYS  67 -10.243  -8.074   3.886
  550    HE2  LYS  67           2HE      LYS  67 -11.447 -10.191   3.408
  551    HE3  LYS  67           3HE      LYS  67  -9.997 -11.098   3.852
  552    HZ1  LYS  67           3HZ      LYS  67 -11.538 -10.994   5.704
  553    HZ2  LYS  67           1HZ      LYS  67 -11.551  -9.303   5.650
  554    HZ3  LYS  67           2HZ      LYS  67 -10.137 -10.125   6.083
  555    H    GLU  68           H        GLU  68  -8.459  -7.769  -0.617
  556    HA   GLU  68           HA       GLU  68 -10.966  -8.459  -1.823
  557    HB2  GLU  68           2HB      GLU  68 -10.582  -6.254  -0.807
  558    HB3  GLU  68           3HB      GLU  68  -9.309  -5.903  -1.969
  559    HG2  GLU  68           2HG      GLU  68 -11.478  -4.742  -2.435
  560    HG3  GLU  68           3HG      GLU  68 -10.893  -5.728  -3.771
  561    H    PHE  69           H        PHE  69  -7.803  -7.450  -3.185
  562    HA   PHE  69           HA       PHE  69  -8.682  -8.120  -5.914
  563    HB2  PHE  69           2HB      PHE  69  -6.025  -6.917  -4.988
  564    HB3  PHE  69           3HB      PHE  69  -6.612  -7.001  -6.648
  565    HD1  PHE  69           HD1      PHE  69  -8.907  -5.748  -7.133
  566    HD2  PHE  69           HD2      PHE  69  -6.435  -4.949  -3.736
  567    HE1  PHE  69           HE1      PHE  69 -10.050  -3.603  -6.787
  568    HE2  PHE  69           HE2      PHE  69  -7.579  -2.795  -3.409
  569    HZ   PHE  69           HZ       PHE  69  -9.396  -2.126  -4.928
  570    H    ASN  70           H        ASN  70  -7.614  -9.879  -3.418
  571    HA   ASN  70           HA       ASN  70  -6.492 -11.772  -2.970
  572    HB2  ASN  70           2HB      ASN  70  -8.328 -12.542  -4.617
  573    HB3  ASN  70           3HB      ASN  70  -7.065 -12.644  -5.836
  574   HD21  ASN  70          1HD2      ASN  70  -8.664 -14.819  -4.935
  575   HD22  ASN  70          2HD2      ASN  70  -7.628 -15.980  -4.188
  576    H    ILE  71           H        ILE  71  -4.816  -9.781  -3.482
  577    HA   ILE  71           HA       ILE  71  -2.516 -10.934  -4.955
  578    HB   ILE  71           HB       ILE  71  -1.600  -8.584  -4.985
  579   HG12  ILE  71          2HG1      ILE  71  -4.349  -7.845  -3.862
  580   HG13  ILE  71          3HG1      ILE  71  -2.794  -7.594  -3.077
  581   HG21  ILE  71          1HG2      ILE  71  -3.033  -7.750  -6.809
  582   HG22  ILE  71          2HG2      ILE  71  -4.305  -8.880  -6.348
  583   HG23  ILE  71          3HG2      ILE  71  -2.767  -9.489  -6.964
  584   HD11  ILE  71          3HD1      ILE  71  -2.203  -5.961  -4.824
  585   HD12  ILE  71          1HD1      ILE  71  -3.659  -5.514  -3.935
  586   HD13  ILE  71          2HD1      ILE  71  -3.794  -6.192  -5.558
  587    H    THR  72           H        THR  72  -0.406 -10.623  -3.936
  588    HA   THR  72           HA       THR  72  -0.460 -11.200  -1.096
  589    HB   THR  72           HB       THR  72   2.078 -11.450  -1.472
  590    HG1  THR  72           HG1      THR  72   2.563 -11.700  -3.802
  591   HG21  THR  72          3HG2      THR  72   1.908 -13.573  -2.724
  592   HG22  THR  72          1HG2      THR  72   0.265 -13.158  -3.222
  593   HG23  THR  72          2HG2      THR  72   0.633 -13.438  -1.518
  594    H    VAL  73           H        VAL  73   0.312  -9.827   0.505
  595    HA   VAL  73           HA       VAL  73   1.751  -7.390  -0.302
  596    HB   VAL  73           HB       VAL  73  -0.671  -6.798   0.239
  597   HG11  VAL  73          1HG1      VAL  73   0.083  -7.463   3.108
  598   HG12  VAL  73          2HG1      VAL  73  -1.074  -8.348   2.111
  599   HG13  VAL  73          3HG1      VAL  73  -1.410  -6.679   2.575
  600   HG21  VAL  73          3HG2      VAL  73   1.415  -5.483   2.021
  601   HG22  VAL  73          1HG2      VAL  73  -0.094  -4.763   1.453
  602   HG23  VAL  73          2HG2      VAL  73   1.186  -5.147   0.303
  603    H    THR  74           H        THR  74   3.307  -6.761   1.040
  604    HA   THR  74           HA       THR  74   3.673  -7.937   3.690
  605    HB   THR  74           HB       THR  74   5.167  -9.290   2.248
  606    HG1  THR  74           HG1      THR  74   5.961  -8.806   4.289
  607   HG21  THR  74          3HG2      THR  74   5.512  -7.704   0.372
  608   HG22  THR  74          1HG2      THR  74   7.047  -8.311   1.003
  609   HG23  THR  74          2HG2      THR  74   6.502  -6.685   1.419
  610    H    TYR  75           H        TYR  75   4.397  -6.350   5.097
  611    HA   TYR  75           HA       TYR  75   5.028  -3.692   4.021
  612    HB2  TYR  75           2HB      TYR  75   3.368  -2.728   5.763
  613    HB3  TYR  75           3HB      TYR  75   2.712  -3.364   4.268
  614    HD1  TYR  75           HD1      TYR  75   3.262  -4.289   7.886
  615    HD2  TYR  75           HD2      TYR  75   0.972  -4.997   4.341
  616    HE1  TYR  75           HE1      TYR  75   1.708  -5.700   9.166
  617    HE2  TYR  75           HE2      TYR  75  -0.576  -6.402   5.629
  618    HH   TYR  75           HH       TYR  75  -0.654  -7.679   7.660
  619    H    THR  76           H        THR  76   6.363  -2.478   5.313
  620    HA   THR  76           HA       THR  76   7.772  -4.009   7.396
  621    HB   THR  76           HB       THR  76   8.630  -1.508   5.846
  622    HG1  THR  76           HG1      THR  76   8.354  -3.699   4.756
  623   HG21  THR  76          3HG2      THR  76   9.821  -1.720   8.022
  624   HG22  THR  76          1HG2      THR  76  10.915  -2.031   6.671
  625   HG23  THR  76          2HG2      THR  76  10.273  -3.375   7.615
  626    H    ILE  77           H        ILE  77   7.041  -3.590   9.362
  627    HA   ILE  77           HA       ILE  77   7.291  -0.946  10.502
  628    HB   ILE  77           HB       ILE  77   5.084  -1.298  11.878
  629   HG12  ILE  77          2HG1      ILE  77   4.367  -2.978   9.430
  630   HG13  ILE  77          3HG1      ILE  77   4.509  -3.555  11.086
  631   HG21  ILE  77          1HG2      ILE  77   5.408   0.602  10.391
  632   HG22  ILE  77          2HG2      ILE  77   3.741   0.032  10.336
  633   HG23  ILE  77          3HG2      ILE  77   4.847  -0.353   9.017
  634   HD11  ILE  77          3HD1      ILE  77   2.599  -2.164  11.730
  635   HD12  ILE  77          1HD1      ILE  77   2.194  -3.311  10.454
  636   HD13  ILE  77          2HD1      ILE  77   2.447  -1.610  10.058
  637    H    ARG  78           H        ARG  78   7.636  -1.029  12.732
  638    HA   ARG  78           HA       ARG  78   8.767  -3.599  13.606
  639    HB2  ARG  78           2HB      ARG  78   9.189  -0.837  14.834
  640    HB3  ARG  78           3HB      ARG  78  10.169  -2.279  15.075
  641    HG2  ARG  78           2HG      ARG  78   9.992  -0.573  12.575
  642    HG3  ARG  78           3HG      ARG  78  11.374  -0.747  13.652
  643    HD2  ARG  78           2HD      ARG  78  10.225  -2.893  11.837
  644    HD3  ARG  78           3HD      ARG  78  11.721  -1.996  11.580
  645    HE   ARG  78           HE       ARG  78  12.541  -3.078  13.685
  646   HH11  ARG  78          1HH1      ARG  78  10.110  -4.693  11.718
  647   HH12  ARG  78          2HH1      ARG  78  10.539  -6.278  12.278
  648   HH21  ARG  78          1HH2      ARG  78  13.067  -5.193  14.423
  649   HH22  ARG  78          2HH2      ARG  78  12.198  -6.554  13.794
  650    H    GLY  79           H        GLY  79   8.334  -4.400  15.723
  651    HA2  GLY  79           2HA      GLY  79   5.614  -3.761  16.694
  652    HA3  GLY  79           3HA      GLY  79   6.494  -5.260  16.944
  653    H    SER  80           H        SER  80   7.936  -5.435  18.669
  654    HA   SER  80           HA       SER  80   7.811  -3.294  20.706
  655    HB2  SER  80           2HB      SER  80   6.511  -5.304  21.362
  656    HB3  SER  80           3HB      SER  80   7.933  -6.325  21.116
  657    HG   SER  80           HG       SER  80   7.717  -4.182  22.972
  658    H    LEU  81           H        LEU  81   9.691  -2.626  19.266
  659    HA   LEU  81           HA       LEU  81  12.222  -3.946  19.709
  660    HB2  LEU  81           2HB      LEU  81  11.565  -1.213  18.557
  661    HB3  LEU  81           3HB      LEU  81  13.204  -1.820  18.725
  662    HG   LEU  81           HG       LEU  81  11.028  -2.877  16.890
  663   HD11  LEU  81          1HD1      LEU  81  12.227  -0.914  16.084
  664   HD12  LEU  81          2HD1      LEU  81  12.619  -2.330  15.117
  665   HD13  LEU  81          3HD1      LEU  81  13.778  -1.733  16.311
  666   HD21  LEU  81          3HD2      LEU  81  12.146  -4.840  17.809
  667   HD22  LEU  81          1HD2      LEU  81  13.732  -4.158  17.430
  668   HD23  LEU  81          2HD2      LEU  81  12.624  -4.608  16.131
  669    H    GLU  82           H        GLU  82  10.306  -1.681  21.494
  670    HA   GLU  82           HA       GLU  82  12.194  -0.397  23.116
  671    HB2  GLU  82           2HB      GLU  82   9.446  -1.460  23.900
  672    HB3  GLU  82           3HB      GLU  82  10.408  -0.386  24.907
  673    HG2  GLU  82           2HG      GLU  82  10.260   1.385  23.225
  674    HG3  GLU  82           3HG      GLU  82   9.367   0.309  22.149
  675    H    HIS  83           H        HIS  83  11.088  -3.691  23.131
  676    HA   HIS  83           HA       HIS  83  12.260  -4.610  25.555
  677    HB2  HIS  83           2HB      HIS  83  10.423  -5.718  24.101
  678    HB3  HIS  83           3HB      HIS  83  11.711  -6.265  23.039
  679    HD1  HIS  83           HD1      HIS  83   9.637  -7.659  25.368
  680    HD2  HIS  83           HD2      HIS  83  13.777  -7.666  25.048
  681    HE1  HIS  83           HE1      HIS  83  10.409  -9.646  26.687
  682    HE2  HIS  83           HE2      HIS  83  12.911  -9.666  26.427
  683    H    HIS  84           H        HIS  84  13.360  -4.510  22.146
  684    HA   HIS  84           HA       HIS  84  15.861  -5.833  22.625
  685    HB2  HIS  84           2HB      HIS  84  14.712  -5.936  20.419
  686    HB3  HIS  84           3HB      HIS  84  14.999  -4.214  20.186
  687    HD1  HIS  84           HD1      HIS  84  17.298  -3.539  19.307
  688    HD2  HIS  84           HD2      HIS  84  17.090  -7.563  20.308
  689    HE1  HIS  84           HE1      HIS  84  19.404  -4.560  18.423
  690    HE2  HIS  84           HE2      HIS  84  19.351  -6.943  19.214
  691    H    HIS  85           H        HIS  85  15.324  -2.428  21.417
  692    HA   HIS  85           HA       HIS  85  17.724  -1.478  22.642
  693    HB2  HIS  85           2HB      HIS  85  17.037   0.788  22.036
  694    HB3  HIS  85           3HB      HIS  85  16.821  -0.290  20.675
  695    HD1  HIS  85           HD1      HIS  85  14.505  -0.368  19.626
  696    HD2  HIS  85           HD2      HIS  85  14.584   1.849  23.133
  697    HE1  HIS  85           HE1      HIS  85  12.336   0.882  19.694
  698    HE2  HIS  85           HE2      HIS  85  12.481   2.324  21.726
  699    H    HIS  86           H        HIS  86  17.698  -2.159  24.711
  700    HA   HIS  86           HA       HIS  86  15.396  -1.852  26.438
  701    HB2  HIS  86           2HB      HIS  86  16.930  -3.874  26.395
  702    HB3  HIS  86           3HB      HIS  86  18.181  -2.880  27.126
  703    HD1  HIS  86           HD1      HIS  86  15.070  -4.757  27.904
  704    HD2  HIS  86           HD2      HIS  86  17.723  -2.235  29.868
  705    HE1  HIS  86           HE1      HIS  86  14.544  -4.986  30.345
  706    HE2  HIS  86           HE2      HIS  86  15.961  -3.240  31.454
  707    H    HIS  87           H        HIS  87  15.209   0.387  26.480
  708    HA   HIS  87           HA       HIS  87  17.280   2.131  27.502
  709    HB2  HIS  87           2HB      HIS  87  15.607   3.936  27.236
  710    HB3  HIS  87           3HB      HIS  87  15.744   2.962  25.777
  711    HD1  HIS  87           HD1      HIS  87  13.404   3.737  28.604
  712    HD2  HIS  87           HD2      HIS  87  13.384   1.640  25.014
  713    HE1  HIS  87           HE1      HIS  87  10.996   3.210  28.146
  714    HE2  HIS  87           HE2      HIS  87  11.031   1.790  26.074
  715    H    HIS  88           H        HIS  88  14.520   0.436  28.786
  716    HA   HIS  88           HA       HIS  88  15.034   1.499  31.494
  717    HB2  HIS  88           2HB      HIS  88  12.854   2.361  30.587
  718    HB3  HIS  88           3HB      HIS  88  12.303   0.703  30.360
  719    HD1  HIS  88           HD1      HIS  88  13.097   3.208  33.059
  720    HD2  HIS  88           HD2      HIS  88  11.363  -0.549  32.687
  721    HE1  HIS  88           HE1      HIS  88  12.068   2.713  35.293
  722    HE2  HIS  88           HE2      HIS  88  11.171   0.378  35.085
  Start of MODEL   11
    1    H1   MET   1           1H       MET   1   9.843   5.417  13.648
    2    H2   MET   1           2H       MET   1   9.843   4.459  15.033
    3    H3   MET   1           3H       MET   1   9.173   3.864  13.608
    4    HA   MET   1           HA       MET   1  12.018   4.555  14.004
    5    HB2  MET   1           2HB      MET   1  10.607   1.859  14.016
    6    HB3  MET   1           3HB      MET   1  12.349   2.029  13.854
    7    HG2  MET   1           2HG      MET   1  12.394   3.194  16.052
    8    HG3  MET   1           3HG      MET   1  10.666   2.871  16.214
    9    HE1  MET   1           3HE      MET   1  12.981   2.069  18.329
   10    HE2  MET   1           1HE      MET   1  12.495   0.435  18.780
   11    HE3  MET   1           2HE      MET   1  11.282   1.705  18.648
   12    H    GLY   2           H        GLY   2  12.685   5.359  12.153
   13    HA2  GLY   2           2HA      GLY   2  13.191   5.645   9.956
   14    HA3  GLY   2           3HA      GLY   2  12.816   3.942   9.726
   15    H    GLU   3           H        GLU   3  11.385   3.699   8.148
   16    HA   GLU   3           HA       GLU   3   8.891   5.245   8.072
   17    HB2  GLU   3           2HB      GLU   3   9.034   5.496   5.603
   18    HB3  GLU   3           3HB      GLU   3  10.332   6.364   6.413
   19    HG2  GLU   3           2HG      GLU   3  11.945   4.650   5.801
   20    HG3  GLU   3           3HG      GLU   3  10.671   3.625   5.147
   21    H    MET   4           H        MET   4   7.428   4.128   6.298
   22    HA   MET   4           HA       MET   4   7.564   1.189   6.747
   23    HB2  MET   4           2HB      MET   4   5.629   2.239   7.884
   24    HB3  MET   4           3HB      MET   4   5.109   2.982   6.376
   25    HG2  MET   4           2HG      MET   4   4.669   0.742   5.433
   26    HG3  MET   4           3HG      MET   4   5.202   0.003   6.949
   27    HE1  MET   4           3HE      MET   4   2.416  -0.836   5.845
   28    HE2  MET   4           1HE      MET   4   1.386  -0.640   7.264
   29    HE3  MET   4           2HE      MET   4   2.999  -1.328   7.437
   30    H    ASP   5           H        ASP   5   7.412  -0.144   4.979
   31    HA   ASP   5           HA       ASP   5   6.827   1.027   2.333
   32    HB2  ASP   5           2HB      ASP   5   8.289  -0.702   1.347
   33    HB3  ASP   5           3HB      ASP   5   9.195   0.296   2.473
   34    H    ILE   6           H        ILE   6   5.251  -0.025   1.203
   35    HA   ILE   6           HA       ILE   6   4.155  -2.575   2.258
   36    HB   ILE   6           HB       ILE   6   2.506  -0.332   0.960
   37   HG12  ILE   6          2HG1      ILE   6   2.587  -1.078   3.932
   38   HG13  ILE   6          3HG1      ILE   6   3.340   0.352   3.235
   39   HG21  ILE   6          1HG2      ILE   6   1.588  -2.596   0.606
   40   HG22  ILE   6          2HG2      ILE   6   0.550  -1.670   1.687
   41   HG23  ILE   6          3HG2      ILE   6   1.625  -2.905   2.345
   42   HD11  ILE   6          3HD1      ILE   6   1.250   0.903   4.300
   43   HD12  ILE   6          1HD1      ILE   6   0.391  -0.251   3.279
   44   HD13  ILE   6          2HD1      ILE   6   1.141   1.179   2.560
   45    H    ARG   7           H        ARG   7   4.900  -4.021   0.740
   46    HA   ARG   7           HA       ARG   7   4.718  -3.330  -2.113
   47    HB2  ARG   7           2HB      ARG   7   6.869  -4.287  -1.438
   48    HB3  ARG   7           3HB      ARG   7   6.076  -5.697  -0.738
   49    HG2  ARG   7           2HG      ARG   7   5.233  -6.293  -3.027
   50    HG3  ARG   7           3HG      ARG   7   6.150  -4.943  -3.688
   51    HD2  ARG   7           2HD      ARG   7   7.403  -7.236  -2.149
   52    HD3  ARG   7           3HD      ARG   7   7.255  -7.201  -3.906
   53    HE   ARG   7           HE       ARG   7   8.780  -5.159  -2.378
   54   HH11  ARG   7          1HH1      ARG   7   8.564  -7.410  -5.073
   55   HH12  ARG   7          2HH1      ARG   7  10.093  -6.937  -5.742
   56   HH21  ARG   7          1HH2      ARG   7  10.780  -4.560  -3.261
   57   HH22  ARG   7          2HH2      ARG   7  11.353  -5.320  -4.714
   58    H    PHE   8           H        PHE   8   3.215  -4.171  -3.365
   59    HA   PHE   8           HA       PHE   8   1.542  -6.458  -2.537
   60    HB2  PHE   8           2HB      PHE   8   0.927  -4.150  -4.450
   61    HB3  PHE   8           3HB      PHE   8  -0.099  -5.568  -4.251
   62    HD1  PHE   8           HD2      PHE   8  -1.157  -6.018  -1.989
   63    HD2  PHE   8           HD1      PHE   8   0.727  -2.296  -2.941
   64    HE1  PHE   8           HE2      PHE   8  -2.367  -4.933  -0.154
   65    HE2  PHE   8           HE1      PHE   8  -0.482  -1.228  -1.091
   66    HZ   PHE   8           HZ       PHE   8  -2.034  -2.543   0.303
   67    H    ARG   9           H        ARG   9   1.627  -8.235  -3.886
   68    HA   ARG   9           HA       ARG   9   2.866  -7.950  -6.561
   69    HB2  ARG   9           2HB      ARG   9   4.384  -9.131  -4.837
   70    HB3  ARG   9           3HB      ARG   9   3.197 -10.426  -4.788
   71    HG2  ARG   9           2HG      ARG   9   3.496 -10.854  -7.181
   72    HG3  ARG   9           3HG      ARG   9   4.621  -9.502  -7.308
   73    HD2  ARG   9           2HD      ARG   9   6.107 -10.755  -5.653
   74    HD3  ARG   9           3HD      ARG   9   5.039 -12.145  -5.879
   75    HE   ARG   9           HE       ARG   9   6.924 -11.010  -7.805
   76   HH11  ARG   9          1HH1      ARG   9   4.321 -13.323  -7.339
   77   HH12  ARG   9          2HH1      ARG   9   4.723 -14.234  -8.760
   78   HH21  ARG   9          1HH2      ARG   9   7.417 -12.204  -9.671
   79   HH22  ARG   9          2HH2      ARG   9   6.466 -13.602 -10.074
   80    H    GLY  10           H        GLY  10   1.523  -8.617  -8.145
   81    HA2  GLY  10           2HA      GLY  10  -0.488 -10.703  -7.663
   82    HA3  GLY  10           3HA      GLY  10  -1.100  -9.090  -8.009
   83    H    ASP  11           H        ASP  11  -1.251 -11.668  -9.426
   84    HA   ASP  11           HA       ASP  11   0.220 -11.755 -11.802
   85    HB2  ASP  11           2HB      ASP  11  -1.067 -13.664 -11.008
   86    HB3  ASP  11           3HB      ASP  11  -2.571 -12.762 -11.109
   87    H    ASP  12           H        ASP  12  -2.517  -9.795 -10.896
   88    HA   ASP  12           HA       ASP  12  -2.783  -8.670 -13.620
   89    HB2  ASP  12           2HB      ASP  12  -4.857  -9.579 -12.415
   90    HB3  ASP  12           3HB      ASP  12  -4.660  -8.291 -11.232
   91    H    LEU  13           H        LEU  13  -1.345  -7.046 -13.830
   92    HA   LEU  13           HA       LEU  13  -0.109  -5.541 -11.785
   93    HB2  LEU  13           2HB      LEU  13   0.763  -5.950 -14.099
   94    HB3  LEU  13           3HB      LEU  13  -0.433  -4.854 -14.743
   95    HG   LEU  13           HG       LEU  13   1.975  -3.984 -14.592
   96   HD11  LEU  13          1HD1      LEU  13  -0.080  -2.251 -13.199
   97   HD12  LEU  13          2HD1      LEU  13   0.095  -2.445 -14.942
   98   HD13  LEU  13          3HD1      LEU  13   1.392  -1.702 -14.011
   99   HD21  LEU  13          3HD2      LEU  13   2.586  -4.843 -12.372
  100   HD22  LEU  13          1HD2      LEU  13   1.406  -3.771 -11.614
  101   HD23  LEU  13          2HD2      LEU  13   2.804  -3.097 -12.456
  102    H    GLU  14           H        GLU  14  -3.140  -5.102 -13.451
  103    HA   GLU  14           HA       GLU  14  -3.490  -2.312 -12.814
  104    HB2  GLU  14           2HB      GLU  14  -5.461  -4.398 -13.828
  105    HB3  GLU  14           3HB      GLU  14  -5.903  -2.729 -13.493
  106    HG2  GLU  14           2HG      GLU  14  -5.581  -2.882 -15.838
  107    HG3  GLU  14           3HG      GLU  14  -4.203  -1.999 -15.192
  108    H    ALA  15           H        ALA  15  -4.393  -5.412 -11.319
  109    HA   ALA  15           HA       ALA  15  -6.158  -4.482  -9.332
  110    HB1  ALA  15           3HB      ALA  15  -5.920  -6.857  -9.895
  111    HB2  ALA  15           1HB      ALA  15  -5.626  -6.607  -8.174
  112    HB3  ALA  15           2HB      ALA  15  -4.270  -6.863  -9.270
  113    H    LEU  16           H        LEU  16  -2.655  -4.708  -9.475
  114    HA   LEU  16           HA       LEU  16  -1.979  -3.912  -6.855
  115    HB2  LEU  16           2HB      LEU  16  -0.462  -3.340  -9.439
  116    HB3  LEU  16           3HB      LEU  16   0.210  -3.255  -7.816
  117    HG   LEU  16           HG       LEU  16  -0.743  -5.784  -9.220
  118   HD11  LEU  16          1HD1      LEU  16   1.626  -6.421  -9.232
  119   HD12  LEU  16          2HD1      LEU  16   2.063  -4.872  -8.506
  120   HD13  LEU  16          3HD1      LEU  16   1.362  -4.924 -10.124
  121   HD21  LEU  16          3HD2      LEU  16  -1.165  -5.939  -6.811
  122   HD22  LEU  16          1HD2      LEU  16   0.510  -5.491  -6.471
  123   HD23  LEU  16          2HD2      LEU  16   0.147  -7.008  -7.294
  124    H    GLU  17           H        GLU  17  -2.758  -2.094  -9.779
  125    HA   GLU  17           HA       GLU  17  -2.071   0.503  -8.770
  126    HB2  GLU  17           2HB      GLU  17  -3.755  -0.238 -11.202
  127    HB3  GLU  17           3HB      GLU  17  -3.079   1.353 -10.853
  128    HG2  GLU  17           2HG      GLU  17  -0.798   0.446 -11.033
  129    HG3  GLU  17           3HG      GLU  17  -1.463  -1.156 -11.356
  130    H    LYS  18           H        LYS  18  -5.071  -1.384  -8.790
  131    HA   LYS  18           HA       LYS  18  -6.764   0.795  -7.938
  132    HB2  LYS  18           2HB      LYS  18  -7.140  -2.210  -8.053
  133    HB3  LYS  18           3HB      LYS  18  -8.284  -1.227  -7.153
  134    HG2  LYS  18           2HG      LYS  18  -9.246  -1.579  -9.293
  135    HG3  LYS  18           3HG      LYS  18  -8.700   0.097  -9.266
  136    HD2  LYS  18           2HD      LYS  18  -6.685  -0.559 -10.563
  137    HD3  LYS  18           3HD      LYS  18  -7.261  -2.229 -10.588
  138    HE2  LYS  18           2HE      LYS  18  -9.284  -1.462 -11.849
  139    HE3  LYS  18           3HE      LYS  18  -8.608   0.168 -11.890
  140    HZ1  LYS  18           3HZ      LYS  18  -6.681  -0.759 -13.073
  141    HZ2  LYS  18           1HZ      LYS  18  -8.121  -0.946 -13.932
  142    HZ3  LYS  18           2HZ      LYS  18  -7.442  -2.263 -13.123
  143    H    ALA  19           H        ALA  19  -5.009  -1.825  -6.265
  144    HA   ALA  19           HA       ALA  19  -5.591  -1.089  -3.596
  145    HB1  ALA  19           3HB      ALA  19  -4.507  -3.219  -4.186
  146    HB2  ALA  19           1HB      ALA  19  -3.554  -2.341  -2.988
  147    HB3  ALA  19           2HB      ALA  19  -3.050  -2.355  -4.683
  148    H    LEU  20           H        LEU  20  -3.002  -0.086  -5.780
  149    HA   LEU  20           HA       LEU  20  -1.493   1.646  -4.207
  150    HB2  LEU  20           2HB      LEU  20  -0.807   0.849  -6.433
  151    HB3  LEU  20           3HB      LEU  20  -2.121   1.731  -7.188
  152    HG   LEU  20           HG       LEU  20  -1.034   3.878  -6.489
  153   HD11  LEU  20          1HD1      LEU  20   0.219   3.097  -4.545
  154   HD12  LEU  20          2HD1      LEU  20   1.282   3.885  -5.706
  155   HD13  LEU  20          3HD1      LEU  20   1.266   2.125  -5.586
  156   HD21  LEU  20          3HD2      LEU  20  -0.684   2.988  -8.751
  157   HD22  LEU  20          1HD2      LEU  20   0.717   2.067  -8.189
  158   HD23  LEU  20          2HD2      LEU  20   0.750   3.833  -8.174
  159    H    LYS  21           H        LYS  21  -4.358   2.241  -6.180
  160    HA   LYS  21           HA       LYS  21  -4.622   5.005  -6.045
  161    HB2  LYS  21           2HB      LYS  21  -5.965   3.447  -7.498
  162    HB3  LYS  21           3HB      LYS  21  -6.857   2.924  -6.076
  163    HG2  LYS  21           2HG      LYS  21  -7.712   5.259  -5.799
  164    HG3  LYS  21           3HG      LYS  21  -6.856   5.710  -7.278
  165    HD2  LYS  21           2HD      LYS  21  -9.182   5.298  -7.831
  166    HD3  LYS  21           3HD      LYS  21  -8.198   4.015  -8.537
  167    HE2  LYS  21           2HE      LYS  21 -10.178   3.017  -7.578
  168    HE3  LYS  21           3HE      LYS  21  -8.805   2.560  -6.568
  169    HZ1  LYS  21           3HZ      LYS  21 -10.653   3.227  -5.205
  170    HZ2  LYS  21           1HZ      LYS  21 -10.769   4.709  -6.009
  171    HZ3  LYS  21           2HZ      LYS  21  -9.423   4.371  -5.050
  172    H    GLU  22           H        GLU  22  -5.761   2.481  -3.844
  173    HA   GLU  22           HA       GLU  22  -7.029   4.255  -1.985
  174    HB2  GLU  22           2HB      GLU  22  -6.279   1.314  -1.830
  175    HB3  GLU  22           3HB      GLU  22  -7.153   2.162  -0.558
  176    HG2  GLU  22           2HG      GLU  22  -8.088   1.779  -3.413
  177    HG3  GLU  22           3HG      GLU  22  -8.681   0.907  -1.999
  178    H    MET  23           H        MET  23  -3.847   2.552  -2.004
  179    HA   MET  23           HA       MET  23  -3.019   3.214   0.583
  180    HB2  MET  23           2HB      MET  23  -1.370   2.718  -1.926
  181    HB3  MET  23           3HB      MET  23  -0.683   2.818  -0.312
  182    HG2  MET  23           2HG      MET  23  -2.860   0.819  -0.743
  183    HG3  MET  23           3HG      MET  23  -1.292   0.492  -1.463
  184    HE1  MET  23           3HE      MET  23  -2.114   0.671   3.088
  185    HE2  MET  23           1HE      MET  23  -3.375   0.632   1.855
  186    HE3  MET  23           2HE      MET  23  -2.392   2.082   2.070
  187    H    ILE  24           H        ILE  24  -2.556   4.966  -2.471
  188    HA   ILE  24           HA       ILE  24  -1.039   7.146  -1.462
  189    HB   ILE  24           HB       ILE  24  -2.796   6.944  -3.965
  190   HG12  ILE  24          2HG1      ILE  24   0.235   6.663  -3.617
  191   HG13  ILE  24          3HG1      ILE  24  -0.887   5.346  -3.943
  192   HG21  ILE  24          1HG2      ILE  24  -2.498   9.312  -3.350
  193   HG22  ILE  24          2HG2      ILE  24  -1.596   8.937  -4.817
  194   HG23  ILE  24          3HG2      ILE  24  -0.749   9.088  -3.276
  195   HD11  ILE  24          3HD1      ILE  24  -1.403   6.344  -6.116
  196   HD12  ILE  24          1HD1      ILE  24   0.309   5.966  -5.933
  197   HD13  ILE  24          2HD1      ILE  24  -0.242   7.633  -5.788
  198    H    ARG  25           H        ARG  25  -4.500   6.652  -2.061
  199    HA   ARG  25           HA       ARG  25  -5.633   9.063  -1.282
  200    HB2  ARG  25           2HB      ARG  25  -6.892   7.261  -2.339
  201    HB3  ARG  25           3HB      ARG  25  -6.613   6.200  -0.970
  202    HG2  ARG  25           2HG      ARG  25  -8.058   7.720   0.423
  203    HG3  ARG  25           3HG      ARG  25  -8.420   8.636  -1.046
  204    HD2  ARG  25           2HD      ARG  25  -9.333   6.564  -2.090
  205    HD3  ARG  25           3HD      ARG  25  -9.013   5.685  -0.591
  206    HE   ARG  25           HE       ARG  25 -10.620   7.868   0.050
  207   HH11  ARG  25          1HH1      ARG  25 -10.921   4.881  -1.828
  208   HH12  ARG  25          2HH1      ARG  25 -12.639   4.782  -1.586
  209   HH21  ARG  25          1HH2      ARG  25 -12.875   7.713   0.315
  210   HH22  ARG  25          2HH2      ARG  25 -13.735   6.375  -0.381
  211    H    GLN  26           H        GLN  26  -4.637   6.297   0.747
  212    HA   GLN  26           HA       GLN  26  -5.536   7.348   3.240
  213    HB2  GLN  26           2HB      GLN  26  -3.240   5.376   2.876
  214    HB3  GLN  26           3HB      GLN  26  -4.206   5.624   4.323
  215    HG2  GLN  26           2HG      GLN  26  -4.991   4.259   1.758
  216    HG3  GLN  26           3HG      GLN  26  -4.900   3.570   3.366
  217   HE21  GLN  26          1HE2      GLN  26  -7.089   3.551   1.418
  218   HE22  GLN  26          2HE2      GLN  26  -8.457   4.208   2.238
  219    H    ALA  27           H        ALA  27  -2.351   7.261   1.644
  220    HA   ALA  27           HA       ALA  27  -0.853   8.554   3.638
  221    HB1  ALA  27           3HB      ALA  27  -0.322   8.441   0.656
  222    HB2  ALA  27           1HB      ALA  27   0.157   7.227   1.842
  223    HB3  ALA  27           2HB      ALA  27   0.865   8.842   1.902
  224    H    ARG  28           H        ARG  28  -2.873   9.876   1.084
  225    HA   ARG  28           HA       ARG  28  -1.946  12.589   1.346
  226    HB2  ARG  28           2HB      ARG  28  -4.467  11.510   0.009
  227    HB3  ARG  28           3HB      ARG  28  -3.953  13.194  -0.036
  228    HG2  ARG  28           2HG      ARG  28  -1.799  12.367  -1.174
  229    HG3  ARG  28           3HG      ARG  28  -2.606  10.810  -1.328
  230    HD2  ARG  28           2HD      ARG  28  -4.467  11.943  -2.570
  231    HD3  ARG  28           3HD      ARG  28  -3.539  13.444  -2.524
  232    HE   ARG  28           HE       ARG  28  -2.857  10.993  -4.017
  233   HH11  ARG  28          1HH1      ARG  28  -2.288  14.412  -3.482
  234   HH12  ARG  28          2HH1      ARG  28  -1.295  14.595  -4.894
  235   HH21  ARG  28          1HH2      ARG  28  -1.527  11.241  -5.876
  236   HH22  ARG  28          2HH2      ARG  28  -0.867  12.807  -6.243
  237    H    LYS  29           H        LYS  29  -4.780  10.747   2.547
  238    HA   LYS  29           HA       LYS  29  -6.005  13.029   3.776
  239    HB2  LYS  29           2HB      LYS  29  -7.678  11.541   4.627
  240    HB3  LYS  29           3HB      LYS  29  -7.277  11.019   2.999
  241    HG2  LYS  29           2HG      LYS  29  -5.885   9.196   3.946
  242    HG3  LYS  29           3HG      LYS  29  -6.339   9.703   5.568
  243    HD2  LYS  29           2HD      LYS  29  -8.277   8.690   3.441
  244    HD3  LYS  29           3HD      LYS  29  -7.618   7.726   4.759
  245    HE2  LYS  29           2HE      LYS  29  -9.808   8.349   5.441
  246    HE3  LYS  29           3HE      LYS  29  -8.716   9.374   6.367
  247    HZ1  LYS  29           3HZ      LYS  29  -9.240  11.220   4.987
  248    HZ2  LYS  29           1HZ      LYS  29 -10.703  10.507   5.421
  249    HZ3  LYS  29           2HZ      LYS  29 -10.073  10.261   3.871
  250    H    PHE  30           H        PHE  30  -3.674  10.664   4.898
  251    HA   PHE  30           HA       PHE  30  -3.775  11.542   7.680
  252    HB2  PHE  30           2HB      PHE  30  -1.877   9.609   6.271
  253    HB3  PHE  30           3HB      PHE  30  -1.901   9.913   8.005
  254    HD1  PHE  30           HD1      PHE  30  -4.760   9.879   8.690
  255    HD2  PHE  30           HD2      PHE  30  -2.583   7.393   5.975
  256    HE1  PHE  30           HE1      PHE  30  -6.394   8.064   9.030
  257    HE2  PHE  30           HE2      PHE  30  -4.226   5.585   6.322
  258    HZ   PHE  30           HZ       PHE  30  -6.129   5.920   7.847
  259    H    ALA  31           H        ALA  31  -2.359  12.609   4.827
  260    HA   ALA  31           HA       ALA  31  -1.005  14.284   4.239
  261    HB1  ALA  31           3HB      ALA  31  -2.144  15.597   5.977
  262    HB2  ALA  31           1HB      ALA  31  -0.453  16.074   5.819
  263    HB3  ALA  31           2HB      ALA  31  -0.964  15.062   7.174
  264    H    GLY  32           H        GLY  32   0.430  12.587   3.657
  265    HA2  GLY  32           2HA      GLY  32   3.093  12.955   4.844
  266    HA3  GLY  32           3HA      GLY  32   2.462  11.313   4.701
  267    H    THR  33           H        THR  33   4.543  11.245   3.375
  268    HA   THR  33           HA       THR  33   4.230  12.177   0.594
  269    HB   THR  33           HB       THR  33   6.712  11.229   2.136
  270    HG1  THR  33           HG1      THR  33   5.503  13.589   2.110
  271   HG21  THR  33          3HG2      THR  33   8.021  12.004   0.197
  272   HG22  THR  33          1HG2      THR  33   6.536  12.395  -0.675
  273   HG23  THR  33          2HG2      THR  33   6.918  10.715  -0.283
  274    H    VAL  34           H        VAL  34   4.157  10.579  -1.036
  275    HA   VAL  34           HA       VAL  34   4.339   7.738  -0.277
  276    HB   VAL  34           HB       VAL  34   1.972   8.316  -0.061
  277   HG11  VAL  34          1HG1      VAL  34   1.844  10.291  -1.502
  278   HG12  VAL  34          2HG1      VAL  34   0.586   9.130  -1.926
  279   HG13  VAL  34          3HG1      VAL  34   2.024   9.282  -2.939
  280   HG21  VAL  34          3HG2      VAL  34   2.469   6.062  -0.902
  281   HG22  VAL  34          1HG2      VAL  34   2.431   6.653  -2.567
  282   HG23  VAL  34          2HG2      VAL  34   0.961   6.665  -1.590
  283    H    THR  35           H        THR  35   5.451   6.622  -1.714
  284    HA   THR  35           HA       THR  35   5.676   7.457  -4.543
  285    HB   THR  35           HB       THR  35   8.087   6.563  -4.421
  286    HG1  THR  35           HG1      THR  35   7.492   6.710  -1.638
  287   HG21  THR  35          3HG2      THR  35   7.671   8.997  -4.570
  288   HG22  THR  35          1HG2      THR  35   9.068   8.653  -3.546
  289   HG23  THR  35          2HG2      THR  35   7.522   9.087  -2.813
  290    H    TYR  36           H        TYR  36   6.345   5.553  -5.932
  291    HA   TYR  36           HA       TYR  36   5.804   2.900  -4.870
  292    HB2  TYR  36           2HB      TYR  36   3.915   2.450  -6.393
  293    HB3  TYR  36           3HB      TYR  36   3.526   3.718  -5.248
  294    HD1  TYR  36           HD2      TYR  36   3.387   6.110  -6.034
  295    HD2  TYR  36           HD1      TYR  36   3.906   2.885  -8.801
  296    HE1  TYR  36           HE2      TYR  36   2.691   7.577  -7.882
  297    HE2  TYR  36           HE1      TYR  36   3.211   4.362 -10.639
  298    HH   TYR  36           HH       TYR  36   2.954   7.736 -10.308
  299    H    THR  37           H        THR  37   6.295   1.193  -6.351
  300    HA   THR  37           HA       THR  37   7.559   1.966  -8.921
  301    HB   THR  37           HB       THR  37   8.601  -0.182  -7.015
  302    HG1  THR  37           HG1      THR  37   9.410   2.505  -7.506
  303   HG21  THR  37          3HG2      THR  37  10.579  -0.234  -8.521
  304   HG22  THR  37          1HG2      THR  37   9.774   0.910  -9.610
  305   HG23  THR  37          2HG2      THR  37   9.112  -0.707  -9.372
  306    H    LEU  38           H        LEU  38   5.728   1.356 -10.119
  307    HA   LEU  38           HA       LEU  38   4.712  -1.372 -10.121
  308    HB2  LEU  38           2HB      LEU  38   4.373   0.968 -12.053
  309    HB3  LEU  38           3HB      LEU  38   3.593  -0.589 -12.287
  310    HG   LEU  38           HG       LEU  38   3.117   1.190  -9.865
  311   HD11  LEU  38          1HD1      LEU  38   2.322   2.320 -11.886
  312   HD12  LEU  38          2HD1      LEU  38   0.975   1.791 -10.884
  313   HD13  LEU  38          3HD1      LEU  38   1.389   0.889 -12.345
  314   HD21  LEU  38          3HD2      LEU  38   1.179  -0.267  -9.461
  315   HD22  LEU  38          1HD2      LEU  38   2.692  -1.174  -9.422
  316   HD23  LEU  38          2HD2      LEU  38   1.635  -1.277 -10.837
  317    H    ASP  39           H        ASP  39   5.967  -3.000 -10.913
  318    HA   ASP  39           HA       ASP  39   7.317  -2.762 -13.476
  319    HB2  ASP  39           2HB      ASP  39   9.026  -1.922 -11.836
  320    HB3  ASP  39           3HB      ASP  39   8.927  -3.446 -10.962
  321    H    GLY  40           H        GLY  40   6.456  -4.483 -14.436
  322    HA2  GLY  40           2HA      GLY  40   5.939  -6.629 -15.006
  323    HA3  GLY  40           3HA      GLY  40   6.913  -7.182 -13.653
  324    H    ASN  41           H        ASN  41   5.918  -7.817 -11.801
  325    HA   ASN  41           HA       ASN  41   2.988  -7.425 -11.495
  326    HB2  ASN  41           2HB      ASN  41   4.520 -10.010 -10.949
  327    HB3  ASN  41           3HB      ASN  41   2.830  -9.729 -10.523
  328   HD21  ASN  41          1HD2      ASN  41   1.300  -9.419 -12.263
  329   HD22  ASN  41          2HD2      ASN  41   1.620 -10.091 -13.820
  330    H    ASP  42           H        ASP  42   5.741  -6.430 -10.305
  331    HA   ASP  42           HA       ASP  42   4.914  -6.618  -7.469
  332    HB2  ASP  42           2HB      ASP  42   7.666  -6.333  -8.732
  333    HB3  ASP  42           3HB      ASP  42   7.383  -5.861  -7.060
  334    H    LEU  43           H        LEU  43   4.318  -4.890  -6.518
  335    HA   LEU  43           HA       LEU  43   4.978  -2.170  -7.466
  336    HB2  LEU  43           2HB      LEU  43   2.596  -2.446  -7.809
  337    HB3  LEU  43           3HB      LEU  43   2.405  -3.308  -6.290
  338    HG   LEU  43           HG       LEU  43   2.883  -1.197  -5.042
  339   HD11  LEU  43          1HD1      LEU  43   4.245   0.009  -6.638
  340   HD12  LEU  43          2HD1      LEU  43   2.836   0.972  -6.204
  341   HD13  LEU  43          3HD1      LEU  43   2.885   0.139  -7.755
  342   HD21  LEU  43          3HD2      LEU  43   0.584  -1.885  -5.469
  343   HD22  LEU  43          1HD2      LEU  43   0.583  -0.992  -6.993
  344   HD23  LEU  43          2HD2      LEU  43   0.731  -0.129  -5.458
  345    H    GLU  44           H        GLU  44   6.605  -1.568  -5.991
  346    HA   GLU  44           HA       GLU  44   6.078  -2.125  -3.119
  347    HB2  GLU  44           2HB      GLU  44   8.242  -3.012  -4.002
  348    HB3  GLU  44           3HB      GLU  44   8.754  -1.364  -4.383
  349    HG2  GLU  44           2HG      GLU  44   8.702  -0.733  -2.039
  350    HG3  GLU  44           3HG      GLU  44   7.965  -2.270  -1.587
  351    H    ILE  45           H        ILE  45   5.239  -0.566  -2.109
  352    HA   ILE  45           HA       ILE  45   5.400   2.263  -2.937
  353    HB   ILE  45           HB       ILE  45   3.587   0.872  -0.884
  354   HG12  ILE  45          2HG1      ILE  45   2.900   1.762  -3.731
  355   HG13  ILE  45          3HG1      ILE  45   3.250   0.101  -3.266
  356   HG21  ILE  45          1HG2      ILE  45   3.366   3.683  -2.047
  357   HG22  ILE  45          2HG2      ILE  45   3.847   3.280  -0.399
  358   HG23  ILE  45          3HG2      ILE  45   2.208   2.928  -0.945
  359   HD11  ILE  45          3HD1      ILE  45   0.890   0.460  -3.473
  360   HD12  ILE  45          1HD1      ILE  45   0.947   1.765  -2.288
  361   HD13  ILE  45          2HD1      ILE  45   1.305   0.106  -1.795
  362    H    ARG  46           H        ARG  46   6.504   3.759  -1.667
  363    HA   ARG  46           HA       ARG  46   7.413   2.974   1.062
  364    HB2  ARG  46           2HB      ARG  46   8.734   4.963  -0.849
  365    HB3  ARG  46           3HB      ARG  46   9.308   4.547   0.758
  366    HG2  ARG  46           2HG      ARG  46   9.145   2.595  -1.554
  367    HG3  ARG  46           3HG      ARG  46  10.590   3.502  -1.118
  368    HD2  ARG  46           2HD      ARG  46   9.174   1.495   0.664
  369    HD3  ARG  46           3HD      ARG  46  10.645   1.190  -0.264
  370    HE   ARG  46           HE       ARG  46  10.897   3.441   1.505
  371   HH11  ARG  46          1HH1      ARG  46  11.101  -0.079   1.453
  372   HH12  ARG  46          2HH1      ARG  46  12.159  -0.146   2.823
  373   HH21  ARG  46          1HH2      ARG  46  12.324   3.316   3.266
  374   HH22  ARG  46          2HH2      ARG  46  12.854   1.769   3.848
  375    H    ILE  47           H        ILE  47   6.094   3.954   2.480
  376    HA   ILE  47           HA       ILE  47   5.135   6.717   1.984
  377    HB   ILE  47           HB       ILE  47   3.912   4.673   3.913
  378   HG12  ILE  47          2HG1      ILE  47   2.905   5.592   1.169
  379   HG13  ILE  47          3HG1      ILE  47   3.579   4.007   1.524
  380   HG21  ILE  47          1HG2      ILE  47   2.034   6.296   4.095
  381   HG22  ILE  47          2HG2      ILE  47   2.898   7.420   3.042
  382   HG23  ILE  47          3HG2      ILE  47   3.553   7.020   4.631
  383   HD11  ILE  47          3HD1      ILE  47   1.678   3.550   3.013
  384   HD12  ILE  47          1HD1      ILE  47   1.181   3.904   1.358
  385   HD13  ILE  47          2HD1      ILE  47   1.001   5.131   2.610
  386    H    THR  48           H        THR  48   5.874   8.271   3.233
  387    HA   THR  48           HA       THR  48   6.975   7.794   5.932
  388    HB   THR  48           HB       THR  48   8.226   9.717   3.890
  389    HG1  THR  48           HG1      THR  48   8.633   6.991   4.257
  390   HG21  THR  48          3HG2      THR  48   9.312   8.670   6.541
  391   HG22  THR  48          1HG2      THR  48   8.719  10.305   6.245
  392   HG23  THR  48          2HG2      THR  48  10.173   9.732   5.425
  393    H    GLY  49           H        GLY  49   7.033  10.096   7.095
  394    HA2  GLY  49           2HA      GLY  49   6.188  12.257   7.408
  395    HA3  GLY  49           3HA      GLY  49   5.142  12.069   6.010
  396    H    VAL  50           H        VAL  50   4.319   9.358   7.208
  397    HA   VAL  50           HA       VAL  50   2.212  10.350   8.990
  398    HB   VAL  50           HB       VAL  50   1.122   8.149   8.635
  399   HG11  VAL  50          1HG1      VAL  50   1.969   9.480   6.025
  400   HG12  VAL  50          2HG1      VAL  50   0.620   9.968   7.055
  401   HG13  VAL  50          3HG1      VAL  50   0.576   8.411   6.230
  402   HG21  VAL  50          3HG2      VAL  50   3.115   6.721   8.394
  403   HG22  VAL  50          1HG2      VAL  50   3.497   7.477   6.844
  404   HG23  VAL  50          2HG2      VAL  50   2.033   6.504   7.020
  405    HA   PRO  51           HA       PRO  51   4.369   8.889  12.703
  406    HB2  PRO  51           2HB      PRO  51   1.583   8.490  13.800
  407    HB3  PRO  51           3HB      PRO  51   2.939   9.431  14.466
  408    HG2  PRO  51           2HG      PRO  51   0.866  10.644  13.338
  409    HG3  PRO  51           3HG      PRO  51   2.513  11.262  13.104
  410    HD2  PRO  51           2HD      PRO  51   0.798   9.683  11.198
  411    HD3  PRO  51           3HD      PRO  51   1.902  11.037  10.868
  412    H    GLU  52           H        GLU  52   4.562   6.966  14.063
  413    HA   GLU  52           HA       GLU  52   4.372   4.609  12.505
  414    HB2  GLU  52           2HB      GLU  52   6.206   5.109  14.108
  415    HB3  GLU  52           3HB      GLU  52   5.096   4.837  15.446
  416    HG2  GLU  52           2HG      GLU  52   4.915   2.502  14.941
  417    HG3  GLU  52           3HG      GLU  52   5.685   2.713  13.366
  418    H    GLN  53           H        GLN  53   2.320   5.935  15.024
  419    HA   GLN  53           HA       GLN  53   0.721   3.621  15.507
  420    HB2  GLN  53           2HB      GLN  53  -0.977   5.218  16.376
  421    HB3  GLN  53           3HB      GLN  53   0.631   5.547  17.015
  422    HG2  GLN  53           2HG      GLN  53   0.899   7.474  15.608
  423    HG3  GLN  53           3HG      GLN  53  -0.536   7.064  14.667
  424   HE21  GLN  53          1HE2      GLN  53  -2.569   7.461  15.526
  425   HE22  GLN  53          2HE2      GLN  53  -2.824   8.517  16.877
  426    H    VAL  54           H        VAL  54   0.620   6.160  13.077
  427    HA   VAL  54           HA       VAL  54  -1.889   5.393  11.892
  428    HB   VAL  54           HB       VAL  54   0.299   7.298  10.939
  429   HG11  VAL  54          1HG1      VAL  54  -1.363   8.216   9.355
  430   HG12  VAL  54          2HG1      VAL  54  -2.505   6.948   9.811
  431   HG13  VAL  54          3HG1      VAL  54  -0.995   6.528   9.000
  432   HG21  VAL  54          3HG2      VAL  54  -2.369   7.869  12.275
  433   HG22  VAL  54          1HG2      VAL  54  -1.241   9.088  11.672
  434   HG23  VAL  54          2HG2      VAL  54  -0.776   8.038  13.011
  435    H    ARG  55           H        ARG  55   1.538   4.694  11.288
  436    HA   ARG  55           HA       ARG  55   1.372   3.432   8.772
  437    HB2  ARG  55           2HB      ARG  55   3.224   2.764  11.101
  438    HB3  ARG  55           3HB      ARG  55   3.451   2.218   9.442
  439    HG2  ARG  55           2HG      ARG  55   3.767   4.534   8.701
  440    HG3  ARG  55           3HG      ARG  55   3.474   5.110  10.342
  441    HD2  ARG  55           2HD      ARG  55   5.482   3.655  11.044
  442    HD3  ARG  55           3HD      ARG  55   5.830   3.507   9.315
  443    HE   ARG  55           HE       ARG  55   5.527   6.232   9.912
  444   HH11  ARG  55          1HH1      ARG  55   7.773   3.610  10.682
  445   HH12  ARG  55          2HH1      ARG  55   9.121   4.677  10.893
  446   HH21  ARG  55          1HH2      ARG  55   7.296   7.605  10.233
  447   HH22  ARG  55          2HH2      ARG  55   8.852   6.948  10.639
  448    H    LYS  56           H        LYS  56   0.736   2.249  12.035
  449    HA   LYS  56           HA       LYS  56   0.301  -0.466  11.512
  450    HB2  LYS  56           2HB      LYS  56  -1.029   1.353  13.580
  451    HB3  LYS  56           3HB      LYS  56  -1.060  -0.411  13.626
  452    HG2  LYS  56           2HG      LYS  56   1.345  -0.508  13.917
  453    HG3  LYS  56           3HG      LYS  56   1.486   1.236  13.698
  454    HD2  LYS  56           2HD      LYS  56   0.165   1.574  15.792
  455    HD3  LYS  56           3HD      LYS  56   0.119  -0.178  16.023
  456    HE2  LYS  56           2HE      LYS  56   2.604  -0.200  16.128
  457    HE3  LYS  56           3HE      LYS  56   2.615   1.555  15.948
  458    HZ1  LYS  56           3HZ      LYS  56   1.489   1.776  18.034
  459    HZ2  LYS  56           1HZ      LYS  56   2.855   0.811  18.258
  460    HZ3  LYS  56           2HZ      LYS  56   1.321   0.105  18.190
  461    H    GLU  57           H        GLU  57  -1.837   2.347  11.167
  462    HA   GLU  57           HA       GLU  57  -4.186   0.854  10.459
  463    HB2  GLU  57           2HB      GLU  57  -3.641   3.805   9.902
  464    HB3  GLU  57           3HB      GLU  57  -5.213   3.011   9.954
  465    HG2  GLU  57           2HG      GLU  57  -3.344   3.592  12.256
  466    HG3  GLU  57           3HG      GLU  57  -4.971   4.217  12.000
  467    H    LEU  58           H        LEU  58  -1.553   2.393   8.646
  468    HA   LEU  58           HA       LEU  58  -2.494   1.945   6.014
  469    HB2  LEU  58           2HB      LEU  58   0.255   2.320   7.212
  470    HB3  LEU  58           3HB      LEU  58   0.156   1.707   5.576
  471    HG   LEU  58           HG       LEU  58   0.532   4.080   5.465
  472   HD11  LEU  58          1HD1      LEU  58  -1.356   4.859   4.107
  473   HD12  LEU  58          2HD1      LEU  58  -2.354   3.532   4.703
  474   HD13  LEU  58          3HD1      LEU  58  -0.929   3.193   3.720
  475   HD21  LEU  58          3HD2      LEU  58  -0.265   4.781   7.667
  476   HD22  LEU  58          1HD2      LEU  58  -1.940   4.515   7.174
  477   HD23  LEU  58          2HD2      LEU  58  -0.977   5.779   6.402
  478    H    ALA  59           H        ALA  59  -1.051  -0.208   8.387
  479    HA   ALA  59           HA       ALA  59  -0.589  -2.434   6.678
  480    HB1  ALA  59           3HB      ALA  59   0.540  -2.178   8.846
  481    HB2  ALA  59           1HB      ALA  59  -0.327  -3.709   8.758
  482    HB3  ALA  59           2HB      ALA  59  -0.999  -2.369   9.689
  483    H    LYS  60           H        LYS  60  -3.389  -1.480   8.732
  484    HA   LYS  60           HA       LYS  60  -5.021  -3.751   8.265
  485    HB2  LYS  60           2HB      LYS  60  -5.712  -0.866   8.945
  486    HB3  LYS  60           3HB      LYS  60  -6.981  -2.036   8.632
  487    HG2  LYS  60           2HG      LYS  60  -6.710  -1.776  11.011
  488    HG3  LYS  60           3HG      LYS  60  -6.189  -3.398  10.553
  489    HD2  LYS  60           2HD      LYS  60  -3.867  -2.799  10.786
  490    HD3  LYS  60           3HD      LYS  60  -4.262  -1.089  10.965
  491    HE2  LYS  60           2HE      LYS  60  -5.058  -3.244  12.948
  492    HE3  LYS  60           3HE      LYS  60  -3.635  -2.216  13.106
  493    HZ1  LYS  60           3HZ      LYS  60  -5.080  -0.285  13.180
  494    HZ2  LYS  60           1HZ      LYS  60  -5.475  -1.383  14.398
  495    HZ3  LYS  60           2HZ      LYS  60  -6.443  -1.268  13.026
  496    H    GLU  61           H        GLU  61  -4.621  -0.691   6.513
  497    HA   GLU  61           HA       GLU  61  -6.554  -1.133   4.492
  498    HB2  GLU  61           2HB      GLU  61  -4.080   0.648   4.502
  499    HB3  GLU  61           3HB      GLU  61  -5.343   0.704   3.273
  500    HG2  GLU  61           2HG      GLU  61  -5.632   1.343   6.210
  501    HG3  GLU  61           3HG      GLU  61  -5.677   2.491   4.875
  502    H    ALA  62           H        ALA  62  -3.075  -1.745   4.660
  503    HA   ALA  62           HA       ALA  62  -2.532  -2.576   2.082
  504    HB1  ALA  62           3HB      ALA  62  -0.550  -3.630   3.036
  505    HB2  ALA  62           1HB      ALA  62  -1.277  -3.621   4.647
  506    HB3  ALA  62           2HB      ALA  62  -0.859  -2.104   3.853
  507    H    GLU  63           H        GLU  63  -3.416  -4.586   4.878
  508    HA   GLU  63           HA       GLU  63  -3.397  -7.074   3.514
  509    HB2  GLU  63           2HB      GLU  63  -4.583  -6.245   6.190
  510    HB3  GLU  63           3HB      GLU  63  -4.434  -7.917   5.650
  511    HG2  GLU  63           2HG      GLU  63  -1.996  -7.721   5.575
  512    HG3  GLU  63           3HG      GLU  63  -2.097  -6.010   5.994
  513    H    ARG  64           H        ARG  64  -6.053  -4.793   4.267
  514    HA   ARG  64           HA       ARG  64  -8.150  -6.575   3.458
  515    HB2  ARG  64           2HB      ARG  64  -9.681  -4.736   3.635
  516    HB3  ARG  64           3HB      ARG  64  -8.519  -4.566   4.944
  517    HG2  ARG  64           2HG      ARG  64  -7.339  -2.822   3.667
  518    HG3  ARG  64           3HG      ARG  64  -8.500  -2.997   2.353
  519    HD2  ARG  64           2HD      ARG  64  -9.135  -2.081   5.176
  520    HD3  ARG  64           3HD      ARG  64  -9.002  -1.040   3.757
  521    HE   ARG  64           HE       ARG  64 -10.907  -2.748   2.967
  522   HH11  ARG  64          1HH1      ARG  64 -10.608  -0.929   5.985
  523   HH12  ARG  64          2HH1      ARG  64 -12.328  -0.828   6.216
  524   HH21  ARG  64          1HH2      ARG  64 -13.132  -2.621   3.312
  525   HH22  ARG  64          2HH2      ARG  64 -13.755  -1.787   4.704
  526    H    LEU  65           H        LEU  65  -6.162  -4.212   1.733
  527    HA   LEU  65           HA       LEU  65  -7.586  -4.344  -0.775
  528    HB2  LEU  65           2HB      LEU  65  -4.769  -3.384  -0.117
  529    HB3  LEU  65           3HB      LEU  65  -5.540  -3.190  -1.688
  530    HG   LEU  65           HG       LEU  65  -6.591  -1.967   0.893
  531   HD11  LEU  65          1HD1      LEU  65  -5.733   0.177   0.069
  532   HD12  LEU  65          2HD1      LEU  65  -5.002  -0.631  -1.320
  533   HD13  LEU  65          3HD1      LEU  65  -4.428  -0.983   0.313
  534   HD21  LEU  65          3HD2      LEU  65  -8.376  -2.343  -0.726
  535   HD22  LEU  65          1HD2      LEU  65  -7.446  -1.522  -1.987
  536   HD23  LEU  65          2HD2      LEU  65  -8.038  -0.620  -0.589
  537    H    ALA  66           H        ALA  66  -4.945  -6.046   0.729
  538    HA   ALA  66           HA       ALA  66  -3.899  -7.453  -1.451
  539    HB1  ALA  66           3HB      ALA  66  -4.023  -8.329   1.449
  540    HB2  ALA  66           1HB      ALA  66  -2.789  -7.286   0.735
  541    HB3  ALA  66           2HB      ALA  66  -2.937  -8.962   0.207
  542    H    LYS  67           H        LYS  67  -6.333  -8.465   0.934
  543    HA   LYS  67           HA       LYS  67  -6.927 -10.962  -0.350
  544    HB2  LYS  67           2HB      LYS  67  -8.676 -11.190   1.367
  545    HB3  LYS  67           3HB      LYS  67  -7.166 -10.656   2.091
  546    HG2  LYS  67           2HG      LYS  67  -8.051  -8.323   2.126
  547    HG3  LYS  67           3HG      LYS  67  -9.583  -8.920   1.501
  548    HD2  LYS  67           2HD      LYS  67  -8.369  -9.807   4.151
  549    HD3  LYS  67           3HD      LYS  67  -9.529  -8.492   3.991
  550    HE2  LYS  67           2HE      LYS  67 -10.722 -10.436   4.712
  551    HE3  LYS  67           3HE      LYS  67 -11.172 -10.144   3.037
  552    HZ1  LYS  67           3HZ      LYS  67  -9.130 -12.131   3.887
  553    HZ2  LYS  67           1HZ      LYS  67  -9.791 -11.944   2.342
  554    HZ3  LYS  67           2HZ      LYS  67 -10.753 -12.506   3.611
  555    H    GLU  68           H        GLU  68  -8.135  -7.709  -0.625
  556    HA   GLU  68           HA       GLU  68 -10.670  -8.142  -1.808
  557    HB2  GLU  68           2HB      GLU  68  -9.951  -5.965  -0.857
  558    HB3  GLU  68           3HB      GLU  68  -8.746  -5.792  -2.124
  559    HG2  GLU  68           2HG      GLU  68 -10.662  -4.374  -2.587
  560    HG3  GLU  68           3HG      GLU  68 -10.542  -5.634  -3.812
  561    H    PHE  69           H        PHE  69  -7.488  -7.441  -3.252
  562    HA   PHE  69           HA       PHE  69  -8.513  -7.945  -5.971
  563    HB2  PHE  69           2HB      PHE  69  -5.890  -6.679  -5.047
  564    HB3  PHE  69           3HB      PHE  69  -6.460  -6.776  -6.705
  565    HD1  PHE  69           HD1      PHE  69  -8.894  -5.712  -7.125
  566    HD2  PHE  69           HD2      PHE  69  -6.304  -4.677  -3.880
  567    HE1  PHE  69           HE1      PHE  69 -10.097  -3.586  -6.825
  568    HE2  PHE  69           HE2      PHE  69  -7.511  -2.552  -3.598
  569    HZ   PHE  69           HZ       PHE  69  -9.406  -2.008  -5.067
  570    H    ASN  70           H        ASN  70  -7.402  -9.875  -3.677
  571    HA   ASN  70           HA       ASN  70  -6.551 -11.966  -3.561
  572    HB2  ASN  70           2HB      ASN  70  -7.850 -12.396  -5.632
  573    HB3  ASN  70           3HB      ASN  70  -6.498 -11.839  -6.614
  574   HD21  ASN  70          1HD2      ASN  70  -4.739 -13.236  -6.939
  575   HD22  ASN  70          2HD2      ASN  70  -4.808 -14.917  -6.546
  576    H    ILE  71           H        ILE  71  -4.819  -9.405  -4.070
  577    HA   ILE  71           HA       ILE  71  -2.314 -10.479  -5.126
  578    HB   ILE  71           HB       ILE  71  -1.468  -8.135  -4.905
  579   HG12  ILE  71          2HG1      ILE  71  -4.270  -7.538  -3.841
  580   HG13  ILE  71          3HG1      ILE  71  -2.750  -7.314  -2.984
  581   HG21  ILE  71          1HG2      ILE  71  -4.130  -8.299  -6.378
  582   HG22  ILE  71          2HG2      ILE  71  -2.581  -8.871  -6.997
  583   HG23  ILE  71          3HG2      ILE  71  -2.825  -7.152  -6.702
  584   HD11  ILE  71          3HD1      ILE  71  -3.618  -5.193  -3.693
  585   HD12  ILE  71          1HD1      ILE  71  -3.730  -5.744  -5.364
  586   HD13  ILE  71          2HD1      ILE  71  -2.149  -5.542  -4.605
  587    H    THR  72           H        THR  72  -0.389 -10.540  -3.897
  588    HA   THR  72           HA       THR  72  -0.709 -11.140  -1.063
  589    HB   THR  72           HB       THR  72   1.828 -11.672  -1.320
  590    HG1  THR  72           HG1      THR  72   2.220 -12.042  -3.712
  591   HG21  THR  72          3HG2      THR  72  -0.118 -13.178  -3.118
  592   HG22  THR  72          1HG2      THR  72   0.113 -13.466  -1.389
  593   HG23  THR  72          2HG2      THR  72   1.426 -13.791  -2.523
  594    H    VAL  73           H        VAL  73   0.271  -9.940   0.628
  595    HA   VAL  73           HA       VAL  73   1.576  -7.381  -0.098
  596    HB   VAL  73           HB       VAL  73  -0.779  -6.990   0.725
  597   HG11  VAL  73          1HG1      VAL  73  -1.339  -7.261   3.104
  598   HG12  VAL  73          2HG1      VAL  73   0.208  -8.066   3.388
  599   HG13  VAL  73          3HG1      VAL  73  -0.996  -8.819   2.344
  600   HG21  VAL  73          3HG2      VAL  73   0.906  -5.220   0.942
  601   HG22  VAL  73          1HG2      VAL  73   1.413  -5.858   2.511
  602   HG23  VAL  73          2HG2      VAL  73  -0.205  -5.186   2.308
  603    H    THR  74           H        THR  74   3.309  -6.821   1.085
  604    HA   THR  74           HA       THR  74   3.900  -8.109   3.647
  605    HB   THR  74           HB       THR  74   5.229  -9.390   2.021
  606    HG1  THR  74           HG1      THR  74   7.377  -8.048   2.921
  607   HG21  THR  74          3HG2      THR  74   6.971  -8.360   0.620
  608   HG22  THR  74          1HG2      THR  74   6.459  -6.753   1.144
  609   HG23  THR  74          2HG2      THR  74   5.373  -7.755   0.179
  610    H    TYR  75           H        TYR  75   4.748  -6.632   5.090
  611    HA   TYR  75           HA       TYR  75   5.587  -3.989   4.166
  612    HB2  TYR  75           2HB      TYR  75   4.020  -2.825   5.744
  613    HB3  TYR  75           3HB      TYR  75   3.199  -3.619   4.411
  614    HD1  TYR  75           HD1      TYR  75   3.796  -3.715   8.082
  615    HD2  TYR  75           HD2      TYR  75   1.658  -5.480   4.821
  616    HE1  TYR  75           HE1      TYR  75   2.309  -4.855   9.671
  617    HE2  TYR  75           HE2      TYR  75   0.179  -6.619   6.420
  618    HH   TYR  75           HH       TYR  75  -0.024  -5.789   9.656
  619    H    THR  76           H        THR  76   6.820  -2.828   5.699
  620    HA   THR  76           HA       THR  76   7.704  -4.420   8.047
  621    HB   THR  76           HB       THR  76   9.445  -2.500   6.431
  622    HG1  THR  76           HG1      THR  76   8.769  -4.500   5.346
  623   HG21  THR  76          3HG2      THR  76  10.168  -4.521   8.602
  624   HG22  THR  76          1HG2      THR  76  10.187  -2.767   8.784
  625   HG23  THR  76          2HG2      THR  76  11.315  -3.550   7.677
  626    H    ILE  77           H        ILE  77   7.233  -3.526   9.883
  627    HA   ILE  77           HA       ILE  77   7.479  -0.650  10.383
  628    HB   ILE  77           HB       ILE  77   5.416  -0.801  11.950
  629   HG12  ILE  77          2HG1      ILE  77   4.781  -3.213  10.176
  630   HG13  ILE  77          3HG1      ILE  77   5.055  -3.239  11.915
  631   HG21  ILE  77          1HG2      ILE  77   5.414   0.571   9.919
  632   HG22  ILE  77          2HG2      ILE  77   3.827  -0.142  10.203
  633   HG23  ILE  77          3HG2      ILE  77   4.888  -0.817   8.963
  634   HD11  ILE  77          3HD1      ILE  77   3.010  -1.914  12.243
  635   HD12  ILE  77          1HD1      ILE  77   2.701  -3.439  11.411
  636   HD13  ILE  77          2HD1      ILE  77   2.733  -1.931  10.498
  637    H    ARG  78           H        ARG  78   8.120  -0.212  12.529
  638    HA   ARG  78           HA       ARG  78   8.963  -2.557  14.149
  639    HB2  ARG  78           2HB      ARG  78  10.471   0.061  13.664
  640    HB3  ARG  78           3HB      ARG  78  10.971  -1.199  14.791
  641    HG2  ARG  78           2HG      ARG  78  11.236  -2.776  12.890
  642    HG3  ARG  78           3HG      ARG  78  10.765  -1.496  11.771
  643    HD2  ARG  78           2HD      ARG  78  12.748  -0.202  12.343
  644    HD3  ARG  78           3HD      ARG  78  13.176  -1.358  13.611
  645    HE   ARG  78           HE       ARG  78  13.003  -2.720  11.147
  646   HH11  ARG  78          1HH1      ARG  78  15.110  -0.395  12.750
  647   HH12  ARG  78          2HH1      ARG  78  16.525  -0.901  11.884
  648   HH21  ARG  78          1HH2      ARG  78  14.868  -3.409  10.062
  649   HH22  ARG  78          2HH2      ARG  78  16.384  -2.613  10.350
  650    H    GLY  79           H        GLY  79   9.822  -1.227  16.403
  651    HA2  GLY  79           2HA      GLY  79   8.698   0.902  17.523
  652    HA3  GLY  79           3HA      GLY  79   7.319  -0.195  17.530
  653    H    SER  80           H        SER  80   7.796  -2.405  18.433
  654    HA   SER  80           HA       SER  80   9.530  -2.230  20.836
  655    HB2  SER  80           2HB      SER  80   7.011  -2.472  21.211
  656    HB3  SER  80           3HB      SER  80   7.113  -4.071  20.466
  657    HG   SER  80           HG       SER  80   8.134  -3.146  22.904
  658    H    LEU  81           H        LEU  81  11.260  -2.751  19.403
  659    HA   LEU  81           HA       LEU  81  11.425  -5.213  17.947
  660    HB2  LEU  81           2HB      LEU  81  13.538  -3.183  18.776
  661    HB3  LEU  81           3HB      LEU  81  13.869  -4.557  17.728
  662    HG   LEU  81           HG       LEU  81  11.915  -2.307  17.079
  663   HD11  LEU  81          1HD1      LEU  81  13.546  -1.599  15.382
  664   HD12  LEU  81          2HD1      LEU  81  14.682  -2.833  15.937
  665   HD13  LEU  81          3HD1      LEU  81  14.224  -1.505  17.006
  666   HD21  LEU  81          3HD2      LEU  81  11.827  -3.320  14.817
  667   HD22  LEU  81          1HD2      LEU  81  11.189  -4.398  16.055
  668   HD23  LEU  81          2HD2      LEU  81  12.799  -4.676  15.388
  669    H    GLU  82           H        GLU  82  12.395  -4.168  21.130
  670    HA   GLU  82           HA       GLU  82  13.096  -6.932  21.920
  671    HB2  GLU  82           2HB      GLU  82  14.509  -5.661  23.760
  672    HB3  GLU  82           3HB      GLU  82  15.176  -5.887  22.151
  673    HG2  GLU  82           2HG      GLU  82  15.600  -3.627  23.093
  674    HG3  GLU  82           3HG      GLU  82  14.768  -3.607  21.547
  675    H    HIS  83           H        HIS  83  12.969  -6.923  24.541
  676    HA   HIS  83           HA       HIS  83  10.541  -5.442  25.389
  677    HB2  HIS  83           2HB      HIS  83  10.045  -7.882  25.144
  678    HB3  HIS  83           3HB      HIS  83  11.333  -8.258  26.286
  679    HD1  HIS  83           HD1      HIS  83  10.414  -8.735  28.556
  680    HD2  HIS  83           HD2      HIS  83   8.032  -5.999  26.526
  681    HE1  HIS  83           HE1      HIS  83   8.493  -8.238  30.089
  682    HE2  HIS  83           HE2      HIS  83   6.984  -6.739  28.761
  683    H    HIS  84           H        HIS  84  11.797  -3.762  26.180
  684    HA   HIS  84           HA       HIS  84  13.888  -4.029  28.110
  685    HB2  HIS  84           2HB      HIS  84  13.528  -1.969  26.740
  686    HB3  HIS  84           3HB      HIS  84  12.002  -1.680  27.570
  687    HD1  HIS  84           HD1      HIS  84  12.141  -0.829  30.048
  688    HD2  HIS  84           HD2      HIS  84  15.820  -1.159  28.130
  689    HE1  HIS  84           HE1      HIS  84  13.787   0.348  31.539
  690    HE2  HIS  84           HE2      HIS  84  16.000   0.107  30.379
  691    H    HIS  85           H        HIS  85  13.674  -4.582  30.216
  692    HA   HIS  85           HA       HIS  85  11.146  -5.019  31.493
  693    HB2  HIS  85           2HB      HIS  85  13.946  -4.980  32.704
  694    HB3  HIS  85           3HB      HIS  85  12.499  -5.558  33.525
  695    HD1  HIS  85           HD1      HIS  85  11.688  -7.914  32.958
  696    HD2  HIS  85           HD2      HIS  85  14.953  -6.722  30.676
  697    HE1  HIS  85           HE1      HIS  85  12.531  -9.992  31.842
  698    HE2  HIS  85           HE2      HIS  85  14.490  -9.250  30.460
  699    H    HIS  86           H        HIS  86  10.004  -3.094  31.608
  700    HA   HIS  86           HA       HIS  86  11.042  -0.877  33.224
  701    HB2  HIS  86           2HB      HIS  86   8.764   0.167  32.872
  702    HB3  HIS  86           3HB      HIS  86   9.696  -0.106  31.413
  703    HD1  HIS  86           HD1      HIS  86   6.422  -0.665  32.851
  704    HD2  HIS  86           HD2      HIS  86   8.718  -2.389  29.846
  705    HE1  HIS  86           HE1      HIS  86   4.799  -1.902  31.389
  706    HE2  HIS  86           HE2      HIS  86   6.229  -3.039  29.669
  707    H    HIS  87           H        HIS  87   9.572  -3.847  33.768
  708    HA   HIS  87           HA       HIS  87  10.195  -3.460  36.509
  709    HB2  HIS  87           2HB      HIS  87   8.129  -4.098  37.580
  710    HB3  HIS  87           3HB      HIS  87   7.750  -2.755  36.512
  711    HD1  HIS  87           HD1      HIS  87   6.896  -6.273  37.228
  712    HD2  HIS  87           HD2      HIS  87   6.186  -3.520  34.184
  713    HE1  HIS  87           HE1      HIS  87   4.915  -7.156  35.959
  714    HE2  HIS  87           HE2      HIS  87   4.436  -5.429  34.209
  715    H    HIS  88           H        HIS  88  10.514  -5.495  37.585
  716    HA   HIS  88           HA       HIS  88  11.070  -7.739  35.875
  717    HB2  HIS  88           2HB      HIS  88  12.434  -7.294  37.894
  718    HB3  HIS  88           3HB      HIS  88  11.035  -7.556  38.927
  719    HD1  HIS  88           HD1      HIS  88  13.407  -9.466  36.652
  720    HD2  HIS  88           HD2      HIS  88  10.554 -10.215  39.584
  721    HE1  HIS  88           HE1      HIS  88  13.595 -11.923  37.168
  722    HE2  HIS  88           HE2      HIS  88  11.844 -12.352  38.917
  Start of MODEL   12
    1    H1   MET   1           1H       MET   1  13.420   7.527  12.862
    2    H2   MET   1           2H       MET   1  13.631   9.003  12.069
    3    H3   MET   1           3H       MET   1  13.403   7.593  11.175
    4    HA   MET   1           HA       MET   1  11.424   8.830  12.992
    5    HB2  MET   1           2HB      MET   1  11.720  10.163  10.939
    6    HB3  MET   1           3HB      MET   1  11.536   8.725   9.942
    7    HG2  MET   1           2HG      MET   1   9.499  10.120   9.929
    8    HG3  MET   1           3HG      MET   1   9.185   8.526  10.619
    9    HE1  MET   1           3HE      MET   1   6.783  10.850  12.709
   10    HE2  MET   1           1HE      MET   1   6.882   9.417  11.688
   11    HE3  MET   1           2HE      MET   1   7.173  11.015  10.996
   12    H    GLY   2           H        GLY   2  12.250   6.250  10.738
   13    HA2  GLY   2           2HA      GLY   2  11.478   4.095  10.549
   14    HA3  GLY   2           3HA      GLY   2  10.337   4.389  11.857
   15    H    GLU   3           H        GLU   3  10.966   4.932   8.441
   16    HA   GLU   3           HA       GLU   3   8.193   5.535   7.827
   17    HB2  GLU   3           2HB      GLU   3   8.899   5.533   5.457
   18    HB3  GLU   3           3HB      GLU   3   9.880   6.606   6.435
   19    HG2  GLU   3           2HG      GLU   3  10.828   3.821   5.724
   20    HG3  GLU   3           3HG      GLU   3  11.044   5.177   4.626
   21    H    MET   4           H        MET   4   7.233   4.161   5.932
   22    HA   MET   4           HA       MET   4   7.397   1.304   6.727
   23    HB2  MET   4           2HB      MET   4   5.376   2.448   7.622
   24    HB3  MET   4           3HB      MET   4   4.905   2.909   5.990
   25    HG2  MET   4           2HG      MET   4   4.567   0.588   5.385
   26    HG3  MET   4           3HG      MET   4   5.200   0.054   6.949
   27    HE1  MET   4           3HE      MET   4   1.513  -0.830   7.608
   28    HE2  MET   4           1HE      MET   4   3.194  -1.335   7.770
   29    HE3  MET   4           2HE      MET   4   2.475  -1.152   6.167
   30    H    ASP   5           H        ASP   5   7.626  -0.174   5.031
   31    HA   ASP   5           HA       ASP   5   7.265   0.809   2.269
   32    HB2  ASP   5           2HB      ASP   5   9.610   0.124   2.770
   33    HB3  ASP   5           3HB      ASP   5   9.048  -1.449   3.323
   34    H    ILE   6           H        ILE   6   5.506  -0.045   1.357
   35    HA   ILE   6           HA       ILE   6   4.360  -2.608   2.329
   36    HB   ILE   6           HB       ILE   6   2.877  -0.149   1.255
   37   HG12  ILE   6          2HG1      ILE   6   2.913  -1.218   4.116
   38   HG13  ILE   6          3HG1      ILE   6   3.854   0.160   3.558
   39   HG21  ILE   6          1HG2      ILE   6   1.724  -2.240   0.672
   40   HG22  ILE   6          2HG2      ILE   6   0.805  -1.342   1.879
   41   HG23  ILE   6          3HG2      ILE   6   1.752  -2.750   2.363
   42   HD11  ILE   6          3HD1      ILE   6   1.760   1.320   2.994
   43   HD12  ILE   6          1HD1      ILE   6   1.922   0.926   4.705
   44   HD13  ILE   6          2HD1      ILE   6   0.861  -0.038   3.681
   45    H    ARG   7           H        ARG   7   4.915  -4.015   0.747
   46    HA   ARG   7           HA       ARG   7   4.770  -3.176  -2.085
   47    HB2  ARG   7           2HB      ARG   7   7.022  -3.907  -1.181
   48    HB3  ARG   7           3HB      ARG   7   6.351  -5.513  -0.916
   49    HG2  ARG   7           2HG      ARG   7   5.999  -5.819  -3.310
   50    HG3  ARG   7           3HG      ARG   7   6.467  -4.149  -3.628
   51    HD2  ARG   7           2HD      ARG   7   8.750  -4.783  -2.594
   52    HD3  ARG   7           3HD      ARG   7   8.217  -6.458  -2.773
   53    HE   ARG   7           HE       ARG   7   7.849  -5.694  -5.253
   54   HH11  ARG   7          1HH1      ARG   7  10.515  -4.739  -3.172
   55   HH12  ARG   7          2HH1      ARG   7  11.628  -4.531  -4.486
   56   HH21  ARG   7          1HH2      ARG   7   9.327  -5.424  -6.985
   57   HH22  ARG   7          2HH2      ARG   7  10.954  -4.920  -6.653
   58    H    PHE   8           H        PHE   8   3.283  -4.082  -3.301
   59    HA   PHE   8           HA       PHE   8   1.694  -6.399  -2.384
   60    HB2  PHE   8           2HB      PHE   8   1.111  -4.223  -4.458
   61    HB3  PHE   8           3HB      PHE   8   0.106  -5.651  -4.251
   62    HD1  PHE   8           HD1      PHE   8   1.181  -2.469  -2.651
   63    HD2  PHE   8           HD2      PHE   8  -1.480  -5.818  -2.427
   64    HE1  PHE   8           HE1      PHE   8  -0.155  -1.309  -0.944
   65    HE2  PHE   8           HE2      PHE   8  -2.808  -4.643  -0.720
   66    HZ   PHE   8           HZ       PHE   8  -2.145  -2.390   0.024
   67    H    ARG   9           H        ARG   9   1.193  -8.007  -4.080
   68    HA   ARG   9           HA       ARG   9   2.882  -8.125  -6.456
   69    HB2  ARG   9           2HB      ARG   9   4.279  -9.022  -4.476
   70    HB3  ARG   9           3HB      ARG   9   3.126 -10.340  -4.361
   71    HG2  ARG   9           2HG      ARG   9   3.711 -11.139  -6.578
   72    HG3  ARG   9           3HG      ARG   9   4.731  -9.735  -6.867
   73    HD2  ARG   9           2HD      ARG   9   6.174 -10.519  -4.922
   74    HD3  ARG   9           3HD      ARG   9   5.226 -12.014  -4.930
   75    HE   ARG   9           HE       ARG   9   6.222 -11.466  -7.529
   76   HH11  ARG   9          1HH1      ARG   9   7.330 -12.643  -4.396
   77   HH12  ARG   9          2HH1      ARG   9   8.648 -13.545  -5.072
   78   HH21  ARG   9          1HH2      ARG   9   7.997 -12.587  -8.387
   79   HH22  ARG   9          2HH2      ARG   9   9.029 -13.511  -7.339
   80    H    GLY  10           H        GLY  10   2.100  -9.674  -7.977
   81    HA2  GLY  10           2HA      GLY  10   0.158 -11.653  -7.466
   82    HA3  GLY  10           3HA      GLY  10  -0.668 -10.167  -7.942
   83    H    ASP  11           H        ASP  11  -1.419 -11.166  -9.833
   84    HA   ASP  11           HA       ASP  11   0.577 -11.674 -11.969
   85    HB2  ASP  11           2HB      ASP  11  -0.935 -13.581 -11.452
   86    HB3  ASP  11           3HB      ASP  11  -2.338 -12.562 -11.746
   87    H    ASP  12           H        ASP  12  -2.209  -9.791 -10.980
   88    HA   ASP  12           HA       ASP  12  -2.567  -8.632 -13.678
   89    HB2  ASP  12           2HB      ASP  12  -4.539  -9.780 -12.695
   90    HB3  ASP  12           3HB      ASP  12  -4.470  -8.725 -11.288
   91    H    LEU  13           H        LEU  13  -1.594  -6.737 -13.932
   92    HA   LEU  13           HA       LEU  13  -0.523  -5.136 -11.895
   93    HB2  LEU  13           2HB      LEU  13   0.405  -5.132 -14.149
   94    HB3  LEU  13           3HB      LEU  13  -1.069  -4.449 -14.802
   95    HG   LEU  13           HG       LEU  13  -0.628  -2.335 -13.489
   96   HD11  LEU  13          1HD1      LEU  13   1.594  -1.939 -12.507
   97   HD12  LEU  13          2HD1      LEU  13   2.015  -3.635 -12.767
   98   HD13  LEU  13          3HD1      LEU  13   0.706  -3.206 -11.660
   99   HD21  LEU  13          3HD2      LEU  13   0.046  -2.484 -15.839
  100   HD22  LEU  13          1HD2      LEU  13   1.625  -3.114 -15.360
  101   HD23  LEU  13          2HD2      LEU  13   1.152  -1.470 -14.915
  102    H    GLU  14           H        GLU  14  -3.733  -5.136 -13.289
  103    HA   GLU  14           HA       GLU  14  -4.382  -2.432 -12.513
  104    HB2  GLU  14           2HB      GLU  14  -6.142  -4.752 -13.377
  105    HB3  GLU  14           3HB      GLU  14  -6.786  -3.173 -12.938
  106    HG2  GLU  14           2HG      GLU  14  -4.849  -3.731 -15.199
  107    HG3  GLU  14           3HG      GLU  14  -6.574  -3.424 -15.370
  108    H    ALA  15           H        ALA  15  -4.707  -5.637 -11.029
  109    HA   ALA  15           HA       ALA  15  -6.296  -4.938  -8.814
  110    HB1  ALA  15           3HB      ALA  15  -4.097  -7.030  -9.041
  111    HB2  ALA  15           1HB      ALA  15  -5.784  -7.252  -9.508
  112    HB3  ALA  15           2HB      ALA  15  -5.368  -6.994  -7.813
  113    H    LEU  16           H        LEU  16  -2.823  -4.801  -9.403
  114    HA   LEU  16           HA       LEU  16  -1.981  -3.836  -6.858
  115    HB2  LEU  16           2HB      LEU  16  -0.594  -3.494  -9.544
  116    HB3  LEU  16           3HB      LEU  16   0.161  -3.436  -7.958
  117    HG   LEU  16           HG       LEU  16  -1.109  -5.946  -9.129
  118   HD11  LEU  16          1HD1      LEU  16   1.816  -5.153  -9.103
  119   HD12  LEU  16          2HD1      LEU  16   0.770  -5.237 -10.522
  120   HD13  LEU  16          3HD1      LEU  16   1.165  -6.706  -9.635
  121   HD21  LEU  16          3HD2      LEU  16  -1.003  -5.973  -6.686
  122   HD22  LEU  16          1HD2      LEU  16   0.719  -5.580  -6.731
  123   HD23  LEU  16          2HD2      LEU  16   0.143  -7.124  -7.364
  124    H    GLU  17           H        GLU  17  -3.035  -2.305  -9.874
  125    HA   GLU  17           HA       GLU  17  -2.120   0.333  -9.376
  126    HB2  GLU  17           2HB      GLU  17  -2.654  -0.918 -11.579
  127    HB3  GLU  17           3HB      GLU  17  -4.340  -0.544 -11.278
  128    HG2  GLU  17           2HG      GLU  17  -2.231   1.603 -11.449
  129    HG3  GLU  17           3HG      GLU  17  -2.984   0.935 -12.884
  130    H    LYS  18           H        LYS  18  -5.208  -1.343  -8.822
  131    HA   LYS  18           HA       LYS  18  -6.562   1.066  -7.909
  132    HB2  LYS  18           2HB      LYS  18  -7.438  -1.835  -8.139
  133    HB3  LYS  18           3HB      LYS  18  -8.410  -0.670  -7.256
  134    HG2  LYS  18           2HG      LYS  18  -9.354  -0.863  -9.451
  135    HG3  LYS  18           3HG      LYS  18  -8.558   0.712  -9.376
  136    HD2  LYS  18           2HD      LYS  18  -6.598  -0.259 -10.570
  137    HD3  LYS  18           3HD      LYS  18  -7.442  -1.805 -10.657
  138    HE2  LYS  18           2HE      LYS  18  -7.646  -0.703 -12.780
  139    HE3  LYS  18           3HE      LYS  18  -9.229  -0.687 -12.001
  140    HZ1  LYS  18           3HZ      LYS  18  -7.308   1.579 -12.124
  141    HZ2  LYS  18           1HZ      LYS  18  -8.785   1.615 -11.308
  142    HZ3  LYS  18           2HZ      LYS  18  -8.753   1.443 -12.986
  143    H    ALA  19           H        ALA  19  -4.926  -1.764  -6.445
  144    HA   ALA  19           HA       ALA  19  -5.435  -1.130  -3.727
  145    HB1  ALA  19           3HB      ALA  19  -3.408  -2.455  -3.229
  146    HB2  ALA  19           1HB      ALA  19  -2.969  -2.437  -4.944
  147    HB3  ALA  19           2HB      ALA  19  -4.427  -3.275  -4.413
  148    H    LEU  20           H        LEU  20  -2.869  -0.149  -5.963
  149    HA   LEU  20           HA       LEU  20  -1.303   1.545  -4.452
  150    HB2  LEU  20           2HB      LEU  20  -0.783   0.836  -6.761
  151    HB3  LEU  20           3HB      LEU  20  -2.098   1.813  -7.379
  152    HG   LEU  20           HG       LEU  20  -0.919   3.876  -6.737
  153   HD11  LEU  20          1HD1      LEU  20   1.356   3.865  -5.858
  154   HD12  LEU  20          2HD1      LEU  20   1.317   2.107  -5.710
  155   HD13  LEU  20          3HD1      LEU  20   0.239   3.104  -4.729
  156   HD21  LEU  20          3HD2      LEU  20  -0.497   2.920  -8.955
  157   HD22  LEU  20          1HD2      LEU  20   0.867   1.998  -8.315
  158   HD23  LEU  20          2HD2      LEU  20   0.921   3.765  -8.342
  159    H    LYS  21           H        LYS  21  -4.120   2.364  -6.446
  160    HA   LYS  21           HA       LYS  21  -4.433   5.056  -6.036
  161    HB2  LYS  21           2HB      LYS  21  -5.801   3.692  -7.569
  162    HB3  LYS  21           3HB      LYS  21  -6.564   2.896  -6.203
  163    HG2  LYS  21           2HG      LYS  21  -7.320   5.362  -5.560
  164    HG3  LYS  21           3HG      LYS  21  -6.989   5.690  -7.262
  165    HD2  LYS  21           2HD      LYS  21  -9.382   5.138  -6.875
  166    HD3  LYS  21           3HD      LYS  21  -8.608   3.952  -7.935
  167    HE2  LYS  21           2HE      LYS  21  -8.395   2.374  -6.085
  168    HE3  LYS  21           3HE      LYS  21  -9.008   3.570  -4.943
  169    HZ1  LYS  21           3HZ      LYS  21 -11.130   3.497  -6.023
  170    HZ2  LYS  21           1HZ      LYS  21 -10.677   1.936  -5.586
  171    HZ3  LYS  21           2HZ      LYS  21 -10.562   2.429  -7.195
  172    H    GLU  22           H        GLU  22  -5.630   2.392  -4.016
  173    HA   GLU  22           HA       GLU  22  -6.972   4.010  -2.105
  174    HB2  GLU  22           2HB      GLU  22  -6.056   1.121  -2.054
  175    HB3  GLU  22           3HB      GLU  22  -6.995   1.851  -0.758
  176    HG2  GLU  22           2HG      GLU  22  -7.935   1.702  -3.635
  177    HG3  GLU  22           3HG      GLU  22  -8.313   0.493  -2.413
  178    H    MET  23           H        MET  23  -3.687   2.481  -2.098
  179    HA   MET  23           HA       MET  23  -3.113   3.219   0.606
  180    HB2  MET  23           2HB      MET  23  -1.183   2.462  -1.622
  181    HB3  MET  23           3HB      MET  23  -0.773   2.560   0.089
  182    HG2  MET  23           2HG      MET  23  -2.702   0.624  -1.198
  183    HG3  MET  23           3HG      MET  23  -1.115   0.248  -0.538
  184    HE1  MET  23           3HE      MET  23  -1.716   0.540   3.301
  185    HE2  MET  23           1HE      MET  23  -1.053   1.784   2.243
  186    HE3  MET  23           2HE      MET  23  -0.584   0.098   2.021
  187    H    ILE  24           H        ILE  24  -2.497   4.802  -2.501
  188    HA   ILE  24           HA       ILE  24  -0.968   7.000  -1.525
  189    HB   ILE  24           HB       ILE  24  -2.771   6.793  -3.998
  190   HG12  ILE  24          2HG1      ILE  24   0.273   6.624  -3.731
  191   HG13  ILE  24          3HG1      ILE  24  -0.806   5.285  -4.102
  192   HG21  ILE  24          1HG2      ILE  24  -1.667   8.841  -4.843
  193   HG22  ILE  24          2HG2      ILE  24  -0.804   9.005  -3.314
  194   HG23  ILE  24          3HG2      ILE  24  -2.560   9.157  -3.351
  195   HD11  ILE  24          3HD1      ILE  24   0.327   6.026  -6.095
  196   HD12  ILE  24          1HD1      ILE  24  -0.257   7.675  -5.864
  197   HD13  ILE  24          2HD1      ILE  24  -1.395   6.377  -6.234
  198    H    ARG  25           H        ARG  25  -4.428   6.467  -2.105
  199    HA   ARG  25           HA       ARG  25  -5.569   8.873  -1.317
  200    HB2  ARG  25           2HB      ARG  25  -6.842   7.119  -2.408
  201    HB3  ARG  25           3HB      ARG  25  -6.548   6.004  -1.085
  202    HG2  ARG  25           2HG      ARG  25  -7.981   7.450   0.381
  203    HG3  ARG  25           3HG      ARG  25  -8.341   8.451  -1.029
  204    HD2  ARG  25           2HD      ARG  25  -9.274   6.432  -2.176
  205    HD3  ARG  25           3HD      ARG  25  -8.981   5.496  -0.705
  206    HE   ARG  25           HE       ARG  25 -10.591   7.804  -0.193
  207   HH11  ARG  25          1HH1      ARG  25 -10.778   4.527  -1.505
  208   HH12  ARG  25          2HH1      ARG  25 -12.468   4.354  -1.142
  209   HH21  ARG  25          1HH2      ARG  25 -12.809   7.576   0.245
  210   HH22  ARG  25          2HH2      ARG  25 -13.623   6.092  -0.144
  211    H    GLN  26           H        GLN  26  -4.616   6.079   0.662
  212    HA   GLN  26           HA       GLN  26  -5.560   7.047   3.161
  213    HB2  GLN  26           2HB      GLN  26  -3.342   5.034   2.589
  214    HB3  GLN  26           3HB      GLN  26  -4.063   5.321   4.168
  215    HG2  GLN  26           2HG      GLN  26  -5.429   4.152   1.741
  216    HG3  GLN  26           3HG      GLN  26  -4.971   3.300   3.205
  217   HE21  GLN  26          1HE2      GLN  26  -7.581   3.543   1.940
  218   HE22  GLN  26          2HE2      GLN  26  -8.637   4.234   3.117
  219    H    ALA  27           H        ALA  27  -2.274   6.936   1.751
  220    HA   ALA  27           HA       ALA  27  -0.874   8.243   3.758
  221    HB1  ALA  27           3HB      ALA  27   0.198   7.032   1.913
  222    HB2  ALA  27           1HB      ALA  27   0.856   8.662   2.059
  223    HB3  ALA  27           2HB      ALA  27  -0.302   8.288   0.777
  224    H    ARG  28           H        ARG  28  -2.736   9.635   1.080
  225    HA   ARG  28           HA       ARG  28  -1.869  12.347   1.472
  226    HB2  ARG  28           2HB      ARG  28  -4.205  11.217  -0.127
  227    HB3  ARG  28           3HB      ARG  28  -3.728  12.912  -0.132
  228    HG2  ARG  28           2HG      ARG  28  -1.487  12.227  -1.060
  229    HG3  ARG  28           3HG      ARG  28  -2.084  10.572  -1.154
  230    HD2  ARG  28           2HD      ARG  28  -2.270  11.661  -3.340
  231    HD3  ARG  28           3HD      ARG  28  -3.874  11.295  -2.699
  232    HE   ARG  28           HE       ARG  28  -3.178  13.924  -1.972
  233   HH11  ARG  28          1HH1      ARG  28  -4.052  12.142  -4.892
  234   HH12  ARG  28          2HH1      ARG  28  -4.701  13.541  -5.685
  235   HH21  ARG  28          1HH2      ARG  28  -4.028  15.728  -3.020
  236   HH22  ARG  28          2HH2      ARG  28  -4.687  15.578  -4.619
  237    H    LYS  29           H        LYS  29  -4.775  10.458   2.454
  238    HA   LYS  29           HA       LYS  29  -6.154  12.737   3.558
  239    HB2  LYS  29           2HB      LYS  29  -7.826  11.212   4.386
  240    HB3  LYS  29           3HB      LYS  29  -7.353  10.665   2.784
  241    HG2  LYS  29           2HG      LYS  29  -5.923   8.930   3.827
  242    HG3  LYS  29           3HG      LYS  29  -6.466   9.450   5.418
  243    HD2  LYS  29           2HD      LYS  29  -8.249   8.317   3.222
  244    HD3  LYS  29           3HD      LYS  29  -7.654   7.416   4.615
  245    HE2  LYS  29           2HE      LYS  29  -8.904   9.018   6.105
  246    HE3  LYS  29           3HE      LYS  29  -9.581   9.766   4.654
  247    HZ1  LYS  29           3HZ      LYS  29 -11.110   8.146   5.589
  248    HZ2  LYS  29           1HZ      LYS  29  -9.949   6.924   5.476
  249    HZ3  LYS  29           2HZ      LYS  29 -10.579   7.622   4.072
  250    H    PHE  30           H        PHE  30  -3.704  10.600   4.740
  251    HA   PHE  30           HA       PHE  30  -3.980  11.449   7.531
  252    HB2  PHE  30           2HB      PHE  30  -1.980   9.579   6.186
  253    HB3  PHE  30           3HB      PHE  30  -2.012   9.924   7.912
  254    HD1  PHE  30           HD1      PHE  30  -4.903   9.791   8.548
  255    HD2  PHE  30           HD2      PHE  30  -2.544   7.283   6.007
  256    HE1  PHE  30           HE1      PHE  30  -6.451   7.918   8.934
  257    HE2  PHE  30           HE2      PHE  30  -4.109   5.423   6.393
  258    HZ   PHE  30           HZ       PHE  30  -6.061   5.741   7.857
  259    H    ALA  31           H        ALA  31  -2.791  12.911   4.870
  260    HA   ALA  31           HA       ALA  31  -1.408  14.636   4.406
  261    HB1  ALA  31           3HB      ALA  31  -1.261  15.021   7.413
  262    HB2  ALA  31           1HB      ALA  31  -2.518  15.669   6.356
  263    HB3  ALA  31           2HB      ALA  31  -0.851  16.221   6.183
  264    H    GLY  32           H        GLY  32  -0.195  12.407   4.037
  265    HA2  GLY  32           2HA      GLY  32   2.496  12.511   5.281
  266    HA3  GLY  32           3HA      GLY  32   1.665  11.022   4.856
  267    H    THR  33           H        THR  33   3.918  10.875   3.798
  268    HA   THR  33           HA       THR  33   3.975  12.047   1.082
  269    HB   THR  33           HB       THR  33   6.250  10.797   2.705
  270    HG1  THR  33           HG1      THR  33   5.525  12.791   3.592
  271   HG21  THR  33          3HG2      THR  33   6.633  10.676   0.258
  272   HG22  THR  33          1HG2      THR  33   7.743  11.814   1.028
  273   HG23  THR  33          2HG2      THR  33   6.346  12.413   0.133
  274    H    VAL  34           H        VAL  34   4.002  10.595  -0.705
  275    HA   VAL  34           HA       VAL  34   4.382   7.726  -0.208
  276    HB   VAL  34           HB       VAL  34   1.956   8.054  -0.053
  277   HG11  VAL  34          1HG1      VAL  34   1.691  10.115  -1.338
  278   HG12  VAL  34          2HG1      VAL  34   0.585   8.871  -1.923
  279   HG13  VAL  34          3HG1      VAL  34   2.049   9.252  -2.836
  280   HG21  VAL  34          3HG2      VAL  34   1.189   6.454  -1.768
  281   HG22  VAL  34          1HG2      VAL  34   2.717   5.947  -1.042
  282   HG23  VAL  34          2HG2      VAL  34   2.702   6.668  -2.653
  283    H    THR  35           H        THR  35   5.633   6.820  -1.732
  284    HA   THR  35           HA       THR  35   5.651   7.756  -4.512
  285    HB   THR  35           HB       THR  35   8.186   7.514  -2.818
  286    HG1  THR  35           HG1      THR  35   6.615   9.610  -3.521
  287   HG21  THR  35          3HG2      THR  35   8.612   6.592  -5.084
  288   HG22  THR  35          1HG2      THR  35   9.459   8.123  -4.847
  289   HG23  THR  35          2HG2      THR  35   7.980   8.073  -5.807
  290    H    TYR  36           H        TYR  36   5.858   6.035  -5.909
  291    HA   TYR  36           HA       TYR  36   6.210   3.338  -4.718
  292    HB2  TYR  36           2HB      TYR  36   4.320   2.559  -6.120
  293    HB3  TYR  36           3HB      TYR  36   3.818   3.788  -4.968
  294    HD1  TYR  36           HD2      TYR  36   3.137   6.047  -5.751
  295    HD2  TYR  36           HD1      TYR  36   4.296   3.023  -8.551
  296    HE1  TYR  36           HE2      TYR  36   2.160   7.363  -7.585
  297    HE2  TYR  36           HE1      TYR  36   3.317   4.344 -10.374
  298    HH   TYR  36           HH       TYR  36   1.665   6.121 -10.710
  299    H    THR  37           H        THR  37   6.623   1.646  -6.299
  300    HA   THR  37           HA       THR  37   7.684   2.474  -8.925
  301    HB   THR  37           HB       THR  37   9.099   0.514  -7.050
  302    HG1  THR  37           HG1      THR  37   9.296   3.256  -7.295
  303   HG21  THR  37          3HG2      THR  37   9.474   0.007  -9.443
  304   HG22  THR  37          1HG2      THR  37  10.949   0.628  -8.697
  305   HG23  THR  37          2HG2      THR  37   9.974   1.677  -9.726
  306    H    LEU  38           H        LEU  38   6.230   1.476 -10.268
  307    HA   LEU  38           HA       LEU  38   5.214  -1.202  -9.868
  308    HB2  LEU  38           2HB      LEU  38   5.216   0.627 -12.310
  309    HB3  LEU  38           3HB      LEU  38   4.386  -0.921 -12.245
  310    HG   LEU  38           HG       LEU  38   3.747   1.452 -10.445
  311   HD11  LEU  38          1HD1      LEU  38   3.147   1.967 -12.757
  312   HD12  LEU  38          2HD1      LEU  38   1.708   1.735 -11.770
  313   HD13  LEU  38          3HD1      LEU  38   2.228   0.461 -12.876
  314   HD21  LEU  38          3HD2      LEU  38   2.282  -1.180 -10.798
  315   HD22  LEU  38          1HD2      LEU  38   1.733   0.189  -9.826
  316   HD23  LEU  38          2HD2      LEU  38   3.206  -0.672  -9.378
  317    H    ASP  39           H        ASP  39   6.171  -3.085 -10.523
  318    HA   ASP  39           HA       ASP  39   8.329  -3.111 -12.510
  319    HB2  ASP  39           2HB      ASP  39   9.387  -2.674 -10.239
  320    HB3  ASP  39           3HB      ASP  39   8.763  -4.219  -9.690
  321    H    GLY  40           H        GLY  40   7.116  -4.382 -13.835
  322    HA2  GLY  40           2HA      GLY  40   6.606  -6.383 -14.803
  323    HA3  GLY  40           3HA      GLY  40   7.212  -7.203 -13.375
  324    H    ASN  41           H        ASN  41   5.759  -7.970 -11.877
  325    HA   ASN  41           HA       ASN  41   2.876  -7.353 -12.208
  326    HB2  ASN  41           2HB      ASN  41   4.071 -10.111 -11.661
  327    HB3  ASN  41           3HB      ASN  41   2.352  -9.733 -11.716
  328   HD21  ASN  41          1HD2      ASN  41   1.444  -9.095 -13.777
  329   HD22  ASN  41          2HD2      ASN  41   2.160  -9.638 -15.246
  330    H    ASP  42           H        ASP  42   5.019  -6.333 -10.399
  331    HA   ASP  42           HA       ASP  42   3.428  -6.546  -7.956
  332    HB2  ASP  42           2HB      ASP  42   5.404  -6.770  -6.493
  333    HB3  ASP  42           3HB      ASP  42   5.207  -8.162  -7.544
  334    H    LEU  43           H        LEU  43   3.989  -4.889  -6.412
  335    HA   LEU  43           HA       LEU  43   4.853  -2.310  -7.598
  336    HB2  LEU  43           2HB      LEU  43   2.502  -2.245  -7.858
  337    HB3  LEU  43           3HB      LEU  43   2.210  -3.130  -6.369
  338    HG   LEU  43           HG       LEU  43   2.890  -1.084  -5.069
  339   HD11  LEU  43          1HD1      LEU  43   2.879   0.334  -7.744
  340   HD12  LEU  43          2HD1      LEU  43   4.289   0.046  -6.727
  341   HD13  LEU  43          3HD1      LEU  43   2.997   1.102  -6.160
  342   HD21  LEU  43          3HD2      LEU  43   0.785   0.087  -5.439
  343   HD22  LEU  43          1HD2      LEU  43   0.564  -1.662  -5.469
  344   HD23  LEU  43          2HD2      LEU  43   0.577  -0.748  -6.981
  345    H    GLU  44           H        GLU  44   6.208  -1.241  -6.221
  346    HA   GLU  44           HA       GLU  44   6.346  -1.995  -3.353
  347    HB2  GLU  44           2HB      GLU  44   8.407  -2.462  -4.585
  348    HB3  GLU  44           3HB      GLU  44   8.453  -0.818  -5.224
  349    HG2  GLU  44           2HG      GLU  44   8.780   0.050  -2.910
  350    HG3  GLU  44           3HG      GLU  44   8.773  -1.598  -2.295
  351    H    ILE  45           H        ILE  45   5.074  -0.548  -2.263
  352    HA   ILE  45           HA       ILE  45   5.084   2.329  -2.949
  353    HB   ILE  45           HB       ILE  45   3.343   0.813  -0.937
  354   HG12  ILE  45          2HG1      ILE  45   2.636   1.752  -3.757
  355   HG13  ILE  45          3HG1      ILE  45   2.955   0.085  -3.295
  356   HG21  ILE  45          1HG2      ILE  45   3.055   3.652  -1.996
  357   HG22  ILE  45          2HG2      ILE  45   3.553   3.199  -0.366
  358   HG23  ILE  45          3HG2      ILE  45   1.918   2.836  -0.918
  359   HD11  ILE  45          3HD1      ILE  45   1.000   0.123  -1.827
  360   HD12  ILE  45          1HD1      ILE  45   0.597   0.474  -3.506
  361   HD13  ILE  45          2HD1      ILE  45   0.663   1.784  -2.328
  362    H    ARG  46           H        ARG  46   6.104   3.787  -1.663
  363    HA   ARG  46           HA       ARG  46   7.193   2.985   0.980
  364    HB2  ARG  46           2HB      ARG  46   8.390   4.956  -1.028
  365    HB3  ARG  46           3HB      ARG  46   9.087   4.516   0.529
  366    HG2  ARG  46           2HG      ARG  46   9.447   2.204  -0.280
  367    HG3  ARG  46           3HG      ARG  46   8.727   2.635  -1.834
  368    HD2  ARG  46           2HD      ARG  46  10.532   4.327  -2.166
  369    HD3  ARG  46           3HD      ARG  46  11.270   3.804  -0.647
  370    HE   ARG  46           HE       ARG  46  10.947   1.583  -2.377
  371   HH11  ARG  46          1HH1      ARG  46  12.938   4.482  -2.041
  372   HH12  ARG  46          2HH1      ARG  46  14.285   3.797  -2.888
  373   HH21  ARG  46          1HH2      ARG  46  12.707   0.708  -3.502
  374   HH22  ARG  46          2HH2      ARG  46  14.154   1.643  -3.722
  375    H    ILE  47           H        ILE  47   5.958   3.970   2.472
  376    HA   ILE  47           HA       ILE  47   4.884   6.688   1.997
  377    HB   ILE  47           HB       ILE  47   3.875   4.563   3.951
  378   HG12  ILE  47          2HG1      ILE  47   2.704   5.517   1.289
  379   HG13  ILE  47          3HG1      ILE  47   3.463   3.957   1.569
  380   HG21  ILE  47          1HG2      ILE  47   3.452   6.867   4.765
  381   HG22  ILE  47          2HG2      ILE  47   1.949   6.062   4.316
  382   HG23  ILE  47          3HG2      ILE  47   2.660   7.263   3.236
  383   HD11  ILE  47          3HD1      ILE  47   1.081   3.731   1.486
  384   HD12  ILE  47          1HD1      ILE  47   0.874   4.923   2.770
  385   HD13  ILE  47          2HD1      ILE  47   1.649   3.374   3.116
  386    H    THR  48           H        THR  48   5.836   8.273   3.064
  387    HA   THR  48           HA       THR  48   7.573   7.744   5.409
  388    HB   THR  48           HB       THR  48   8.001   9.926   3.309
  389    HG1  THR  48           HG1      THR  48   8.374   7.278   3.003
  390   HG21  THR  48          3HG2      THR  48   9.962   8.660   5.266
  391   HG22  THR  48          1HG2      THR  48   9.217  10.258   5.442
  392   HG23  THR  48          2HG2      THR  48  10.324   9.939   4.109
  393    H    GLY  49           H        GLY  49   7.784   9.639   6.876
  394    HA2  GLY  49           2HA      GLY  49   7.278  11.733   7.730
  395    HA3  GLY  49           3HA      GLY  49   6.013  11.935   6.534
  396    H    VAL  50           H        VAL  50   4.552   9.590   7.015
  397    HA   VAL  50           HA       VAL  50   2.825  10.330   9.061
  398    HB   VAL  50           HB       VAL  50   1.779   8.062   8.773
  399   HG11  VAL  50          1HG1      VAL  50   1.090   8.353   6.422
  400   HG12  VAL  50          2HG1      VAL  50   2.430   9.472   6.154
  401   HG13  VAL  50          3HG1      VAL  50   1.131   9.900   7.271
  402   HG21  VAL  50          3HG2      VAL  50   3.813   6.723   8.396
  403   HG22  VAL  50          1HG2      VAL  50   4.072   7.526   6.843
  404   HG23  VAL  50          2HG2      VAL  50   2.659   6.494   7.083
  405    HA   PRO  51           HA       PRO  51   4.913   8.728  12.768
  406    HB2  PRO  51           2HB      PRO  51   2.814   8.874  14.539
  407    HB3  PRO  51           3HB      PRO  51   3.678  10.315  13.966
  408    HG2  PRO  51           2HG      PRO  51   1.069   9.181  12.999
  409    HG3  PRO  51           3HG      PRO  51   1.495  10.870  13.355
  410    HD2  PRO  51           2HD      PRO  51   1.465   9.914  10.816
  411    HD3  PRO  51           3HD      PRO  51   2.622  11.161  11.337
  412    H    GLU  52           H        GLU  52   4.546   6.976  14.470
  413    HA   GLU  52           HA       GLU  52   4.368   4.473  13.292
  414    HB2  GLU  52           2HB      GLU  52   5.544   4.848  15.413
  415    HB3  GLU  52           3HB      GLU  52   4.024   5.213  16.225
  416    HG2  GLU  52           2HG      GLU  52   3.321   2.793  15.561
  417    HG3  GLU  52           3HG      GLU  52   5.034   2.532  15.233
  418    H    GLN  53           H        GLN  53   1.940   6.062  15.364
  419    HA   GLN  53           HA       GLN  53  -0.041   4.154  15.481
  420    HB2  GLN  53           2HB      GLN  53  -1.637   6.092  15.802
  421    HB3  GLN  53           3HB      GLN  53  -0.202   6.145  16.819
  422    HG2  GLN  53           2HG      GLN  53   0.809   7.857  15.455
  423    HG3  GLN  53           3HG      GLN  53  -0.451   7.707  14.234
  424   HE21  GLN  53          1HE2      GLN  53  -2.482   8.664  14.619
  425   HE22  GLN  53          2HE2      GLN  53  -2.717   9.826  15.876
  426    H    VAL  54           H        VAL  54   0.505   6.496  12.887
  427    HA   VAL  54           HA       VAL  54  -1.869   5.816  11.413
  428    HB   VAL  54           HB       VAL  54   0.553   7.550  10.768
  429   HG11  VAL  54          1HG1      VAL  54  -0.723   8.425   8.841
  430   HG12  VAL  54          2HG1      VAL  54  -1.967   7.202   9.111
  431   HG13  VAL  54          3HG1      VAL  54  -0.336   6.713   8.649
  432   HG21  VAL  54          3HG2      VAL  54  -1.033   9.423  11.099
  433   HG22  VAL  54          1HG2      VAL  54  -0.913   8.422  12.547
  434   HG23  VAL  54          2HG2      VAL  54  -2.317   8.275  11.486
  435    H    ARG  55           H        ARG  55   1.617   5.055  11.147
  436    HA   ARG  55           HA       ARG  55   1.683   3.566   8.789
  437    HB2  ARG  55           2HB      ARG  55   3.250   3.327  11.378
  438    HB3  ARG  55           3HB      ARG  55   3.583   2.270  10.011
  439    HG2  ARG  55           2HG      ARG  55   4.391   4.027   8.671
  440    HG3  ARG  55           3HG      ARG  55   3.649   5.273   9.680
  441    HD2  ARG  55           2HD      ARG  55   6.232   4.848   9.842
  442    HD3  ARG  55           3HD      ARG  55   5.295   5.137  11.310
  443    HE   ARG  55           HE       ARG  55   5.701   2.349  10.540
  444   HH11  ARG  55          1HH1      ARG  55   6.816   5.000  12.565
  445   HH12  ARG  55          2HH1      ARG  55   7.617   3.957  13.691
  446   HH21  ARG  55          1HH2      ARG  55   6.657   0.994  12.111
  447   HH22  ARG  55          2HH2      ARG  55   7.527   1.692  13.435
  448    H    LYS  56           H        LYS  56   0.807   2.529  12.083
  449    HA   LYS  56           HA       LYS  56   0.361  -0.187  11.655
  450    HB2  LYS  56           2HB      LYS  56  -1.098   1.711  13.548
  451    HB3  LYS  56           3HB      LYS  56  -1.132  -0.048  13.658
  452    HG2  LYS  56           2HG      LYS  56   1.301  -0.085  14.107
  453    HG3  LYS  56           3HG      LYS  56   1.358   1.672  13.957
  454    HD2  LYS  56           2HD      LYS  56   1.321   1.113  16.322
  455    HD3  LYS  56           3HD      LYS  56  -0.224   1.852  15.897
  456    HE2  LYS  56           2HE      LYS  56  -1.236  -0.417  15.747
  457    HE3  LYS  56           3HE      LYS  56   0.306  -1.118  16.241
  458    HZ1  LYS  56           3HZ      LYS  56  -1.278  -0.886  18.072
  459    HZ2  LYS  56           1HZ      LYS  56  -1.272   0.794  17.875
  460    HZ3  LYS  56           2HZ      LYS  56   0.138  -0.011  18.338
  461    H    GLU  57           H        GLU  57  -1.812   2.591  11.165
  462    HA   GLU  57           HA       GLU  57  -4.114   1.109  10.430
  463    HB2  GLU  57           2HB      GLU  57  -3.385   3.965   9.662
  464    HB3  GLU  57           3HB      GLU  57  -4.988   3.247   9.528
  465    HG2  GLU  57           2HG      GLU  57  -3.457   3.887  12.059
  466    HG3  GLU  57           3HG      GLU  57  -4.959   4.615  11.497
  467    H    LEU  58           H        LEU  58  -1.414   2.455   8.552
  468    HA   LEU  58           HA       LEU  58  -2.340   1.769   5.969
  469    HB2  LEU  58           2HB      LEU  58   0.391   2.389   7.103
  470    HB3  LEU  58           3HB      LEU  58   0.287   1.712   5.494
  471    HG   LEU  58           HG       LEU  58   0.487   4.065   5.216
  472   HD11  LEU  58          1HD1      LEU  58  -1.556   4.713   4.042
  473   HD12  LEU  58          2HD1      LEU  58  -2.425   3.363   4.777
  474   HD13  LEU  58          3HD1      LEU  58  -1.081   3.059   3.674
  475   HD21  LEU  58          3HD2      LEU  58  -0.989   5.743   6.225
  476   HD22  LEU  58          1HD2      LEU  58  -0.103   4.832   7.444
  477   HD23  LEU  58          2HD2      LEU  58  -1.807   4.480   7.151
  478    H    ALA  59           H        ALA  59  -0.820  -0.195   8.486
  479    HA   ALA  59           HA       ALA  59  -0.252  -2.470   6.894
  480    HB1  ALA  59           3HB      ALA  59  -0.083  -3.688   9.002
  481    HB2  ALA  59           1HB      ALA  59  -0.879  -2.363   9.864
  482    HB3  ALA  59           2HB      ALA  59   0.710  -2.120   9.135
  483    H    LYS  60           H        LYS  60  -3.168  -1.613   8.855
  484    HA   LYS  60           HA       LYS  60  -4.641  -3.959   8.174
  485    HB2  LYS  60           2HB      LYS  60  -5.463  -1.279   9.295
  486    HB3  LYS  60           3HB      LYS  60  -6.709  -2.360   8.701
  487    HG2  LYS  60           2HG      LYS  60  -6.661  -2.801  10.997
  488    HG3  LYS  60           3HG      LYS  60  -5.723  -4.125  10.312
  489    HD2  LYS  60           2HD      LYS  60  -4.638  -3.319  12.325
  490    HD3  LYS  60           3HD      LYS  60  -3.629  -2.914  10.934
  491    HE2  LYS  60           2HE      LYS  60  -3.737  -1.048  12.527
  492    HE3  LYS  60           3HE      LYS  60  -4.462  -0.597  10.990
  493    HZ1  LYS  60           3HZ      LYS  60  -5.879  -1.284  13.506
  494    HZ2  LYS  60           1HZ      LYS  60  -6.656  -1.032  12.028
  495    HZ3  LYS  60           2HZ      LYS  60  -5.800   0.227  12.754
  496    H    GLU  61           H        GLU  61  -4.247  -0.819   6.563
  497    HA   GLU  61           HA       GLU  61  -6.292  -1.224   4.611
  498    HB2  GLU  61           2HB      GLU  61  -3.878   0.638   4.566
  499    HB3  GLU  61           3HB      GLU  61  -5.181   0.663   3.383
  500    HG2  GLU  61           2HG      GLU  61  -5.392   1.291   6.335
  501    HG3  GLU  61           3HG      GLU  61  -5.536   2.430   5.002
  502    H    ALA  62           H        ALA  62  -2.765  -1.758   4.626
  503    HA   ALA  62           HA       ALA  62  -2.327  -2.691   2.055
  504    HB1  ALA  62           3HB      ALA  62  -0.384  -3.877   2.995
  505    HB2  ALA  62           1HB      ALA  62  -1.047  -3.693   4.627
  506    HB3  ALA  62           2HB      ALA  62  -0.547  -2.273   3.708
  507    H    GLU  63           H        GLU  63  -3.291  -4.552   4.919
  508    HA   GLU  63           HA       GLU  63  -3.408  -7.106   3.733
  509    HB2  GLU  63           2HB      GLU  63  -4.731  -5.993   6.234
  510    HB3  GLU  63           3HB      GLU  63  -4.683  -7.707   5.820
  511    HG2  GLU  63           2HG      GLU  63  -2.214  -7.687   5.943
  512    HG3  GLU  63           3HG      GLU  63  -2.237  -5.964   6.307
  513    H    ARG  64           H        ARG  64  -5.993  -4.660   4.289
  514    HA   ARG  64           HA       ARG  64  -8.124  -6.407   3.546
  515    HB2  ARG  64           2HB      ARG  64  -9.612  -4.518   3.664
  516    HB3  ARG  64           3HB      ARG  64  -8.443  -4.341   4.964
  517    HG2  ARG  64           2HG      ARG  64  -7.193  -2.714   3.498
  518    HG3  ARG  64           3HG      ARG  64  -8.530  -2.800   2.356
  519    HD2  ARG  64           2HD      ARG  64  -8.804  -1.923   5.252
  520    HD3  ARG  64           3HD      ARG  64  -8.585  -0.820   3.896
  521    HE   ARG  64           HE       ARG  64 -10.856  -2.534   3.533
  522   HH11  ARG  64          1HH1      ARG  64  -9.777   0.432   5.117
  523   HH12  ARG  64          2HH1      ARG  64 -11.378   1.107   5.209
  524   HH21  ARG  64          1HH2      ARG  64 -12.969  -1.655   3.695
  525   HH22  ARG  64          2HH2      ARG  64 -13.197  -0.083   4.399
  526    H    LEU  65           H        LEU  65  -6.036  -4.214   1.730
  527    HA   LEU  65           HA       LEU  65  -7.539  -4.345  -0.734
  528    HB2  LEU  65           2HB      LEU  65  -4.673  -3.464  -0.243
  529    HB3  LEU  65           3HB      LEU  65  -5.595  -3.178  -1.712
  530    HG   LEU  65           HG       LEU  65  -6.221  -2.015   1.022
  531   HD11  LEU  65          1HD1      LEU  65  -5.533   0.115   0.076
  532   HD12  LEU  65          2HD1      LEU  65  -5.118  -0.673  -1.449
  533   HD13  LEU  65          3HD1      LEU  65  -4.221  -1.060   0.022
  534   HD21  LEU  65          3HD2      LEU  65  -8.291  -2.370  -0.201
  535   HD22  LEU  65          1HD2      LEU  65  -7.637  -1.539  -1.617
  536   HD23  LEU  65          2HD2      LEU  65  -7.920  -0.651  -0.117
  537    H    ALA  66           H        ALA  66  -4.821  -6.092   0.685
  538    HA   ALA  66           HA       ALA  66  -3.914  -7.543  -1.524
  539    HB1  ALA  66           3HB      ALA  66  -2.773  -7.535   0.661
  540    HB2  ALA  66           1HB      ALA  66  -3.047  -9.179   0.084
  541    HB3  ALA  66           2HB      ALA  66  -4.076  -8.503   1.352
  542    H    LYS  67           H        LYS  67  -6.440  -8.454   0.843
  543    HA   LYS  67           HA       LYS  67  -7.121 -10.893  -0.530
  544    HB2  LYS  67           2HB      LYS  67  -8.962 -11.051   1.147
  545    HB3  LYS  67           3HB      LYS  67  -7.378 -10.812   1.872
  546    HG2  LYS  67           2HG      LYS  67  -7.882  -8.441   2.260
  547    HG3  LYS  67           3HG      LYS  67  -9.459  -8.632   1.495
  548    HD2  LYS  67           2HD      LYS  67  -8.573 -10.092   4.023
  549    HD3  LYS  67           3HD      LYS  67  -9.587  -8.647   3.991
  550    HE2  LYS  67           2HE      LYS  67 -11.326  -9.861   2.748
  551    HE3  LYS  67           3HE      LYS  67 -10.308 -11.302   2.695
  552    HZ1  LYS  67           3HZ      LYS  67 -11.398 -10.040   5.145
  553    HZ2  LYS  67           1HZ      LYS  67 -10.417 -11.413   5.103
  554    HZ3  LYS  67           2HZ      LYS  67 -11.965 -11.458   4.427
  555    H    GLU  68           H        GLU  68  -8.289  -7.586  -0.548
  556    HA   GLU  68           HA       GLU  68 -10.833  -7.903  -1.731
  557    HB2  GLU  68           2HB      GLU  68  -9.999  -5.812  -0.644
  558    HB3  GLU  68           3HB      GLU  68  -8.878  -5.575  -1.977
  559    HG2  GLU  68           2HG      GLU  68 -10.741  -4.090  -2.271
  560    HG3  GLU  68           3HG      GLU  68 -10.824  -5.328  -3.518
  561    H    PHE  69           H        PHE  69  -7.687  -7.103  -3.194
  562    HA   PHE  69           HA       PHE  69  -8.751  -7.366  -5.914
  563    HB2  PHE  69           2HB      PHE  69  -6.077  -6.311  -4.895
  564    HB3  PHE  69           3HB      PHE  69  -6.592  -6.292  -6.579
  565    HD1  PHE  69           HD1      PHE  69  -8.904  -5.078  -7.049
  566    HD2  PHE  69           HD2      PHE  69  -6.502  -4.368  -3.580
  567    HE1  PHE  69           HE1      PHE  69 -10.043  -2.928  -6.686
  568    HE2  PHE  69           HE2      PHE  69  -7.648  -2.217  -3.231
  569    HZ   PHE  69           HZ       PHE  69  -9.425  -1.502  -4.775
  570    H    ASN  70           H        ASN  70  -7.666  -9.530  -3.805
  571    HA   ASN  70           HA       ASN  70  -7.036 -11.686  -3.932
  572    HB2  ASN  70           2HB      ASN  70  -8.701 -11.640  -5.843
  573    HB3  ASN  70           3HB      ASN  70  -7.360 -11.415  -6.958
  574   HD21  ASN  70          1HD2      ASN  70  -6.069 -13.214  -7.474
  575   HD22  ASN  70          2HD2      ASN  70  -6.475 -14.825  -7.004
  576    H    ILE  71           H        ILE  71  -5.095  -9.549  -4.024
  577    HA   ILE  71           HA       ILE  71  -2.734 -10.860  -5.251
  578    HB   ILE  71           HB       ILE  71  -1.613  -8.603  -4.975
  579   HG12  ILE  71          2HG1      ILE  71  -4.450  -7.686  -4.295
  580   HG13  ILE  71          3HG1      ILE  71  -3.037  -7.591  -3.253
  581   HG21  ILE  71          1HG2      ILE  71  -2.643  -7.589  -6.962
  582   HG22  ILE  71          2HG2      ILE  71  -4.046  -8.643  -6.785
  583   HG23  ILE  71          3HG2      ILE  71  -2.464  -9.335  -7.155
  584   HD11  ILE  71          3HD1      ILE  71  -3.525  -6.009  -5.773
  585   HD12  ILE  71          1HD1      ILE  71  -2.040  -5.956  -4.816
  586   HD13  ILE  71          2HD1      ILE  71  -3.565  -5.419  -4.111
  587    H    THR  72           H        THR  72  -0.711 -10.551  -3.983
  588    HA   THR  72           HA       THR  72  -1.074 -11.014  -1.108
  589    HB   THR  72           HB       THR  72   1.456 -11.553  -1.238
  590    HG1  THR  72           HG1      THR  72   0.937 -11.595  -4.030
  591   HG21  THR  72          3HG2      THR  72   1.123 -13.791  -2.241
  592   HG22  THR  72          1HG2      THR  72  -0.418 -13.261  -2.923
  593   HG23  THR  72          2HG2      THR  72  -0.217 -13.372  -1.172
  594    H    VAL  73           H        VAL  73   0.271  -9.857   0.449
  595    HA   VAL  73           HA       VAL  73   1.685  -7.455  -0.481
  596    HB   VAL  73           HB       VAL  73  -0.686  -6.803   0.252
  597   HG11  VAL  73          1HG1      VAL  73  -1.206  -6.663   2.654
  598   HG12  VAL  73          2HG1      VAL  73   0.301  -7.499   3.041
  599   HG13  VAL  73          3HG1      VAL  73  -0.966  -8.337   2.144
  600   HG21  VAL  73          3HG2      VAL  73   1.119  -5.149   0.128
  601   HG22  VAL  73          1HG2      VAL  73   1.615  -5.529   1.779
  602   HG23  VAL  73          2HG2      VAL  73   0.040  -4.787   1.476
  603    H    THR  74           H        THR  74   3.261  -6.728   0.935
  604    HA   THR  74           HA       THR  74   3.761  -8.070   3.484
  605    HB   THR  74           HB       THR  74   5.250  -9.287   1.969
  606    HG1  THR  74           HG1      THR  74   6.884  -7.363   3.293
  607   HG21  THR  74          3HG2      THR  74   6.381  -6.600   1.105
  608   HG22  THR  74          1HG2      THR  74   5.393  -7.669   0.103
  609   HG23  THR  74          2HG2      THR  74   6.997  -8.182   0.627
  610    H    TYR  75           H        TYR  75   4.805  -6.680   4.962
  611    HA   TYR  75           HA       TYR  75   5.533  -3.971   4.136
  612    HB2  TYR  75           2HB      TYR  75   4.062  -2.932   5.917
  613    HB3  TYR  75           3HB      TYR  75   3.171  -3.626   4.568
  614    HD1  TYR  75           HD2      TYR  75   1.832  -5.710   4.879
  615    HD2  TYR  75           HD1      TYR  75   3.858  -3.894   8.183
  616    HE1  TYR  75           HE2      TYR  75   0.517  -7.083   6.441
  617    HE2  TYR  75           HE1      TYR  75   2.546  -5.271   9.738
  618    HH   TYR  75           HH       TYR  75   0.738  -7.948   8.763
  619    H    THR  76           H        THR  76   6.881  -2.901   5.600
  620    HA   THR  76           HA       THR  76   7.880  -4.495   7.898
  621    HB   THR  76           HB       THR  76   9.504  -2.541   6.199
  622    HG1  THR  76           HG1      THR  76   9.011  -4.432   5.021
  623   HG21  THR  76          3HG2      THR  76  10.403  -4.517   8.342
  624   HG22  THR  76          1HG2      THR  76  10.372  -2.757   8.513
  625   HG23  THR  76          2HG2      THR  76  11.470  -3.513   7.359
  626    H    ILE  77           H        ILE  77   7.479  -3.596   9.782
  627    HA   ILE  77           HA       ILE  77   7.734  -0.742  10.292
  628    HB   ILE  77           HB       ILE  77   5.578  -0.824  11.758
  629   HG12  ILE  77          2HG1      ILE  77   4.893  -3.134   9.869
  630   HG13  ILE  77          3HG1      ILE  77   5.140  -3.255  11.606
  631   HG21  ILE  77          1HG2      ILE  77   4.121  -0.041   9.955
  632   HG22  ILE  77          2HG2      ILE  77   5.236  -0.703   8.759
  633   HG23  ILE  77          3HG2      ILE  77   5.752   0.621   9.807
  634   HD11  ILE  77          3HD1      ILE  77   2.877  -1.819  10.218
  635   HD12  ILE  77          1HD1      ILE  77   3.153  -1.841  11.963
  636   HD13  ILE  77          2HD1      ILE  77   2.800  -3.339  11.108
  637    H    ARG  78           H        ARG  78   8.529  -0.389  12.314
  638    HA   ARG  78           HA       ARG  78   8.682  -2.654  14.234
  639    HB2  ARG  78           2HB      ARG  78  10.537  -0.264  13.853
  640    HB3  ARG  78           3HB      ARG  78  10.633  -1.374  15.214
  641    HG2  ARG  78           2HG      ARG  78  11.129  -3.235  13.624
  642    HG3  ARG  78           3HG      ARG  78  11.127  -2.064  12.300
  643    HD2  ARG  78           2HD      ARG  78  12.988  -0.837  13.393
  644    HD3  ARG  78           3HD      ARG  78  12.988  -2.019  14.708
  645    HE   ARG  78           HE       ARG  78  13.366  -3.245  12.139
  646   HH11  ARG  78          1HH1      ARG  78  15.060  -1.514  14.686
  647   HH12  ARG  78          2HH1      ARG  78  16.610  -2.180  14.289
  648   HH21  ARG  78          1HH2      ARG  78  15.434  -4.142  11.629
  649   HH22  ARG  78          2HH2      ARG  78  16.822  -3.673  12.554
  650    H    GLY  79           H        GLY  79   9.259  -1.331  16.535
  651    HA2  GLY  79           2HA      GLY  79   8.710   0.405  18.004
  652    HA3  GLY  79           3HA      GLY  79   7.487   0.979  16.886
  653    H    SER  80           H        SER  80   5.871  -1.081  16.477
  654    HA   SER  80           HA       SER  80   4.510  -1.424  19.028
  655    HB2  SER  80           2HB      SER  80   3.662  -2.232  16.215
  656    HB3  SER  80           3HB      SER  80   2.626  -2.196  17.645
  657    HG   SER  80           HG       SER  80   3.265   0.141  17.718
  658    H    LEU  81           H        LEU  81   6.828  -3.177  17.384
  659    HA   LEU  81           HA       LEU  81   5.841  -5.868  18.015
  660    HB2  LEU  81           2HB      LEU  81   8.459  -5.001  16.725
  661    HB3  LEU  81           3HB      LEU  81   7.834  -6.642  16.797
  662    HG   LEU  81           HG       LEU  81   6.647  -4.332  15.202
  663   HD11  LEU  81          1HD1      LEU  81   8.697  -5.193  14.217
  664   HD12  LEU  81          2HD1      LEU  81   7.310  -5.641  13.229
  665   HD13  LEU  81          3HD1      LEU  81   8.073  -6.845  14.274
  666   HD21  LEU  81          3HD2      LEU  81   4.838  -5.774  15.995
  667   HD22  LEU  81          1HD2      LEU  81   5.669  -7.206  15.383
  668   HD23  LEU  81          2HD2      LEU  81   5.068  -5.981  14.262
  669    H    GLU  82           H        GLU  82   6.692  -3.800  20.082
  670    HA   GLU  82           HA       GLU  82   8.340  -5.588  21.730
  671    HB2  GLU  82           2HB      GLU  82   9.828  -3.790  22.448
  672    HB3  GLU  82           3HB      GLU  82   9.888  -3.901  20.692
  673    HG2  GLU  82           2HG      GLU  82   8.153  -1.987  20.674
  674    HG3  GLU  82           3HG      GLU  82   8.528  -1.786  22.381
  675    H    HIS  83           H        HIS  83   7.960  -5.333  23.979
  676    HA   HIS  83           HA       HIS  83   6.497  -3.299  25.244
  677    HB2  HIS  83           2HB      HIS  83   4.351  -4.567  25.779
  678    HB3  HIS  83           3HB      HIS  83   4.474  -4.009  24.117
  679    HD1  HIS  83           HD1      HIS  83   4.440  -5.751  22.282
  680    HD2  HIS  83           HD2      HIS  83   4.515  -7.414  26.084
  681    HE1  HIS  83           HE1      HIS  83   3.929  -8.190  21.970
  682    HE2  HIS  83           HE2      HIS  83   3.758  -9.104  24.294
  683    H    HIS  84           H        HIS  84   5.885  -3.872  27.493
  684    HA   HIS  84           HA       HIS  84   7.022  -6.349  28.605
  685    HB2  HIS  84           2HB      HIS  84   7.740  -3.523  29.510
  686    HB3  HIS  84           3HB      HIS  84   7.938  -4.918  30.563
  687    HD1  HIS  84           HD1      HIS  84   9.787  -6.638  29.933
  688    HD2  HIS  84           HD2      HIS  84   9.730  -3.230  27.547
  689    HE1  HIS  84           HE1      HIS  84  11.969  -6.640  28.701
  690    HE2  HIS  84           HE2      HIS  84  11.820  -4.697  27.114
  691    H    HIS  85           H        HIS  85   5.791  -7.144  30.294
  692    HA   HIS  85           HA       HIS  85   3.138  -6.212  30.589
  693    HB2  HIS  85           2HB      HIS  85   2.870  -7.994  32.271
  694    HB3  HIS  85           3HB      HIS  85   3.732  -8.596  30.867
  695    HD1  HIS  85           HD1      HIS  85   6.138  -9.452  31.235
  696    HD2  HIS  85           HD2      HIS  85   4.392  -7.911  34.678
  697    HE1  HIS  85           HE1      HIS  85   7.637 -10.136  33.126
  698    HE2  HIS  85           HE2      HIS  85   6.650  -9.055  35.162
  699    H    HIS  86           H        HIS  86   2.333  -4.655  31.856
  700    HA   HIS  86           HA       HIS  86   3.765  -3.851  34.330
  701    HB2  HIS  86           2HB      HIS  86   2.523  -1.996  32.247
  702    HB3  HIS  86           3HB      HIS  86   3.042  -1.471  33.845
  703    HD1  HIS  86           HD1      HIS  86   4.216  -1.433  30.520
  704    HD2  HIS  86           HD2      HIS  86   6.023  -2.292  34.168
  705    HE1  HIS  86           HE1      HIS  86   6.679  -1.122  30.150
  706    HE2  HIS  86           HE2      HIS  86   7.718  -1.452  32.408
  707    H    HIS  87           H        HIS  87   2.516  -4.551  35.901
  708    HA   HIS  87           HA       HIS  87  -0.108  -3.412  36.247
  709    HB2  HIS  87           2HB      HIS  87  -1.337  -5.497  36.631
  710    HB3  HIS  87           3HB      HIS  87  -0.674  -5.511  35.005
  711    HD1  HIS  87           HD1      HIS  87   1.114  -7.288  34.466
  712    HD2  HIS  87           HD2      HIS  87  -0.309  -7.468  38.369
  713    HE1  HIS  87           HE1      HIS  87   1.912  -9.479  35.381
  714    HE2  HIS  87           HE2      HIS  87   1.190  -9.485  37.784
  715    H    HIS  88           H        HIS  88  -0.939  -3.785  38.441
  716    HA   HIS  88           HA       HIS  88   1.084  -4.564  40.421
  717    HB2  HIS  88           2HB      HIS  88   0.495  -2.508  41.790
  718    HB3  HIS  88           3HB      HIS  88   1.412  -2.186  40.324
  719    HD1  HIS  88           HD1      HIS  88  -0.115  -1.298  38.236
  720    HD2  HIS  88           HD2      HIS  88  -1.774  -0.947  42.031
  721    HE1  HIS  88           HE1      HIS  88  -1.961   0.385  38.014
  722    HE2  HIS  88           HE2      HIS  88  -3.009   0.500  40.286
  Start of MODEL   13
    1    H1   MET   1           1H       MET   1   7.161  10.261  14.727
    2    H2   MET   1           2H       MET   1   6.599  10.905  13.266
    3    H3   MET   1           3H       MET   1   7.672  11.793  14.223
    4    HA   MET   1           HA       MET   1   8.778  10.839  12.321
    5    HB2  MET   1           2HB      MET   1  10.137  11.176  14.322
    6    HB3  MET   1           3HB      MET   1   9.551   9.683  15.041
    7    HG2  MET   1           2HG      MET   1  10.737   8.393  13.286
    8    HG3  MET   1           3HG      MET   1  11.333   9.905  12.599
    9    HE1  MET   1           3HE      MET   1  13.746   8.521  12.807
   10    HE2  MET   1           1HE      MET   1  12.981   7.218  13.721
   11    HE3  MET   1           2HE      MET   1  14.408   8.028  14.365
   12    H    GLY   2           H        GLY   2   9.103   9.106  10.961
   13    HA2  GLY   2           2HA      GLY   2   9.517   6.585  11.272
   14    HA3  GLY   2           3HA      GLY   2   7.792   6.550  11.608
   15    H    GLU   3           H        GLU   3   9.071   5.127   9.634
   16    HA   GLU   3           HA       GLU   3   7.596   6.037   7.267
   17    HB2  GLU   3           2HB      GLU   3   9.456   5.487   5.785
   18    HB3  GLU   3           3HB      GLU   3   9.979   6.703   6.942
   19    HG2  GLU   3           2HG      GLU   3  11.037   4.865   8.293
   20    HG3  GLU   3           3HG      GLU   3  10.632   3.742   6.998
   21    H    MET   4           H        MET   4   7.254   4.216   5.762
   22    HA   MET   4           HA       MET   4   7.303   1.519   6.922
   23    HB2  MET   4           2HB      MET   4   5.144   2.432   7.692
   24    HB3  MET   4           3HB      MET   4   4.747   2.980   6.065
   25    HG2  MET   4           2HG      MET   4   4.594   0.665   5.304
   26    HG3  MET   4           3HG      MET   4   5.076   0.088   6.905
   27    HE1  MET   4           3HE      MET   4   1.384  -0.956   7.052
   28    HE2  MET   4           1HE      MET   4   3.056  -1.415   7.368
   29    HE3  MET   4           2HE      MET   4   2.513  -1.132   5.711
   30    H    ASP   5           H        ASP   5   7.433  -0.088   5.274
   31    HA   ASP   5           HA       ASP   5   7.514   0.888   2.492
   32    HB2  ASP   5           2HB      ASP   5   9.768   0.379   3.268
   33    HB3  ASP   5           3HB      ASP   5   9.246  -1.113   4.031
   34    H    ILE   6           H        ILE   6   5.677   0.180   1.621
   35    HA   ILE   6           HA       ILE   6   4.413  -2.379   2.460
   36    HB   ILE   6           HB       ILE   6   3.088  -0.066   0.938
   37   HG12  ILE   6          2HG1      ILE   6   2.854  -0.729   3.911
   38   HG13  ILE   6          3HG1      ILE   6   3.676   0.671   3.232
   39   HG21  ILE   6          1HG2      ILE   6   0.963  -1.222   1.433
   40   HG22  ILE   6          2HG2      ILE   6   1.837  -2.514   2.254
   41   HG23  ILE   6          3HG2      ILE   6   2.050  -2.271   0.519
   42   HD11  ILE   6          3HD1      ILE   6   1.523   1.281   4.117
   43   HD12  ILE   6          1HD1      ILE   6   0.719   0.107   3.075
   44   HD13  ILE   6          2HD1      ILE   6   1.544   1.501   2.368
   45    H    ARG   7           H        ARG   7   3.925  -3.863   0.806
   46    HA   ARG   7           HA       ARG   7   4.717  -3.245  -1.948
   47    HB2  ARG   7           2HB      ARG   7   6.743  -4.041  -0.686
   48    HB3  ARG   7           3HB      ARG   7   5.928  -5.573  -0.405
   49    HG2  ARG   7           2HG      ARG   7   5.972  -6.121  -2.744
   50    HG3  ARG   7           3HG      ARG   7   6.486  -4.493  -3.189
   51    HD2  ARG   7           2HD      ARG   7   8.153  -6.373  -1.475
   52    HD3  ARG   7           3HD      ARG   7   8.314  -6.237  -3.225
   53    HE   ARG   7           HE       ARG   7   9.304  -4.143  -2.996
   54   HH11  ARG   7          1HH1      ARG   7   8.319  -5.287   0.175
   55   HH12  ARG   7          2HH1      ARG   7   9.238  -4.080   1.018
   56   HH21  ARG   7          1HH2      ARG   7  10.496  -2.568  -1.861
   57   HH22  ARG   7          2HH2      ARG   7  10.460  -2.552  -0.122
   58    H    PHE   8           H        PHE   8   3.272  -4.049  -3.259
   59    HA   PHE   8           HA       PHE   8   1.615  -6.385  -2.512
   60    HB2  PHE   8           2HB      PHE   8   1.125  -4.116  -4.509
   61    HB3  PHE   8           3HB      PHE   8   0.113  -5.554  -4.399
   62    HD1  PHE   8           HD1      PHE   8   1.053  -2.399  -2.720
   63    HD2  PHE   8           HD2      PHE   8  -1.415  -5.888  -2.521
   64    HE1  PHE   8           HE1      PHE   8  -0.295  -1.361  -0.948
   65    HE2  PHE   8           HE2      PHE   8  -2.760  -4.834  -0.758
   66    HZ   PHE   8           HZ       PHE   8  -2.200  -2.574   0.035
   67    H    ARG   9           H        ARG   9   1.307  -7.970  -4.143
   68    HA   ARG   9           HA       ARG   9   2.801  -7.801  -6.637
   69    HB2  ARG   9           2HB      ARG   9   4.246  -9.065  -4.811
   70    HB3  ARG   9           3HB      ARG   9   3.087 -10.377  -5.009
   71    HG2  ARG   9           2HG      ARG   9   3.577 -10.410  -7.445
   72    HG3  ARG   9           3HG      ARG   9   4.777  -9.147  -7.207
   73    HD2  ARG   9           2HD      ARG   9   5.821 -10.921  -5.513
   74    HD3  ARG   9           3HD      ARG   9   4.897 -12.060  -6.504
   75    HE   ARG   9           HE       ARG   9   6.440 -10.204  -8.048
   76   HH11  ARG   9          1HH1      ARG   9   6.627 -13.336  -6.460
   77   HH12  ARG   9          2HH1      ARG   9   7.977 -13.851  -7.417
   78   HH21  ARG   9          1HH2      ARG   9   8.242 -10.819  -9.175
   79   HH22  ARG   9          2HH2      ARG   9   8.901 -12.415  -8.967
   80    H    GLY  10           H        GLY  10   1.640  -8.768  -8.264
   81    HA2  GLY  10           2HA      GLY  10  -0.556 -10.581  -7.702
   82    HA3  GLY  10           3HA      GLY  10  -1.053  -8.942  -8.117
   83    H    ASP  11           H        ASP  11  -1.092 -11.719  -9.394
   84    HA   ASP  11           HA       ASP  11   0.278 -11.834 -11.808
   85    HB2  ASP  11           2HB      ASP  11  -0.965 -13.723 -10.910
   86    HB3  ASP  11           3HB      ASP  11  -2.482 -12.844 -11.009
   87    H    ASP  12           H        ASP  12  -2.592 -10.022 -10.933
   88    HA   ASP  12           HA       ASP  12  -2.859  -8.898 -13.653
   89    HB2  ASP  12           2HB      ASP  12  -4.954  -9.826 -12.786
   90    HB3  ASP  12           3HB      ASP  12  -4.807  -8.893 -11.302
   91    H    LEU  13           H        LEU  13  -1.692  -7.122 -13.896
   92    HA   LEU  13           HA       LEU  13  -0.541  -5.545 -11.866
   93    HB2  LEU  13           2HB      LEU  13   0.429  -5.739 -14.110
   94    HB3  LEU  13           3HB      LEU  13  -0.972  -4.955 -14.812
   95    HG   LEU  13           HG       LEU  13  -0.340  -2.849 -13.524
   96   HD11  LEU  13          1HD1      LEU  13   1.059  -3.831 -11.778
   97   HD12  LEU  13          2HD1      LEU  13   1.945  -2.606 -12.681
   98   HD13  LEU  13          3HD1      LEU  13   2.258  -4.318 -12.980
   99   HD21  LEU  13          3HD2      LEU  13   0.124  -3.085 -15.909
  100   HD22  LEU  13          1HD2      LEU  13   1.670  -3.861 -15.555
  101   HD23  LEU  13          2HD2      LEU  13   1.402  -2.172 -15.111
  102    H    GLU  14           H        GLU  14  -3.675  -5.322 -13.410
  103    HA   GLU  14           HA       GLU  14  -4.151  -2.534 -12.918
  104    HB2  GLU  14           2HB      GLU  14  -6.218  -4.741 -13.345
  105    HB3  GLU  14           3HB      GLU  14  -6.536  -3.010 -13.379
  106    HG2  GLU  14           2HG      GLU  14  -4.754  -2.981 -15.314
  107    HG3  GLU  14           3HG      GLU  14  -5.081  -4.708 -15.395
  108    H    ALA  15           H        ALA  15  -4.839  -5.545 -11.161
  109    HA   ALA  15           HA       ALA  15  -6.452  -4.500  -9.093
  110    HB1  ALA  15           3HB      ALA  15  -6.348  -6.893  -9.631
  111    HB2  ALA  15           1HB      ALA  15  -5.940  -6.631  -7.935
  112    HB3  ALA  15           2HB      ALA  15  -4.664  -6.960  -9.109
  113    H    LEU  16           H        LEU  16  -2.985  -4.736  -9.519
  114    HA   LEU  16           HA       LEU  16  -2.111  -3.972  -6.937
  115    HB2  LEU  16           2HB      LEU  16  -0.782  -3.538  -9.646
  116    HB3  LEU  16           3HB      LEU  16   0.020  -3.340  -8.094
  117    HG   LEU  16           HG       LEU  16  -1.079  -5.961  -9.184
  118   HD11  LEU  16          1HD1      LEU  16   0.908  -5.220 -10.407
  119   HD12  LEU  16          2HD1      LEU  16   1.267  -6.636  -9.424
  120   HD13  LEU  16          3HD1      LEU  16   1.798  -5.037  -8.892
  121   HD21  LEU  16          3HD2      LEU  16   0.466  -5.422  -6.629
  122   HD22  LEU  16          1HD2      LEU  16   0.011  -7.008  -7.251
  123   HD23  LEU  16          2HD2      LEU  16  -1.238  -5.876  -6.745
  124    H    GLU  17           H        GLU  17  -3.022  -2.148  -9.820
  125    HA   GLU  17           HA       GLU  17  -2.257   0.433  -8.792
  126    HB2  GLU  17           2HB      GLU  17  -3.897  -0.341 -11.242
  127    HB3  GLU  17           3HB      GLU  17  -3.375   1.301 -10.867
  128    HG2  GLU  17           2HG      GLU  17  -1.002   0.567 -10.992
  129    HG3  GLU  17           3HG      GLU  17  -1.547  -1.058 -11.407
  130    H    LYS  18           H        LYS  18  -5.237  -1.448  -8.735
  131    HA   LYS  18           HA       LYS  18  -6.970   0.674  -7.855
  132    HB2  LYS  18           2HB      LYS  18  -7.176  -2.352  -7.808
  133    HB3  LYS  18           3HB      LYS  18  -8.306  -1.405  -6.855
  134    HG2  LYS  18           2HG      LYS  18  -9.376  -1.978  -8.922
  135    HG3  LYS  18           3HG      LYS  18  -9.040  -0.245  -8.956
  136    HD2  LYS  18           2HD      LYS  18  -7.085  -0.638 -10.395
  137    HD3  LYS  18           3HD      LYS  18  -7.356  -2.381 -10.306
  138    HE2  LYS  18           2HE      LYS  18  -9.251  -0.366 -11.558
  139    HE3  LYS  18           3HE      LYS  18  -8.150  -1.425 -12.438
  140    HZ1  LYS  18           3HZ      LYS  18 -10.395  -2.319 -10.715
  141    HZ2  LYS  18           1HZ      LYS  18  -9.338  -3.334 -11.553
  142    HZ3  LYS  18           2HZ      LYS  18 -10.383  -2.316 -12.403
  143    H    ALA  19           H        ALA  19  -5.126  -1.905  -6.185
  144    HA   ALA  19           HA       ALA  19  -5.616  -1.153  -3.510
  145    HB1  ALA  19           3HB      ALA  19  -3.604  -2.481  -2.973
  146    HB2  ALA  19           1HB      ALA  19  -3.151  -2.496  -4.684
  147    HB3  ALA  19           2HB      ALA  19  -4.618  -3.317  -4.150
  148    H    LEU  20           H        LEU  20  -3.025  -0.256  -5.739
  149    HA   LEU  20           HA       LEU  20  -1.428   1.394  -4.180
  150    HB2  LEU  20           2HB      LEU  20  -0.763   0.612  -6.399
  151    HB3  LEU  20           3HB      LEU  20  -2.057   1.523  -7.150
  152    HG   LEU  20           HG       LEU  20  -0.930   3.647  -6.519
  153   HD11  LEU  20          1HD1      LEU  20   1.332   1.923  -5.466
  154   HD12  LEU  20          2HD1      LEU  20   0.264   2.952  -4.508
  155   HD13  LEU  20          3HD1      LEU  20   1.364   3.676  -5.674
  156   HD21  LEU  20          3HD2      LEU  20   0.892   3.516  -8.151
  157   HD22  LEU  20          1HD2      LEU  20  -0.538   2.660  -8.727
  158   HD23  LEU  20          2HD2      LEU  20   0.841   1.752  -8.100
  159    H    LYS  21           H        LYS  21  -4.250   2.241  -6.178
  160    HA   LYS  21           HA       LYS  21  -4.230   5.028  -5.871
  161    HB2  LYS  21           2HB      LYS  21  -5.632   3.761  -7.519
  162    HB3  LYS  21           3HB      LYS  21  -6.638   3.184  -6.196
  163    HG2  LYS  21           2HG      LYS  21  -7.104   5.689  -5.698
  164    HG3  LYS  21           3HG      LYS  21  -6.407   6.001  -7.288
  165    HD2  LYS  21           2HD      LYS  21  -8.853   5.878  -7.453
  166    HD3  LYS  21           3HD      LYS  21  -8.135   4.516  -8.318
  167    HE2  LYS  21           2HE      LYS  21  -8.629   3.021  -6.455
  168    HE3  LYS  21           3HE      LYS  21  -9.223   4.369  -5.481
  169    HZ1  LYS  21           3HZ      LYS  21 -11.037   3.109  -6.459
  170    HZ2  LYS  21           1HZ      LYS  21 -10.444   3.397  -8.015
  171    HZ3  LYS  21           2HZ      LYS  21 -11.017   4.680  -7.076
  172    H    GLU  22           H        GLU  22  -5.581   2.462  -3.843
  173    HA   GLU  22           HA       GLU  22  -6.832   4.202  -1.933
  174    HB2  GLU  22           2HB      GLU  22  -6.128   1.248  -1.755
  175    HB3  GLU  22           3HB      GLU  22  -7.058   2.121  -0.543
  176    HG2  GLU  22           2HG      GLU  22  -7.861   1.645  -3.423
  177    HG3  GLU  22           3HG      GLU  22  -8.534   0.853  -2.000
  178    H    MET  23           H        MET  23  -3.669   2.472  -2.012
  179    HA   MET  23           HA       MET  23  -2.751   3.218   0.533
  180    HB2  MET  23           2HB      MET  23  -1.175   2.767  -2.034
  181    HB3  MET  23           3HB      MET  23  -0.453   2.867  -0.434
  182    HG2  MET  23           2HG      MET  23  -2.566   0.799  -0.960
  183    HG3  MET  23           3HG      MET  23  -0.930   0.539  -1.542
  184    HE1  MET  23           3HE      MET  23  -2.269   0.460   2.869
  185    HE2  MET  23           1HE      MET  23  -3.331   0.306   1.470
  186    HE3  MET  23           2HE      MET  23  -2.616   1.869   1.867
  187    H    ILE  24           H        ILE  24  -2.645   4.937  -2.558
  188    HA   ILE  24           HA       ILE  24  -1.173   7.227  -1.715
  189    HB   ILE  24           HB       ILE  24  -3.143   6.899  -4.042
  190   HG12  ILE  24          2HG1      ILE  24  -0.082   6.797  -4.068
  191   HG13  ILE  24          3HG1      ILE  24  -1.132   5.391  -4.154
  192   HG21  ILE  24          1HG2      ILE  24  -2.894   9.279  -3.473
  193   HG22  ILE  24          2HG2      ILE  24  -2.121   8.932  -5.019
  194   HG23  ILE  24          3HG2      ILE  24  -1.137   9.137  -3.569
  195   HD11  ILE  24          3HD1      ILE  24  -0.269   5.964  -6.332
  196   HD12  ILE  24          1HD1      ILE  24  -0.950   7.587  -6.207
  197   HD13  ILE  24          2HD1      ILE  24  -2.018   6.183  -6.289
  198    H    ARG  25           H        ARG  25  -4.646   6.452  -1.982
  199    HA   ARG  25           HA       ARG  25  -5.900   8.807  -1.243
  200    HB2  ARG  25           2HB      ARG  25  -7.140   6.804  -1.976
  201    HB3  ARG  25           3HB      ARG  25  -6.648   5.926  -0.525
  202    HG2  ARG  25           2HG      ARG  25  -7.987   7.534   0.847
  203    HG3  ARG  25           3HG      ARG  25  -8.543   8.304  -0.640
  204    HD2  ARG  25           2HD      ARG  25  -9.593   6.194  -1.360
  205    HD3  ARG  25           3HD      ARG  25  -8.997   5.389   0.098
  206    HE   ARG  25           HE       ARG  25 -10.513   7.621   0.863
  207   HH11  ARG  25          1HH1      ARG  25 -11.064   4.479  -0.646
  208   HH12  ARG  25          2HH1      ARG  25 -12.693   4.354  -0.050
  209   HH21  ARG  25          1HH2      ARG  25 -12.610   7.429   1.654
  210   HH22  ARG  25          2HH2      ARG  25 -13.571   6.039   1.262
  211    H    GLN  26           H        GLN  26  -4.572   6.249   0.873
  212    HA   GLN  26           HA       GLN  26  -5.402   7.490   3.319
  213    HB2  GLN  26           2HB      GLN  26  -3.183   5.430   3.157
  214    HB3  GLN  26           3HB      GLN  26  -4.287   5.747   4.486
  215    HG2  GLN  26           2HG      GLN  26  -4.896   4.351   1.882
  216    HG3  GLN  26           3HG      GLN  26  -4.867   3.652   3.485
  217   HE21  GLN  26          1HE2      GLN  26  -6.950   2.812   3.004
  218   HE22  GLN  26          2HE2      GLN  26  -8.367   3.777   3.140
  219    H    ALA  27           H        ALA  27  -2.347   7.330   1.515
  220    HA   ALA  27           HA       ALA  27  -0.737   8.792   3.331
  221    HB1  ALA  27           3HB      ALA  27   0.837   9.012   1.455
  222    HB2  ALA  27           1HB      ALA  27  -0.423   8.479   0.329
  223    HB3  ALA  27           2HB      ALA  27   0.193   7.374   1.556
  224    H    ARG  28           H        ARG  28  -3.172   9.866   1.083
  225    HA   ARG  28           HA       ARG  28  -2.253  12.645   1.034
  226    HB2  ARG  28           2HB      ARG  28  -4.728  11.319  -0.151
  227    HB3  ARG  28           3HB      ARG  28  -4.358  13.034  -0.307
  228    HG2  ARG  28           2HG      ARG  28  -2.217  12.403  -1.479
  229    HG3  ARG  28           3HG      ARG  28  -2.751  10.725  -1.432
  230    HD2  ARG  28           2HD      ARG  28  -3.254  11.728  -3.608
  231    HD3  ARG  28           3HD      ARG  28  -4.747  11.313  -2.762
  232    HE   ARG  28           HE       ARG  28  -4.479  13.880  -2.064
  233   HH11  ARG  28          1HH1      ARG  28  -4.189  12.394  -5.250
  234   HH12  ARG  28          2HH1      ARG  28  -4.720  13.818  -6.090
  235   HH21  ARG  28          1HH2      ARG  28  -5.163  15.739  -3.188
  236   HH22  ARG  28          2HH2      ARG  28  -5.268  15.709  -4.919
  237    H    LYS  29           H        LYS  29  -5.017  10.796   2.383
  238    HA   LYS  29           HA       LYS  29  -6.297  13.065   3.578
  239    HB2  LYS  29           2HB      LYS  29  -7.805  11.460   4.634
  240    HB3  LYS  29           3HB      LYS  29  -7.539  11.011   2.952
  241    HG2  LYS  29           2HG      LYS  29  -5.899   9.304   3.682
  242    HG3  LYS  29           3HG      LYS  29  -6.225   9.717   5.363
  243    HD2  LYS  29           2HD      LYS  29  -8.275   8.631   3.396
  244    HD3  LYS  29           3HD      LYS  29  -7.428   7.674   4.610
  245    HE2  LYS  29           2HE      LYS  29  -8.472   9.009   6.399
  246    HE3  LYS  29           3HE      LYS  29  -9.321   9.973   5.182
  247    HZ1  LYS  29           3HZ      LYS  29 -10.709   8.194   6.113
  248    HZ2  LYS  29           1HZ      LYS  29  -9.626   7.037   5.534
  249    HZ3  LYS  29           2HZ      LYS  29 -10.484   8.004   4.450
  250    H    PHE  30           H        PHE  30  -3.865  10.798   4.678
  251    HA   PHE  30           HA       PHE  30  -3.855  11.818   7.426
  252    HB2  PHE  30           2HB      PHE  30  -2.017   9.784   6.081
  253    HB3  PHE  30           3HB      PHE  30  -1.998  10.195   7.793
  254    HD1  PHE  30           HD1      PHE  30  -4.947  10.222   8.406
  255    HD2  PHE  30           HD2      PHE  30  -2.617   7.490   6.079
  256    HE1  PHE  30           HE1      PHE  30  -6.571   8.428   8.866
  257    HE2  PHE  30           HE2      PHE  30  -4.257   5.708   6.546
  258    HZ   PHE  30           HZ       PHE  30  -6.223   6.174   7.933
  259    H    ALA  31           H        ALA  31  -2.307  12.334   4.385
  260    HA   ALA  31           HA       ALA  31  -1.058  13.997   3.572
  261    HB1  ALA  31           3HB      ALA  31  -2.464  15.491   4.910
  262    HB2  ALA  31           1HB      ALA  31  -0.813  16.101   4.788
  263    HB3  ALA  31           2HB      ALA  31  -1.360  15.326   6.275
  264    H    GLY  32           H        GLY  32   0.521  12.295   3.517
  265    HA2  GLY  32           2HA      GLY  32   3.035  13.117   4.840
  266    HA3  GLY  32           3HA      GLY  32   2.565  11.417   4.743
  267    H    THR  33           H        THR  33   4.457  10.978   3.493
  268    HA   THR  33           HA       THR  33   4.566  12.011   0.736
  269    HB   THR  33           HB       THR  33   6.723  10.501   2.322
  270    HG1  THR  33           HG1      THR  33   5.954  13.070   2.504
  271   HG21  THR  33          3HG2      THR  33   8.266  11.283   0.560
  272   HG22  THR  33          1HG2      THR  33   6.931  12.069  -0.285
  273   HG23  THR  33          2HG2      THR  33   6.977  10.309  -0.149
  274    H    VAL  34           H        VAL  34   4.175  10.553  -0.925
  275    HA   VAL  34           HA       VAL  34   4.082   7.660  -0.380
  276    HB   VAL  34           HB       VAL  34   1.759   8.451  -0.497
  277   HG11  VAL  34          1HG1      VAL  34   0.760   9.478  -2.496
  278   HG12  VAL  34          2HG1      VAL  34   2.356   9.582  -3.245
  279   HG13  VAL  34          3HG1      VAL  34   2.007  10.508  -1.784
  280   HG21  VAL  34          3HG2      VAL  34   2.204   6.223  -1.394
  281   HG22  VAL  34          1HG2      VAL  34   2.513   6.900  -2.997
  282   HG23  VAL  34          2HG2      VAL  34   0.895   6.992  -2.293
  283    H    THR  35           H        THR  35   5.352   6.562  -1.740
  284    HA   THR  35           HA       THR  35   6.028   7.552  -4.432
  285    HB   THR  35           HB       THR  35   8.170   6.700  -2.398
  286    HG1  THR  35           HG1      THR  35   7.063   9.167  -2.960
  287   HG21  THR  35          3HG2      THR  35   9.788   7.504  -4.080
  288   HG22  THR  35          1HG2      THR  35   8.467   7.882  -5.190
  289   HG23  THR  35          2HG2      THR  35   8.798   6.206  -4.745
  290    H    TYR  36           H        TYR  36   6.370   5.788  -5.867
  291    HA   TYR  36           HA       TYR  36   6.372   3.067  -4.786
  292    HB2  TYR  36           2HB      TYR  36   4.395   2.375  -6.040
  293    HB3  TYR  36           3HB      TYR  36   3.983   3.676  -4.939
  294    HD1  TYR  36           HD2      TYR  36   3.313   5.903  -5.820
  295    HD2  TYR  36           HD1      TYR  36   4.272   2.701  -8.491
  296    HE1  TYR  36           HE2      TYR  36   2.246   7.114  -7.673
  297    HE2  TYR  36           HE1      TYR  36   3.196   3.916 -10.334
  298    HH   TYR  36           HH       TYR  36   1.461   5.673 -10.607
  299    H    THR  37           H        THR  37   6.872   1.435  -6.273
  300    HA   THR  37           HA       THR  37   7.894   2.236  -8.935
  301    HB   THR  37           HB       THR  37   9.053   0.070  -7.115
  302    HG1  THR  37           HG1      THR  37  10.146   2.626  -7.810
  303   HG21  THR  37          3HG2      THR  37  10.084   1.152  -9.776
  304   HG22  THR  37          1HG2      THR  37   9.347  -0.436  -9.530
  305   HG23  THR  37          2HG2      THR  37  10.889  -0.051  -8.769
  306    H    LEU  38           H        LEU  38   6.424   1.446 -10.356
  307    HA   LEU  38           HA       LEU  38   5.243  -1.231 -10.077
  308    HB2  LEU  38           2HB      LEU  38   4.976   0.966 -12.174
  309    HB3  LEU  38           3HB      LEU  38   4.241  -0.618 -12.374
  310    HG   LEU  38           HG       LEU  38   3.603   1.278 -10.079
  311   HD11  LEU  38          1HD1      LEU  38   1.484   1.746 -11.216
  312   HD12  LEU  38          2HD1      LEU  38   1.985   0.770 -12.599
  313   HD13  LEU  38          3HD1      LEU  38   2.855   2.254 -12.201
  314   HD21  LEU  38          3HD2      LEU  38   2.250  -1.298 -10.950
  315   HD22  LEU  38          1HD2      LEU  38   1.694  -0.220  -9.666
  316   HD23  LEU  38          2HD2      LEU  38   3.233  -1.065  -9.497
  317    H    ASP  39           H        ASP  39   6.516  -2.894 -10.589
  318    HA   ASP  39           HA       ASP  39   8.297  -2.854 -12.931
  319    HB2  ASP  39           2HB      ASP  39   9.690  -2.113 -11.002
  320    HB3  ASP  39           3HB      ASP  39   9.219  -3.542 -10.095
  321    H    GLY  40           H        GLY  40   7.133  -4.392 -13.984
  322    HA2  GLY  40           2HA      GLY  40   6.386  -6.459 -14.619
  323    HA3  GLY  40           3HA      GLY  40   7.229  -7.147 -13.238
  324    H    ASN  41           H        ASN  41   5.807  -8.301 -12.074
  325    HA   ASN  41           HA       ASN  41   3.049  -7.349 -11.634
  326    HB2  ASN  41           2HB      ASN  41   4.389 -10.016 -10.989
  327    HB3  ASN  41           3HB      ASN  41   2.712  -9.622 -10.604
  328   HD21  ASN  41          1HD2      ASN  41   1.210  -9.372 -12.346
  329   HD22  ASN  41          2HD2      ASN  41   1.536 -10.047 -13.901
  330    H    ASP  42           H        ASP  42   5.816  -6.542 -10.340
  331    HA   ASP  42           HA       ASP  42   5.120  -6.798  -7.484
  332    HB2  ASP  42           2HB      ASP  42   7.744  -6.020  -8.850
  333    HB3  ASP  42           3HB      ASP  42   7.507  -6.111  -7.110
  334    H    LEU  43           H        LEU  43   4.493  -5.036  -6.401
  335    HA   LEU  43           HA       LEU  43   4.965  -2.298  -7.441
  336    HB2  LEU  43           2HB      LEU  43   2.590  -2.725  -7.604
  337    HB3  LEU  43           3HB      LEU  43   2.552  -3.516  -6.037
  338    HG   LEU  43           HG       LEU  43   2.942  -1.326  -4.919
  339   HD11  LEU  43          1HD1      LEU  43   2.747   0.789  -6.116
  340   HD12  LEU  43          2HD1      LEU  43   2.691  -0.064  -7.657
  341   HD13  LEU  43          3HD1      LEU  43   4.151  -0.124  -6.667
  342   HD21  LEU  43          3HD2      LEU  43   0.700  -0.413  -5.275
  343   HD22  LEU  43          1HD2      LEU  43   0.671  -2.175  -5.202
  344   HD23  LEU  43          2HD2      LEU  43   0.537  -1.354  -6.760
  345    H    GLU  44           H        GLU  44   6.721  -1.668  -6.191
  346    HA   GLU  44           HA       GLU  44   6.760  -2.040  -3.291
  347    HB2  GLU  44           2HB      GLU  44   8.887  -2.077  -4.594
  348    HB3  GLU  44           3HB      GLU  44   8.592  -0.431  -5.141
  349    HG2  GLU  44           2HG      GLU  44   8.778   0.392  -2.834
  350    HG3  GLU  44           3HG      GLU  44   9.030  -1.253  -2.247
  351    H    ILE  45           H        ILE  45   6.324  -0.443  -1.852
  352    HA   ILE  45           HA       ILE  45   5.701   2.334  -2.696
  353    HB   ILE  45           HB       ILE  45   3.906   0.761  -0.750
  354   HG12  ILE  45          2HG1      ILE  45   3.190   1.662  -3.588
  355   HG13  ILE  45          3HG1      ILE  45   3.587   0.011  -3.131
  356   HG21  ILE  45          1HG2      ILE  45   2.437   2.754  -0.790
  357   HG22  ILE  45          2HG2      ILE  45   3.580   3.588  -1.844
  358   HG23  ILE  45          3HG2      ILE  45   4.052   3.155  -0.200
  359   HD11  ILE  45          3HD1      ILE  45   1.630  -0.066  -1.681
  360   HD12  ILE  45          1HD1      ILE  45   1.211   0.298  -3.354
  361   HD13  ILE  45          2HD1      ILE  45   1.217   1.586  -2.150
  362    H    ARG  46           H        ARG  46   6.582   3.795  -1.258
  363    HA   ARG  46           HA       ARG  46   7.129   2.959   1.522
  364    HB2  ARG  46           2HB      ARG  46   8.861   4.859  -0.128
  365    HB3  ARG  46           3HB      ARG  46   9.086   4.469   1.564
  366    HG2  ARG  46           2HG      ARG  46  10.644   3.013   0.770
  367    HG3  ARG  46           3HG      ARG  46   9.252   1.959   0.504
  368    HD2  ARG  46           2HD      ARG  46  10.724   2.057  -1.471
  369    HD3  ARG  46           3HD      ARG  46   9.125   2.712  -1.840
  370    HE   ARG  46           HE       ARG  46  10.238   4.975  -1.387
  371   HH11  ARG  46          1HH1      ARG  46  12.020   2.289  -2.837
  372   HH12  ARG  46          2HH1      ARG  46  13.134   3.341  -3.657
  373   HH21  ARG  46          1HH2      ARG  46  11.716   6.301  -2.456
  374   HH22  ARG  46          2HH2      ARG  46  12.959   5.601  -3.442
  375    H    ILE  47           H        ILE  47   5.902   4.077   2.833
  376    HA   ILE  47           HA       ILE  47   4.999   6.825   2.206
  377    HB   ILE  47           HB       ILE  47   3.730   4.803   4.121
  378   HG12  ILE  47          2HG1      ILE  47   2.756   5.768   1.386
  379   HG13  ILE  47          3HG1      ILE  47   3.412   4.173   1.728
  380   HG21  ILE  47          1HG2      ILE  47   2.728   7.563   3.310
  381   HG22  ILE  47          2HG2      ILE  47   3.384   7.126   4.889
  382   HG23  ILE  47          3HG2      ILE  47   1.867   6.414   4.340
  383   HD11  ILE  47          3HD1      ILE  47   0.829   5.308   2.795
  384   HD12  ILE  47          1HD1      ILE  47   1.499   3.728   3.212
  385   HD13  ILE  47          2HD1      ILE  47   1.021   4.072   1.551
  386    H    THR  48           H        THR  48   5.844   8.417   3.417
  387    HA   THR  48           HA       THR  48   7.139   7.849   6.032
  388    HB   THR  48           HB       THR  48   8.231   9.723   3.857
  389    HG1  THR  48           HG1      THR  48   8.646   7.006   4.327
  390   HG21  THR  48          3HG2      THR  48   9.527   8.753   6.439
  391   HG22  THR  48          1HG2      THR  48   8.940  10.391   6.133
  392   HG23  THR  48          2HG2      THR  48  10.304   9.754   5.213
  393    H    GLY  49           H        GLY  49   7.295   9.867   7.397
  394    HA2  GLY  49           2HA      GLY  49   6.726  11.989   8.107
  395    HA3  GLY  49           3HA      GLY  49   5.999  12.311   6.543
  396    H    VAL  50           H        VAL  50   4.899   9.467   8.042
  397    HA   VAL  50           HA       VAL  50   2.422  10.759   9.022
  398    HB   VAL  50           HB       VAL  50   1.291   8.546   8.627
  399   HG11  VAL  50          1HG1      VAL  50   1.104   8.748   6.166
  400   HG12  VAL  50          2HG1      VAL  50   2.545   9.769   6.135
  401   HG13  VAL  50          3HG1      VAL  50   1.085  10.329   6.952
  402   HG21  VAL  50          3HG2      VAL  50   3.886   7.749   7.244
  403   HG22  VAL  50          1HG2      VAL  50   2.382   6.819   7.225
  404   HG23  VAL  50          2HG2      VAL  50   3.251   7.062   8.740
  405    HA   PRO  51           HA       PRO  51   3.474   9.523  13.199
  406    HB2  PRO  51           2HB      PRO  51   0.571   8.710  13.452
  407    HB3  PRO  51           3HB      PRO  51   1.543   9.774  14.497
  408    HG2  PRO  51           2HG      PRO  51  -0.236  10.790  12.816
  409    HG3  PRO  51           3HG      PRO  51   1.328  11.599  13.069
  410    HD2  PRO  51           2HD      PRO  51   0.420   9.917  10.746
  411    HD3  PRO  51           3HD      PRO  51   1.449  11.366  10.753
  412    H    GLU  52           H        GLU  52   3.825   7.768  14.462
  413    HA   GLU  52           HA       GLU  52   4.302   5.299  13.265
  414    HB2  GLU  52           2HB      GLU  52   5.583   6.203  15.135
  415    HB3  GLU  52           3HB      GLU  52   4.188   6.076  16.201
  416    HG2  GLU  52           2HG      GLU  52   4.271   3.666  16.108
  417    HG3  GLU  52           3HG      GLU  52   5.531   3.707  14.873
  418    H    GLN  53           H        GLN  53   1.549   6.421  15.200
  419    HA   GLN  53           HA       GLN  53   0.259   3.890  15.535
  420    HB2  GLN  53           2HB      GLN  53  -1.808   5.204  16.010
  421    HB3  GLN  53           3HB      GLN  53  -0.426   5.773  16.932
  422    HG2  GLN  53           2HG      GLN  53  -0.221   7.748  15.619
  423    HG3  GLN  53           3HG      GLN  53  -1.291   7.121  14.367
  424   HE21  GLN  53          1HE2      GLN  53  -3.527   7.215  14.682
  425   HE22  GLN  53          2HE2      GLN  53  -4.258   8.162  15.931
  426    H    VAL  54           H        VAL  54   0.209   6.328  13.010
  427    HA   VAL  54           HA       VAL  54  -1.989   5.301  11.507
  428    HB   VAL  54           HB       VAL  54   0.206   7.315  10.855
  429   HG11  VAL  54          1HG1      VAL  54  -2.236   6.687   9.159
  430   HG12  VAL  54          2HG1      VAL  54  -0.552   6.380   8.724
  431   HG13  VAL  54          3HG1      VAL  54  -1.126   8.037   8.908
  432   HG21  VAL  54          3HG2      VAL  54  -1.575   8.991  11.180
  433   HG22  VAL  54          1HG2      VAL  54  -1.351   8.005  12.623
  434   HG23  VAL  54          2HG2      VAL  54  -2.727   7.707  11.557
  435    H    ARG  55           H        ARG  55   1.537   4.895  11.341
  436    HA   ARG  55           HA       ARG  55   1.755   3.448   8.945
  437    HB2  ARG  55           2HB      ARG  55   3.443   3.297  11.477
  438    HB3  ARG  55           3HB      ARG  55   3.869   2.485   9.970
  439    HG2  ARG  55           2HG      ARG  55   3.851   4.731   8.840
  440    HG3  ARG  55           3HG      ARG  55   3.633   5.469  10.428
  441    HD2  ARG  55           2HD      ARG  55   5.952   3.655   9.709
  442    HD3  ARG  55           3HD      ARG  55   6.003   5.413   9.588
  443    HE   ARG  55           HE       ARG  55   5.362   5.207  12.116
  444   HH11  ARG  55          1HH1      ARG  55   7.692   3.203  10.392
  445   HH12  ARG  55          2HH1      ARG  55   8.679   2.941  11.794
  446   HH21  ARG  55          1HH2      ARG  55   6.776   5.000  13.891
  447   HH22  ARG  55          2HH2      ARG  55   8.153   3.964  13.771
  448    H    LYS  56           H        LYS  56   1.243   2.287  12.265
  449    HA   LYS  56           HA       LYS  56   1.033  -0.447  11.835
  450    HB2  LYS  56           2HB      LYS  56  -0.557   1.259  13.801
  451    HB3  LYS  56           3HB      LYS  56  -0.316  -0.482  13.929
  452    HG2  LYS  56           2HG      LYS  56   2.028  -0.207  14.382
  453    HG3  LYS  56           3HG      LYS  56   1.968   1.510  13.975
  454    HD2  LYS  56           2HD      LYS  56   0.451   1.890  15.927
  455    HD3  LYS  56           3HD      LYS  56   0.607   0.184  16.360
  456    HE2  LYS  56           2HE      LYS  56   2.851   2.226  16.267
  457    HE3  LYS  56           3HE      LYS  56   2.096   1.572  17.721
  458    HZ1  LYS  56           3HZ      LYS  56   3.686   0.058  15.732
  459    HZ2  LYS  56           1HZ      LYS  56   2.892  -0.635  17.055
  460    HZ3  LYS  56           2HZ      LYS  56   4.151   0.456  17.299
  461    H    GLU  57           H        GLU  57  -1.361   2.101  11.316
  462    HA   GLU  57           HA       GLU  57  -3.612   0.361  10.885
  463    HB2  GLU  57           2HB      GLU  57  -3.228   3.320  10.263
  464    HB3  GLU  57           3HB      GLU  57  -4.764   2.465  10.150
  465    HG2  GLU  57           2HG      GLU  57  -3.130   2.844  12.667
  466    HG3  GLU  57           3HG      GLU  57  -4.587   3.733  12.245
  467    H    LEU  58           H        LEU  58  -1.232   1.952   8.814
  468    HA   LEU  58           HA       LEU  58  -2.423   1.336   6.310
  469    HB2  LEU  58           2HB      LEU  58   0.303   2.236   7.188
  470    HB3  LEU  58           3HB      LEU  58   0.198   1.485   5.609
  471    HG   LEU  58           HG       LEU  58   0.118   3.905   5.371
  472   HD11  LEU  58          1HD1      LEU  58  -1.166   2.603   3.745
  473   HD12  LEU  58          2HD1      LEU  58  -1.901   4.178   4.027
  474   HD13  LEU  58          3HD1      LEU  58  -2.613   2.735   4.754
  475   HD21  LEU  58          3HD2      LEU  58  -1.698   5.299   6.258
  476   HD22  LEU  58          1HD2      LEU  58  -0.771   4.548   7.555
  477   HD23  LEU  58          2HD2      LEU  58  -2.359   3.910   7.125
  478    H    ALA  59           H        ALA  59  -0.656  -0.635   8.575
  479    HA   ALA  59           HA       ALA  59  -0.033  -2.843   6.924
  480    HB1  ALA  59           3HB      ALA  59   0.854  -2.571   9.206
  481    HB2  ALA  59           1HB      ALA  59   0.045  -4.128   9.031
  482    HB3  ALA  59           2HB      ALA  59  -0.759  -2.805   9.878
  483    H    LYS  60           H        LYS  60  -2.925  -2.066   8.839
  484    HA   LYS  60           HA       LYS  60  -4.437  -4.405   8.198
  485    HB2  LYS  60           2HB      LYS  60  -5.335  -1.665   9.187
  486    HB3  LYS  60           3HB      LYS  60  -6.451  -2.997   8.943
  487    HG2  LYS  60           2HG      LYS  60  -6.014  -2.847  11.282
  488    HG3  LYS  60           3HG      LYS  60  -5.175  -4.290  10.708
  489    HD2  LYS  60           2HD      LYS  60  -3.044  -3.134  10.764
  490    HD3  LYS  60           3HD      LYS  60  -3.834  -1.595  11.110
  491    HE2  LYS  60           2HE      LYS  60  -3.855  -3.996  12.967
  492    HE3  LYS  60           3HE      LYS  60  -2.756  -2.625  13.104
  493    HZ1  LYS  60           3HZ      LYS  60  -4.647  -2.435  14.595
  494    HZ2  LYS  60           1HZ      LYS  60  -5.720  -2.460  13.286
  495    HZ3  LYS  60           2HZ      LYS  60  -4.636  -1.175  13.469
  496    H    GLU  61           H        GLU  61  -4.035  -1.207   6.747
  497    HA   GLU  61           HA       GLU  61  -6.121  -1.348   4.820
  498    HB2  GLU  61           2HB      GLU  61  -3.570   0.323   4.872
  499    HB3  GLU  61           3HB      GLU  61  -4.865   0.532   3.700
  500    HG2  GLU  61           2HG      GLU  61  -5.031   0.974   6.684
  501    HG3  GLU  61           3HG      GLU  61  -5.063   2.210   5.427
  502    H    ALA  62           H        ALA  62  -2.643  -2.045   4.701
  503    HA   ALA  62           HA       ALA  62  -2.337  -2.745   2.039
  504    HB1  ALA  62           3HB      ALA  62  -0.501  -2.419   3.679
  505    HB2  ALA  62           1HB      ALA  62  -0.318  -3.916   2.777
  506    HB3  ALA  62           2HB      ALA  62  -0.910  -3.959   4.439
  507    H    GLU  63           H        GLU  63  -3.258  -4.825   4.791
  508    HA   GLU  63           HA       GLU  63  -3.374  -7.242   3.244
  509    HB2  GLU  63           2HB      GLU  63  -4.370  -6.665   6.055
  510    HB3  GLU  63           3HB      GLU  63  -4.233  -8.269   5.335
  511    HG2  GLU  63           2HG      GLU  63  -1.787  -7.931   5.083
  512    HG3  GLU  63           3HG      GLU  63  -1.940  -6.354   5.853
  513    H    ARG  64           H        ARG  64  -5.876  -4.886   4.229
  514    HA   ARG  64           HA       ARG  64  -8.083  -6.584   3.495
  515    HB2  ARG  64           2HB      ARG  64  -9.513  -4.555   3.573
  516    HB3  ARG  64           3HB      ARG  64  -8.527  -4.726   5.021
  517    HG2  ARG  64           2HG      ARG  64  -7.006  -3.014   4.261
  518    HG3  ARG  64           3HG      ARG  64  -7.829  -2.904   2.708
  519    HD2  ARG  64           2HD      ARG  64  -9.199  -2.282   5.340
  520    HD3  ARG  64           3HD      ARG  64  -8.340  -1.067   4.393
  521    HE   ARG  64           HE       ARG  64 -10.774  -2.515   3.552
  522   HH11  ARG  64          1HH1      ARG  64  -8.596   0.245   3.190
  523   HH12  ARG  64          2HH1      ARG  64  -9.644   1.067   2.074
  524   HH21  ARG  64          1HH2      ARG  64 -12.121  -1.421   2.109
  525   HH22  ARG  64          2HH2      ARG  64 -11.647   0.117   1.464
  526    H    LEU  65           H        LEU  65  -6.073  -4.233   1.764
  527    HA   LEU  65           HA       LEU  65  -7.594  -4.284  -0.686
  528    HB2  LEU  65           2HB      LEU  65  -4.690  -3.501  -0.214
  529    HB3  LEU  65           3HB      LEU  65  -5.614  -3.158  -1.671
  530    HG   LEU  65           HG       LEU  65  -6.220  -2.038   1.088
  531   HD11  LEU  65          1HD1      LEU  65  -4.979  -0.659  -1.306
  532   HD12  LEU  65          2HD1      LEU  65  -4.158  -1.111   0.190
  533   HD13  LEU  65          3HD1      LEU  65  -5.428   0.108   0.221
  534   HD21  LEU  65          3HD2      LEU  65  -7.849  -0.576  -0.047
  535   HD22  LEU  65          1HD2      LEU  65  -8.274  -2.281  -0.193
  536   HD23  LEU  65          2HD2      LEU  65  -7.563  -1.431  -1.565
  537    H    ALA  66           H        ALA  66  -4.892  -6.133   0.628
  538    HA   ALA  66           HA       ALA  66  -4.144  -7.640  -1.604
  539    HB1  ALA  66           3HB      ALA  66  -4.191  -8.552   1.288
  540    HB2  ALA  66           1HB      ALA  66  -2.896  -7.632   0.523
  541    HB3  ALA  66           2HB      ALA  66  -3.246  -9.274  -0.019
  542    H    LYS  67           H        LYS  67  -6.597  -8.427   0.890
  543    HA   LYS  67           HA       LYS  67  -7.333 -10.923  -0.346
  544    HB2  LYS  67           2HB      LYS  67  -9.044 -11.091   1.415
  545    HB3  LYS  67           3HB      LYS  67  -7.487 -10.638   2.097
  546    HG2  LYS  67           2HG      LYS  67  -8.219  -8.298   2.272
  547    HG3  LYS  67           3HG      LYS  67  -9.777  -8.718   1.563
  548    HD2  LYS  67           2HD      LYS  67  -8.711  -9.816   4.197
  549    HD3  LYS  67           3HD      LYS  67  -9.861  -8.491   4.047
  550    HE2  LYS  67           2HE      LYS  67 -11.480 -10.020   2.971
  551    HE3  LYS  67           3HE      LYS  67 -10.330 -11.350   3.138
  552    HZ1  LYS  67           3HZ      LYS  67 -11.996 -11.355   4.904
  553    HZ2  LYS  67           1HZ      LYS  67 -11.518  -9.808   5.387
  554    HZ3  LYS  67           2HZ      LYS  67 -10.451 -11.111   5.541
  555    H    GLU  68           H        GLU  68  -8.441  -7.627  -0.584
  556    HA   GLU  68           HA       GLU  68 -11.054  -8.087  -1.638
  557    HB2  GLU  68           2HB      GLU  68 -10.307  -5.930  -0.613
  558    HB3  GLU  68           3HB      GLU  68  -9.200  -5.674  -1.954
  559    HG2  GLU  68           2HG      GLU  68 -11.153  -4.285  -2.243
  560    HG3  GLU  68           3HG      GLU  68 -11.136  -5.523  -3.496
  561    H    PHE  69           H        PHE  69  -7.950  -7.176  -3.187
  562    HA   PHE  69           HA       PHE  69  -9.145  -7.398  -5.856
  563    HB2  PHE  69           2HB      PHE  69  -6.416  -6.334  -4.997
  564    HB3  PHE  69           3HB      PHE  69  -7.092  -6.227  -6.618
  565    HD1  PHE  69           HD1      PHE  69  -9.639  -5.156  -6.575
  566    HD2  PHE  69           HD2      PHE  69  -6.517  -4.330  -3.774
  567    HE1  PHE  69           HE1      PHE  69 -10.719  -3.023  -5.990
  568    HE2  PHE  69           HE2      PHE  69  -7.605  -2.198  -3.200
  569    HZ   PHE  69           HZ       PHE  69  -9.701  -1.546  -4.304
  570    H    ASN  70           H        ASN  70  -7.861  -9.631  -3.914
  571    HA   ASN  70           HA       ASN  70  -6.955 -11.683  -4.131
  572    HB2  ASN  70           2HB      ASN  70  -8.780 -11.842  -5.885
  573    HB3  ASN  70           3HB      ASN  70  -7.591 -11.429  -7.114
  574   HD21  ASN  70          1HD2      ASN  70  -6.014 -13.001  -7.671
  575   HD22  ASN  70          2HD2      ASN  70  -6.219 -14.669  -7.272
  576    H    ILE  71           H        ILE  71  -5.133  -9.919  -3.789
  577    HA   ILE  71           HA       ILE  71  -2.815 -10.740  -5.426
  578    HB   ILE  71           HB       ILE  71  -1.844  -8.423  -5.158
  579   HG12  ILE  71          2HG1      ILE  71  -4.630  -7.726  -4.121
  580   HG13  ILE  71          3HG1      ILE  71  -3.118  -7.606  -3.230
  581   HG21  ILE  71          1HG2      ILE  71  -2.927  -9.049  -7.292
  582   HG22  ILE  71          2HG2      ILE  71  -3.118  -7.330  -6.949
  583   HG23  ILE  71          3HG2      ILE  71  -4.471  -8.434  -6.692
  584   HD11  ILE  71          3HD1      ILE  71  -2.395  -5.806  -4.765
  585   HD12  ILE  71          1HD1      ILE  71  -3.873  -5.421  -3.882
  586   HD13  ILE  71          2HD1      ILE  71  -3.962  -5.902  -5.575
  587    H    THR  72           H        THR  72  -0.788 -10.660  -4.236
  588    HA   THR  72           HA       THR  72  -1.030 -11.246  -1.382
  589    HB   THR  72           HB       THR  72   1.525 -11.700  -1.666
  590    HG1  THR  72           HG1      THR  72   1.454 -10.506  -3.791
  591   HG21  THR  72          3HG2      THR  72  -0.111 -13.558  -1.553
  592   HG22  THR  72          1HG2      THR  72   1.180 -13.911  -2.702
  593   HG23  THR  72          2HG2      THR  72  -0.406 -13.409  -3.288
  594    H    VAL  73           H        VAL  73   0.140 -10.105   0.244
  595    HA   VAL  73           HA       VAL  73   1.512  -7.610  -0.527
  596    HB   VAL  73           HB       VAL  73  -0.888  -7.149   0.238
  597   HG11  VAL  73          1HG1      VAL  73  -1.081  -8.824   2.019
  598   HG12  VAL  73          2HG1      VAL  73  -1.413  -7.208   2.640
  599   HG13  VAL  73          3HG1      VAL  73   0.138  -7.980   2.977
  600   HG21  VAL  73          3HG2      VAL  73   0.865  -5.422   0.235
  601   HG22  VAL  73          1HG2      VAL  73   1.309  -5.855   1.889
  602   HG23  VAL  73          2HG2      VAL  73  -0.288  -5.183   1.544
  603    H    THR  74           H        THR  74   3.120  -6.953   0.855
  604    HA   THR  74           HA       THR  74   3.526  -8.135   3.477
  605    HB   THR  74           HB       THR  74   5.018  -9.511   2.035
  606    HG1  THR  74           HG1      THR  74   7.079  -8.355   3.142
  607   HG21  THR  74          3HG2      THR  74   5.434  -7.893   0.193
  608   HG22  THR  74          1HG2      THR  74   6.942  -8.526   0.858
  609   HG23  THR  74          2HG2      THR  74   6.401  -6.904   1.286
  610    H    TYR  75           H        TYR  75   4.691  -6.665   4.839
  611    HA   TYR  75           HA       TYR  75   5.457  -4.035   3.825
  612    HB2  TYR  75           2HB      TYR  75   3.964  -2.920   5.602
  613    HB3  TYR  75           3HB      TYR  75   3.116  -3.584   4.208
  614    HD1  TYR  75           HD1      TYR  75   3.855  -4.152   7.833
  615    HD2  TYR  75           HD2      TYR  75   1.555  -5.422   4.455
  616    HE1  TYR  75           HE1      TYR  75   2.488  -5.581   9.292
  617    HE2  TYR  75           HE2      TYR  75   0.195  -6.834   5.920
  618    HH   TYR  75           HH       TYR  75   0.247  -7.887   8.023
  619    H    THR  76           H        THR  76   6.589  -2.781   5.445
  620    HA   THR  76           HA       THR  76   7.487  -4.243   7.851
  621    HB   THR  76           HB       THR  76   9.314  -2.640   6.001
  622    HG1  THR  76           HG1      THR  76   8.646  -5.358   6.190
  623   HG21  THR  76          3HG2      THR  76  11.150  -3.581   7.384
  624   HG22  THR  76          1HG2      THR  76   9.966  -4.341   8.448
  625   HG23  THR  76          2HG2      THR  76  10.076  -2.581   8.363
  626    H    ILE  77           H        ILE  77   7.229  -3.118   9.615
  627    HA   ILE  77           HA       ILE  77   7.397  -0.169   9.654
  628    HB   ILE  77           HB       ILE  77   5.703  -0.248  11.614
  629   HG12  ILE  77          2HG1      ILE  77   5.101  -2.989  10.407
  630   HG13  ILE  77          3HG1      ILE  77   5.613  -2.649  12.056
  631   HG21  ILE  77          1HG2      ILE  77   5.154   0.735   9.431
  632   HG22  ILE  77          2HG2      ILE  77   3.749  -0.042  10.158
  633   HG23  ILE  77          3HG2      ILE  77   4.619  -0.842   8.846
  634   HD11  ILE  77          3HD1      ILE  77   3.265  -3.189  12.011
  635   HD12  ILE  77          1HD1      ILE  77   2.955  -1.920  10.823
  636   HD13  ILE  77          2HD1      ILE  77   3.464  -1.494  12.460
  637    H    ARG  78           H        ARG  78   9.199   0.270  10.745
  638    HA   ARG  78           HA       ARG  78   9.727  -1.121  13.311
  639    HB2  ARG  78           2HB      ARG  78  11.688   0.059  11.312
  640    HB3  ARG  78           3HB      ARG  78  12.144  -0.328  12.970
  641    HG2  ARG  78           2HG      ARG  78  11.575  -2.704  12.576
  642    HG3  ARG  78           3HG      ARG  78  11.100  -2.319  10.922
  643    HD2  ARG  78           2HD      ARG  78  13.887  -1.894  12.042
  644    HD3  ARG  78           3HD      ARG  78  13.391  -3.314  11.118
  645    HE   ARG  78           HE       ARG  78  12.841  -1.682   9.273
  646   HH11  ARG  78          1HH1      ARG  78  15.391  -0.931  11.593
  647   HH12  ARG  78          2HH1      ARG  78  16.238   0.093  10.479
  648   HH21  ARG  78          1HH2      ARG  78  13.991  -0.349   7.854
  649   HH22  ARG  78          2HH2      ARG  78  15.456   0.420   8.384
  650    H    GLY  79           H        GLY  79   9.019   0.117  14.852
  651    HA2  GLY  79           2HA      GLY  79   9.714   2.971  14.989
  652    HA3  GLY  79           3HA      GLY  79   8.002   2.548  14.993
  653    H    SER  80           H        SER  80  10.662   3.098  16.896
  654    HA   SER  80           HA       SER  80  11.118   3.050  19.102
  655    HB2  SER  80           2HB      SER  80   8.160   2.392  19.452
  656    HB3  SER  80           3HB      SER  80   9.244   2.984  20.718
  657    HG   SER  80           HG       SER  80   8.208   4.328  18.466
  658    H    LEU  81           H        LEU  81  10.955   0.447  17.428
  659    HA   LEU  81           HA       LEU  81  10.521  -1.705  19.242
  660    HB2  LEU  81           2HB      LEU  81  12.121  -1.677  16.650
  661    HB3  LEU  81           3HB      LEU  81  11.592  -3.115  17.508
  662    HG   LEU  81           HG       LEU  81   9.836  -1.107  16.050
  663   HD11  LEU  81          1HD1      LEU  81  10.971  -2.707  14.593
  664   HD12  LEU  81          2HD1      LEU  81   9.238  -3.015  14.622
  665   HD13  LEU  81          3HD1      LEU  81  10.334  -4.059  15.534
  666   HD21  LEU  81          3HD2      LEU  81   8.665  -1.739  18.092
  667   HD22  LEU  81          1HD2      LEU  81   8.934  -3.453  17.760
  668   HD23  LEU  81          2HD2      LEU  81   7.895  -2.494  16.701
  669    H    GLU  82           H        GLU  82  13.259   0.261  18.353
  670    HA   GLU  82           HA       GLU  82  15.194  -1.266  19.901
  671    HB2  GLU  82           2HB      GLU  82  15.495   1.358  18.379
  672    HB3  GLU  82           3HB      GLU  82  16.811   0.445  19.108
  673    HG2  GLU  82           2HG      GLU  82  15.066  -0.420  16.790
  674    HG3  GLU  82           3HG      GLU  82  16.772   0.018  16.728
  675    H    HIS  83           H        HIS  83  12.820   0.163  21.181
  676    HA   HIS  83           HA       HIS  83  13.838   2.093  22.993
  677    HB2  HIS  83           2HB      HIS  83  11.384   1.628  22.669
  678    HB3  HIS  83           3HB      HIS  83  11.593   0.070  23.459
  679    HD1  HIS  83           HD1      HIS  83  11.336   3.738  24.174
  680    HD2  HIS  83           HD2      HIS  83  11.857   0.197  26.296
  681    HE1  HIS  83           HE1      HIS  83  10.938   4.325  26.583
  682    HE2  HIS  83           HE2      HIS  83  11.126   2.151  27.823
  683    H    HIS  84           H        HIS  84  15.789   1.513  23.769
  684    HA   HIS  84           HA       HIS  84  16.547  -1.051  24.701
  685    HB2  HIS  84           2HB      HIS  84  17.827   1.676  25.151
  686    HB3  HIS  84           3HB      HIS  84  18.578   0.145  25.599
  687    HD1  HIS  84           HD1      HIS  84  18.379   2.500  22.861
  688    HD2  HIS  84           HD2      HIS  84  18.968  -1.601  23.204
  689    HE1  HIS  84           HE1      HIS  84  19.388   1.778  20.678
  690    HE2  HIS  84           HE2      HIS  84  19.911  -0.663  20.986
  691    H    HIS  85           H        HIS  85  16.739  -1.851  26.739
  692    HA   HIS  85           HA       HIS  85  15.037  -0.612  28.808
  693    HB2  HIS  85           2HB      HIS  85  14.869  -2.931  29.746
  694    HB3  HIS  85           3HB      HIS  85  14.262  -2.817  28.095
  695    HD1  HIS  85           HD1      HIS  85  17.146  -4.180  30.088
  696    HD2  HIS  85           HD2      HIS  85  15.640  -4.359  26.222
  697    HE1  HIS  85           HE1      HIS  85  18.503  -5.926  28.918
  698    HE2  HIS  85           HE2      HIS  85  17.455  -6.142  26.643
  699    H    HIS  86           H        HIS  86  15.693  -1.082  31.062
  700    HA   HIS  86           HA       HIS  86  18.326  -0.134  31.627
  701    HB2  HIS  86           2HB      HIS  86  17.592  -0.413  34.043
  702    HB3  HIS  86           3HB      HIS  86  16.525   0.577  33.059
  703    HD1  HIS  86           HD1      HIS  86  14.127   0.078  33.387
  704    HD2  HIS  86           HD2      HIS  86  16.477  -3.252  34.181
  705    HE1  HIS  86           HE1      HIS  86  12.534  -1.706  34.166
  706    HE2  HIS  86           HE2      HIS  86  13.960  -3.751  34.460
  707    H    HIS  87           H        HIS  87  19.591  -1.224  33.499
  708    HA   HIS  87           HA       HIS  87  20.617  -3.744  32.653
  709    HB2  HIS  87           2HB      HIS  87  22.025  -2.079  33.838
  710    HB3  HIS  87           3HB      HIS  87  21.036  -2.234  35.286
  711    HD1  HIS  87           HD1      HIS  87  21.808  -3.937  36.952
  712    HD2  HIS  87           HD2      HIS  87  23.467  -4.570  33.197
  713    HE1  HIS  87           HE1      HIS  87  23.477  -5.786  37.257
  714    HE2  HIS  87           HE2      HIS  87  24.606  -6.002  35.025
  715    H    HIS  88           H        HIS  88  20.195  -5.767  33.371
  716    HA   HIS  88           HA       HIS  88  17.823  -6.394  34.826
  717    HB2  HIS  88           2HB      HIS  88  20.139  -8.140  33.860
  718    HB3  HIS  88           3HB      HIS  88  18.741  -8.793  34.710
  719    HD1  HIS  88           HD1      HIS  88  17.203  -9.828  33.122
  720    HD2  HIS  88           HD2      HIS  88  18.966  -6.440  31.488
  721    HE1  HIS  88           HE1      HIS  88  16.202  -9.588  30.839
  722    HE2  HIS  88           HE2      HIS  88  17.453  -7.685  29.799
  Start of MODEL   14
    1    H1   MET   1           1H       MET   1  10.659   3.667  15.727
    2    H2   MET   1           2H       MET   1   9.065   3.674  15.172
    3    H3   MET   1           3H       MET   1   9.520   4.707  16.428
    4    HA   MET   1           HA       MET   1   9.310   5.948  14.398
    5    HB2  MET   1           2HB      MET   1  12.180   5.541  15.344
    6    HB3  MET   1           3HB      MET   1  11.715   6.824  14.233
    7    HG2  MET   1           2HG      MET   1  10.208   7.753  15.954
    8    HG3  MET   1           3HG      MET   1  10.727   6.488  17.073
    9    HE1  MET   1           3HE      MET   1  10.880   9.758  17.529
   10    HE2  MET   1           1HE      MET   1  12.439   9.889  18.342
   11    HE3  MET   1           2HE      MET   1  11.315   8.609  18.795
   12    H    GLY   2           H        GLY   2  10.985   6.482  12.390
   13    HA2  GLY   2           2HA      GLY   2  12.242   5.689  10.578
   14    HA3  GLY   2           3HA      GLY   2  11.835   4.034  11.002
   15    H    GLU   3           H        GLU   3  11.640   4.325   8.508
   16    HA   GLU   3           HA       GLU   3   9.081   5.410   7.574
   17    HB2  GLU   3           2HB      GLU   3   9.995   4.995   5.319
   18    HB3  GLU   3           3HB      GLU   3  11.161   5.869   6.308
   19    HG2  GLU   3           2HG      GLU   3  12.325   3.667   6.761
   20    HG3  GLU   3           3HG      GLU   3  11.238   2.921   5.597
   21    H    MET   4           H        MET   4   7.810   4.051   5.999
   22    HA   MET   4           HA       MET   4   7.800   1.160   6.687
   23    HB2  MET   4           2HB      MET   4   5.835   2.319   7.656
   24    HB3  MET   4           3HB      MET   4   5.400   2.952   6.075
   25    HG2  MET   4           2HG      MET   4   4.919   0.706   5.283
   26    HG3  MET   4           3HG      MET   4   5.473   0.015   6.814
   27    HE1  MET   4           3HE      MET   4   2.764  -0.963   5.883
   28    HE2  MET   4           1HE      MET   4   1.744  -0.688   7.294
   29    HE3  MET   4           2HE      MET   4   3.390  -1.280   7.502
   30    H    ASP   5           H        ASP   5   7.745  -0.274   4.967
   31    HA   ASP   5           HA       ASP   5   7.478   0.808   2.231
   32    HB2  ASP   5           2HB      ASP   5   8.999  -1.734   2.996
   33    HB3  ASP   5           3HB      ASP   5   9.072  -0.835   1.481
   34    H    ILE   6           H        ILE   6   5.646   0.083   1.343
   35    HA   ILE   6           HA       ILE   6   4.318  -2.396   2.321
   36    HB   ILE   6           HB       ILE   6   3.066   0.127   1.090
   37   HG12  ILE   6          2HG1      ILE   6   2.895  -0.892   3.966
   38   HG13  ILE   6          3HG1      ILE   6   3.888   0.458   3.431
   39   HG21  ILE   6          1HG2      ILE   6   1.802  -1.897   0.467
   40   HG22  ILE   6          2HG2      ILE   6   0.875  -0.910   1.594
   41   HG23  ILE   6          3HG2      ILE   6   1.684  -2.370   2.165
   42   HD11  ILE   6          3HD1      ILE   6   1.917   1.270   4.475
   43   HD12  ILE   6          1HD1      ILE   6   0.889   0.316   3.406
   44   HD13  ILE   6          2HD1      ILE   6   1.849   1.648   2.755
   45    H    ARG   7           H        ARG   7   4.758  -3.934   0.812
   46    HA   ARG   7           HA       ARG   7   4.826  -3.159  -2.043
   47    HB2  ARG   7           2HB      ARG   7   7.055  -3.819  -0.937
   48    HB3  ARG   7           3HB      ARG   7   6.427  -5.462  -0.839
   49    HG2  ARG   7           2HG      ARG   7   6.306  -5.634  -3.248
   50    HG3  ARG   7           3HG      ARG   7   6.637  -3.910  -3.438
   51    HD2  ARG   7           2HD      ARG   7   8.899  -4.413  -2.257
   52    HD3  ARG   7           3HD      ARG   7   8.546  -6.108  -2.613
   53    HE   ARG   7           HE       ARG   7   8.251  -5.008  -5.039
   54   HH11  ARG   7          1HH1      ARG   7  10.864  -4.624  -2.695
   55   HH12  ARG   7          2HH1      ARG   7  12.064  -4.317  -3.907
   56   HH21  ARG   7          1HH2      ARG   7   9.841  -4.553  -6.612
   57   HH22  ARG   7          2HH2      ARG   7  11.489  -4.275  -6.118
   58    H    PHE   8           H        PHE   8   3.459  -4.147  -3.294
   59    HA   PHE   8           HA       PHE   8   1.839  -6.449  -2.383
   60    HB2  PHE   8           2HB      PHE   8   1.338  -4.322  -4.531
   61    HB3  PHE   8           3HB      PHE   8   0.307  -5.727  -4.295
   62    HD1  PHE   8           HD2      PHE   8  -1.166  -5.891  -2.327
   63    HD2  PHE   8           HD1      PHE   8   1.238  -2.405  -2.978
   64    HE1  PHE   8           HE2      PHE   8  -2.521  -4.647  -0.698
   65    HE2  PHE   8           HE1      PHE   8  -0.128  -1.175  -1.339
   66    HZ   PHE   8           HZ       PHE   8  -2.003  -2.294  -0.203
   67    H    ARG   9           H        ARG   9   1.539  -8.141  -3.913
   68    HA   ARG   9           HA       ARG   9   3.086  -8.135  -6.412
   69    HB2  ARG   9           2HB      ARG   9   3.202 -10.285  -4.252
   70    HB3  ARG   9           3HB      ARG   9   3.513 -10.679  -5.929
   71    HG2  ARG   9           2HG      ARG   9   5.313  -8.805  -5.842
   72    HG3  ARG   9           3HG      ARG   9   5.129  -8.909  -4.090
   73    HD2  ARG   9           2HD      ARG   9   7.005 -10.281  -4.828
   74    HD3  ARG   9           3HD      ARG   9   5.722 -11.321  -4.197
   75    HE   ARG   9           HE       ARG   9   5.896 -10.833  -7.099
   76   HH11  ARG   9          1HH1      ARG   9   6.203 -13.153  -4.463
   77   HH12  ARG   9          2HH1      ARG   9   6.254 -14.526  -5.527
   78   HH21  ARG   9          1HH2      ARG   9   5.955 -12.634  -8.461
   79   HH22  ARG   9          2HH2      ARG   9   6.112 -14.225  -7.791
   80    H    GLY  10           H        GLY  10   1.927  -8.912  -8.057
   81    HA2  GLY  10           2HA      GLY  10  -0.496 -10.496  -7.668
   82    HA3  GLY  10           3HA      GLY  10  -0.743  -8.843  -8.228
   83    H    ASP  11           H        ASP  11  -0.674 -11.846  -9.305
   84    HA   ASP  11           HA       ASP  11   0.790 -11.938 -11.678
   85    HB2  ASP  11           2HB      ASP  11  -0.471 -13.843 -10.691
   86    HB3  ASP  11           3HB      ASP  11  -1.993 -13.065 -11.095
   87    H    ASP  12           H        ASP  12  -2.081 -10.201 -10.854
   88    HA   ASP  12           HA       ASP  12  -2.468  -9.160 -13.591
   89    HB2  ASP  12           2HB      ASP  12  -4.471 -10.221 -12.687
   90    HB3  ASP  12           3HB      ASP  12  -4.358  -9.281 -11.204
   91    H    LEU  13           H        LEU  13  -1.496  -7.286 -13.892
   92    HA   LEU  13           HA       LEU  13  -0.476  -5.582 -11.876
   93    HB2  LEU  13           2HB      LEU  13   0.490  -5.791 -14.170
   94    HB3  LEU  13           3HB      LEU  13  -0.920  -4.976 -14.824
   95    HG   LEU  13           HG       LEU  13  -0.295  -2.914 -13.518
   96   HD11  LEU  13          1HD1      LEU  13   0.993  -3.908 -11.698
   97   HD12  LEU  13          2HD1      LEU  13   1.952  -2.699 -12.545
   98   HD13  LEU  13          3HD1      LEU  13   2.254  -4.416 -12.828
   99   HD21  LEU  13          3HD2      LEU  13   1.853  -3.908 -15.415
  100   HD22  LEU  13          1HD2      LEU  13   1.552  -2.226 -14.975
  101   HD23  LEU  13          2HD2      LEU  13   0.338  -3.129 -15.876
  102    H    GLU  14           H        GLU  14  -3.586  -5.726 -13.471
  103    HA   GLU  14           HA       GLU  14  -4.434  -3.042 -12.957
  104    HB2  GLU  14           2HB      GLU  14  -6.048  -5.568 -13.493
  105    HB3  GLU  14           3HB      GLU  14  -6.794  -3.995 -13.234
  106    HG2  GLU  14           2HG      GLU  14  -4.901  -4.725 -15.483
  107    HG3  GLU  14           3HG      GLU  14  -6.644  -4.500 -15.609
  108    H    ALA  15           H        ALA  15  -4.755  -6.094 -11.134
  109    HA   ALA  15           HA       ALA  15  -6.317  -5.166  -8.993
  110    HB1  ALA  15           3HB      ALA  15  -5.870  -7.533  -9.444
  111    HB2  ALA  15           1HB      ALA  15  -5.432  -7.129  -7.782
  112    HB3  ALA  15           2HB      ALA  15  -4.175  -7.316  -9.010
  113    H    LEU  16           H        LEU  16  -2.836  -5.030  -9.564
  114    HA   LEU  16           HA       LEU  16  -2.037  -3.851  -7.095
  115    HB2  LEU  16           2HB      LEU  16  -0.678  -3.701  -9.820
  116    HB3  LEU  16           3HB      LEU  16   0.075  -3.315  -8.280
  117    HG   LEU  16           HG       LEU  16  -0.851  -6.077  -9.178
  118   HD11  LEU  16          1HD1      LEU  16   1.534  -6.662  -9.201
  119   HD12  LEU  16          2HD1      LEU  16   1.958  -5.005  -8.762
  120   HD13  LEU  16          3HD1      LEU  16   1.189  -5.338 -10.315
  121   HD21  LEU  16          3HD2      LEU  16   0.168  -6.936  -7.109
  122   HD22  LEU  16          1HD2      LEU  16  -1.182  -5.855  -6.771
  123   HD23  LEU  16          2HD2      LEU  16   0.476  -5.285  -6.568
  124    H    GLU  17           H        GLU  17  -3.215  -2.541 -10.171
  125    HA   GLU  17           HA       GLU  17  -2.652   0.207  -9.727
  126    HB2  GLU  17           2HB      GLU  17  -4.717  -1.156 -11.513
  127    HB3  GLU  17           3HB      GLU  17  -4.481   0.586 -11.499
  128    HG2  GLU  17           2HG      GLU  17  -2.210  -1.314 -12.087
  129    HG3  GLU  17           3HG      GLU  17  -3.317  -0.769 -13.340
  130    H    LYS  18           H        LYS  18  -5.615  -1.718  -9.107
  131    HA   LYS  18           HA       LYS  18  -7.220   0.420  -8.114
  132    HB2  LYS  18           2HB      LYS  18  -7.436  -2.598  -7.784
  133    HB3  LYS  18           3HB      LYS  18  -8.559  -1.511  -6.986
  134    HG2  LYS  18           2HG      LYS  18  -9.668  -2.294  -8.933
  135    HG3  LYS  18           3HG      LYS  18  -9.196  -0.629  -9.286
  136    HD2  LYS  18           2HD      LYS  18  -7.335  -1.393 -10.645
  137    HD3  LYS  18           3HD      LYS  18  -7.614  -3.066 -10.162
  138    HE2  LYS  18           2HE      LYS  18  -8.431  -2.731 -12.414
  139    HE3  LYS  18           3HE      LYS  18  -9.803  -3.005 -11.340
  140    HZ1  LYS  18           3HZ      LYS  18 -10.179  -1.215 -12.928
  141    HZ2  LYS  18           1HZ      LYS  18  -8.879  -0.352 -12.284
  142    HZ3  LYS  18           2HZ      LYS  18 -10.245  -0.653 -11.336
  143    H    ALA  19           H        ALA  19  -5.118  -1.996  -6.517
  144    HA   ALA  19           HA       ALA  19  -5.434  -1.173  -3.837
  145    HB1  ALA  19           3HB      ALA  19  -3.284  -2.311  -3.419
  146    HB2  ALA  19           1HB      ALA  19  -2.976  -2.374  -5.160
  147    HB3  ALA  19           2HB      ALA  19  -4.327  -3.272  -4.469
  148    H    LEU  20           H        LEU  20  -3.107  -0.138  -6.315
  149    HA   LEU  20           HA       LEU  20  -1.467   1.609  -4.921
  150    HB2  LEU  20           2HB      LEU  20  -1.097   0.817  -7.255
  151    HB3  LEU  20           3HB      LEU  20  -2.399   1.832  -7.827
  152    HG   LEU  20           HG       LEU  20   0.108   2.575  -8.166
  153   HD11  LEU  20          1HD1      LEU  20  -1.911   4.615  -7.202
  154   HD12  LEU  20          2HD1      LEU  20  -1.729   4.016  -8.849
  155   HD13  LEU  20          3HD1      LEU  20  -0.440   4.965  -8.118
  156   HD21  LEU  20          3HD2      LEU  20   0.821   2.289  -5.837
  157   HD22  LEU  20          1HD2      LEU  20  -0.305   3.549  -5.326
  158   HD23  LEU  20          2HD2      LEU  20   1.054   3.947  -6.376
  159    H    LYS  21           H        LYS  21  -4.394   2.354  -6.736
  160    HA   LYS  21           HA       LYS  21  -4.462   5.103  -6.548
  161    HB2  LYS  21           2HB      LYS  21  -5.891   3.648  -8.036
  162    HB3  LYS  21           3HB      LYS  21  -6.834   3.185  -6.625
  163    HG2  LYS  21           2HG      LYS  21  -7.274   5.761  -6.367
  164    HG3  LYS  21           3HG      LYS  21  -6.738   5.851  -8.043
  165    HD2  LYS  21           2HD      LYS  21  -9.203   5.708  -7.902
  166    HD3  LYS  21           3HD      LYS  21  -8.534   4.288  -8.714
  167    HE2  LYS  21           2HE      LYS  21  -8.804   2.938  -6.721
  168    HE3  LYS  21           3HE      LYS  21  -9.257   4.348  -5.761
  169    HZ1  LYS  21           3HZ      LYS  21 -11.120   2.886  -6.488
  170    HZ2  LYS  21           1HZ      LYS  21 -10.844   3.398  -8.074
  171    HZ3  LYS  21           2HZ      LYS  21 -11.299   4.514  -6.889
  172    H    GLU  22           H        GLU  22  -5.868   2.644  -4.440
  173    HA   GLU  22           HA       GLU  22  -7.129   4.451  -2.619
  174    HB2  GLU  22           2HB      GLU  22  -6.559   1.469  -2.483
  175    HB3  GLU  22           3HB      GLU  22  -7.491   2.339  -1.269
  176    HG2  GLU  22           2HG      GLU  22  -8.234   2.177  -4.200
  177    HG3  GLU  22           3HG      GLU  22  -8.871   1.107  -2.955
  178    H    MET  23           H        MET  23  -4.008   2.620  -2.529
  179    HA   MET  23           HA       MET  23  -3.418   3.219   0.176
  180    HB2  MET  23           2HB      MET  23  -1.585   2.434  -2.116
  181    HB3  MET  23           3HB      MET  23  -1.007   2.656  -0.467
  182    HG2  MET  23           2HG      MET  23  -3.029   0.617  -1.404
  183    HG3  MET  23           3HG      MET  23  -1.369   0.304  -0.912
  184    HE1  MET  23           3HE      MET  23  -0.525   0.656   1.646
  185    HE2  MET  23           1HE      MET  23  -1.610   1.085   2.970
  186    HE3  MET  23           2HE      MET  23  -1.226   2.275   1.727
  187    H    ILE  24           H        ILE  24  -2.625   4.976  -2.816
  188    HA   ILE  24           HA       ILE  24  -1.016   7.011  -1.650
  189    HB   ILE  24           HB       ILE  24  -2.729   7.051  -4.186
  190   HG12  ILE  24          2HG1      ILE  24   0.264   6.641  -3.721
  191   HG13  ILE  24          3HG1      ILE  24  -0.878   5.475  -4.375
  192   HG21  ILE  24          1HG2      ILE  24  -1.529   9.110  -4.866
  193   HG22  ILE  24          2HG2      ILE  24  -0.725   9.160  -3.298
  194   HG23  ILE  24          3HG2      ILE  24  -2.472   9.369  -3.395
  195   HD11  ILE  24          3HD1      ILE  24   0.505   6.326  -6.129
  196   HD12  ILE  24          1HD1      ILE  24   0.094   7.991  -5.716
  197   HD13  ILE  24          2HD1      ILE  24  -1.142   6.910  -6.366
  198    H    ARG  25           H        ARG  25  -4.477   6.819  -2.368
  199    HA   ARG  25           HA       ARG  25  -5.509   9.193  -1.431
  200    HB2  ARG  25           2HB      ARG  25  -6.766   7.425  -2.613
  201    HB3  ARG  25           3HB      ARG  25  -6.626   6.372  -1.220
  202    HG2  ARG  25           2HG      ARG  25  -8.052   8.014   0.064
  203    HG3  ARG  25           3HG      ARG  25  -8.294   8.889  -1.451
  204    HD2  ARG  25           2HD      ARG  25  -9.209   6.752  -2.454
  205    HD3  ARG  25           3HD      ARG  25  -9.109   6.019  -0.849
  206    HE   ARG  25           HE       ARG  25 -10.615   8.384  -0.658
  207   HH11  ARG  25          1HH1      ARG  25 -10.922   5.150  -2.094
  208   HH12  ARG  25          2HH1      ARG  25 -12.659   5.162  -2.004
  209   HH21  ARG  25          1HH2      ARG  25 -12.893   8.363  -0.584
  210   HH22  ARG  25          2HH2      ARG  25 -13.770   6.977  -1.153
  211    H    GLN  26           H        GLN  26  -4.630   6.298   0.434
  212    HA   GLN  26           HA       GLN  26  -5.594   7.240   2.974
  213    HB2  GLN  26           2HB      GLN  26  -3.623   4.994   2.375
  214    HB3  GLN  26           3HB      GLN  26  -4.458   5.256   3.907
  215    HG2  GLN  26           2HG      GLN  26  -5.725   4.522   1.267
  216    HG3  GLN  26           3HG      GLN  26  -5.540   3.476   2.661
  217   HE21  GLN  26          1HE2      GLN  26  -7.946   4.354   1.184
  218   HE22  GLN  26          2HE2      GLN  26  -8.994   5.034   2.370
  219    H    ALA  27           H        ALA  27  -2.349   6.982   1.517
  220    HA   ALA  27           HA       ALA  27  -0.881   8.009   3.709
  221    HB1  ALA  27           3HB      ALA  27  -0.187   8.051   0.757
  222    HB2  ALA  27           1HB      ALA  27   0.118   6.726   1.877
  223    HB3  ALA  27           2HB      ALA  27   0.950   8.265   2.093
  224    H    ARG  28           H        ARG  28  -2.699   9.586   1.189
  225    HA   ARG  28           HA       ARG  28  -1.617  12.237   1.631
  226    HB2  ARG  28           2HB      ARG  28  -3.932  11.241  -0.084
  227    HB3  ARG  28           3HB      ARG  28  -3.490  12.943   0.046
  228    HG2  ARG  28           2HG      ARG  28  -1.168  12.289  -0.775
  229    HG3  ARG  28           3HG      ARG  28  -1.829  10.692  -1.121
  230    HD2  ARG  28           2HD      ARG  28  -3.368  11.610  -2.759
  231    HD3  ARG  28           3HD      ARG  28  -2.934  13.266  -2.305
  232    HE   ARG  28           HE       ARG  28  -0.734  11.609  -3.248
  233   HH11  ARG  28          1HH1      ARG  28  -3.164  14.002  -4.188
  234   HH12  ARG  28          2HH1      ARG  28  -2.292  14.466  -5.618
  235   HH21  ARG  28          1HH2      ARG  28   0.391  12.265  -5.107
  236   HH22  ARG  28          2HH2      ARG  28  -0.293  13.489  -6.138
  237    H    LYS  29           H        LYS  29  -4.581  10.447   2.606
  238    HA   LYS  29           HA       LYS  29  -5.865  12.714   3.816
  239    HB2  LYS  29           2HB      LYS  29  -7.465  11.215   4.795
  240    HB3  LYS  29           3HB      LYS  29  -7.111  10.604   3.186
  241    HG2  LYS  29           2HG      LYS  29  -5.665   8.879   4.135
  242    HG3  LYS  29           3HG      LYS  29  -5.928   9.511   5.755
  243    HD2  LYS  29           2HD      LYS  29  -8.096   8.337   3.974
  244    HD3  LYS  29           3HD      LYS  29  -7.256   7.460   5.251
  245    HE2  LYS  29           2HE      LYS  29  -8.154   9.081   6.920
  246    HE3  LYS  29           3HE      LYS  29  -9.047   9.884   5.623
  247    HZ1  LYS  29           3HZ      LYS  29 -10.127   7.679   5.192
  248    HZ2  LYS  29           1HZ      LYS  29 -10.532   8.390   6.671
  249    HZ3  LYS  29           2HZ      LYS  29  -9.426   7.113   6.625
  250    H    PHE  30           H        PHE  30  -3.558  10.317   4.938
  251    HA   PHE  30           HA       PHE  30  -3.562  11.222   7.701
  252    HB2  PHE  30           2HB      PHE  30  -1.802   9.225   6.210
  253    HB3  PHE  30           3HB      PHE  30  -1.695   9.537   7.938
  254    HD1  PHE  30           HD1      PHE  30  -4.510   9.627   8.793
  255    HD2  PHE  30           HD2      PHE  30  -2.607   7.002   6.003
  256    HE1  PHE  30           HE1      PHE  30  -6.178   7.889   9.272
  257    HE2  PHE  30           HE2      PHE  30  -4.291   5.273   6.488
  258    HZ   PHE  30           HZ       PHE  30  -6.076   5.720   8.120
  259    H    ALA  31           H        ALA  31  -2.397  12.559   4.950
  260    HA   ALA  31           HA       ALA  31  -1.141  14.366   4.502
  261    HB1  ALA  31           3HB      ALA  31  -0.743  15.982   6.308
  262    HB2  ALA  31           1HB      ALA  31  -1.119  14.752   7.517
  263    HB3  ALA  31           2HB      ALA  31  -2.373  15.319   6.414
  264    H    GLY  32           H        GLY  32   0.181  11.791   4.904
  265    HA2  GLY  32           2HA      GLY  32   2.938  12.538   5.617
  266    HA3  GLY  32           3HA      GLY  32   2.332  10.921   5.274
  267    H    THR  33           H        THR  33   4.341  10.969   3.956
  268    HA   THR  33           HA       THR  33   3.993  12.062   1.234
  269    HB   THR  33           HB       THR  33   6.485  10.987   2.669
  270    HG1  THR  33           HG1      THR  33   5.644  13.639   2.024
  271   HG21  THR  33          3HG2      THR  33   6.676  10.602   0.240
  272   HG22  THR  33          1HG2      THR  33   7.767  11.892   0.748
  273   HG23  THR  33          2HG2      THR  33   6.259  12.288  -0.077
  274    H    VAL  34           H        VAL  34   4.015  10.574  -0.527
  275    HA   VAL  34           HA       VAL  34   4.142   7.695   0.065
  276    HB   VAL  34           HB       VAL  34   1.779   8.209   0.057
  277   HG11  VAL  34          1HG1      VAL  34   0.568   9.206  -1.836
  278   HG12  VAL  34          2HG1      VAL  34   2.101   9.502  -2.659
  279   HG13  VAL  34          3HG1      VAL  34   1.744  10.325  -1.142
  280   HG21  VAL  34          3HG2      VAL  34   2.421   6.075  -0.970
  281   HG22  VAL  34          1HG2      VAL  34   2.522   6.846  -2.555
  282   HG23  VAL  34          2HG2      VAL  34   0.966   6.716  -1.732
  283    H    THR  35           H        THR  35   5.484   6.728  -1.234
  284    HA   THR  35           HA       THR  35   6.012   7.649  -4.007
  285    HB   THR  35           HB       THR  35   7.796   5.906  -2.205
  286    HG1  THR  35           HG1      THR  35   7.932   7.857  -1.263
  287   HG21  THR  35          3HG2      THR  35   8.212   5.603  -4.637
  288   HG22  THR  35          1HG2      THR  35   9.580   6.367  -3.823
  289   HG23  THR  35          2HG2      THR  35   8.481   7.341  -4.802
  290    H    TYR  36           H        TYR  36   6.088   5.872  -5.574
  291    HA   TYR  36           HA       TYR  36   5.465   3.165  -4.733
  292    HB2  TYR  36           2HB      TYR  36   3.457   2.879  -6.046
  293    HB3  TYR  36           3HB      TYR  36   3.204   4.247  -4.976
  294    HD1  TYR  36           HD2      TYR  36   3.354   6.609  -5.939
  295    HD2  TYR  36           HD1      TYR  36   3.246   3.139  -8.443
  296    HE1  TYR  36           HE2      TYR  36   2.718   8.007  -7.857
  297    HE2  TYR  36           HE1      TYR  36   2.614   4.547 -10.350
  298    HH   TYR  36           HH       TYR  36   2.855   7.918 -10.312
  299    H    THR  37           H        THR  37   6.013   1.598  -6.275
  300    HA   THR  37           HA       THR  37   6.854   2.489  -8.968
  301    HB   THR  37           HB       THR  37   8.533   0.608  -7.237
  302    HG1  THR  37           HG1      THR  37   8.763   2.713  -6.471
  303   HG21  THR  37          3HG2      THR  37  10.237   0.833  -9.016
  304   HG22  THR  37          1HG2      THR  37   9.129   1.831  -9.962
  305   HG23  THR  37          2HG2      THR  37   8.747   0.136  -9.657
  306    H    LEU  38           H        LEU  38   5.654   1.344 -10.381
  307    HA   LEU  38           HA       LEU  38   4.834  -1.429  -9.915
  308    HB2  LEU  38           2HB      LEU  38   4.590   0.358 -12.385
  309    HB3  LEU  38           3HB      LEU  38   3.880  -1.242 -12.229
  310    HG   LEU  38           HG       LEU  38   3.122   1.148 -10.500
  311   HD11  LEU  38          1HD1      LEU  38   2.458   1.508 -12.830
  312   HD12  LEU  38          2HD1      LEU  38   1.059   1.254 -11.795
  313   HD13  LEU  38          3HD1      LEU  38   1.621  -0.049 -12.847
  314   HD21  LEU  38          3HD2      LEU  38   1.830  -1.591 -10.727
  315   HD22  LEU  38          1HD2      LEU  38   1.208  -0.225  -9.792
  316   HD23  LEU  38          2HD2      LEU  38   2.741  -0.968  -9.346
  317    H    ASP  39           H        ASP  39   6.438  -2.949 -10.123
  318    HA   ASP  39           HA       ASP  39   8.379  -2.723 -12.356
  319    HB2  ASP  39           2HB      ASP  39   9.334  -2.194 -10.012
  320    HB3  ASP  39           3HB      ASP  39   9.039  -3.882  -9.604
  321    H    GLY  40           H        GLY  40   7.105  -4.040 -13.613
  322    HA2  GLY  40           2HA      GLY  40   6.599  -6.012 -14.647
  323    HA3  GLY  40           3HA      GLY  40   7.461  -6.875 -13.383
  324    H    ASN  41           H        ASN  41   6.320  -7.539 -11.507
  325    HA   ASN  41           HA       ASN  41   3.360  -7.356 -11.555
  326    HB2  ASN  41           2HB      ASN  41   5.033  -9.903 -11.442
  327    HB3  ASN  41           3HB      ASN  41   3.394  -9.857 -10.802
  328   HD21  ASN  41          1HD2      ASN  41   1.654  -9.621 -12.238
  329   HD22  ASN  41          2HD2      ASN  41   1.816  -9.883 -13.931
  330    H    ASP  42           H        ASP  42   5.480  -6.012  -9.960
  331    HA   ASP  42           HA       ASP  42   4.104  -6.448  -7.405
  332    HB2  ASP  42           2HB      ASP  42   6.167  -6.256  -6.057
  333    HB3  ASP  42           3HB      ASP  42   6.234  -7.663  -7.110
  334    H    LEU  43           H        LEU  43   4.215  -4.633  -5.982
  335    HA   LEU  43           HA       LEU  43   4.760  -2.001  -7.216
  336    HB2  LEU  43           2HB      LEU  43   2.423  -2.395  -7.590
  337    HB3  LEU  43           3HB      LEU  43   2.198  -3.060  -5.981
  338    HG   LEU  43           HG       LEU  43   2.498  -0.795  -5.001
  339   HD11  LEU  43          1HD1      LEU  43   2.604   0.224  -7.850
  340   HD12  LEU  43          2HD1      LEU  43   3.924   0.252  -6.683
  341   HD13  LEU  43          3HD1      LEU  43   2.480   1.219  -6.398
  342   HD21  LEU  43          3HD2      LEU  43   0.322   0.081  -5.690
  343   HD22  LEU  43          1HD2      LEU  43   0.272  -1.671  -5.494
  344   HD23  LEU  43          2HD2      LEU  43   0.336  -0.966  -7.112
  345    H    GLU  44           H        GLU  44   6.416  -1.311  -5.890
  346    HA   GLU  44           HA       GLU  44   6.252  -1.653  -2.973
  347    HB2  GLU  44           2HB      GLU  44   8.387  -2.197  -4.058
  348    HB3  GLU  44           3HB      GLU  44   8.500  -0.581  -4.747
  349    HG2  GLU  44           2HG      GLU  44   8.748   0.390  -2.520
  350    HG3  GLU  44           3HG      GLU  44   8.511  -1.182  -1.763
  351    H    ILE  45           H        ILE  45   4.860  -0.223  -2.188
  352    HA   ILE  45           HA       ILE  45   4.916   2.654  -2.823
  353    HB   ILE  45           HB       ILE  45   2.972   1.052  -1.064
  354   HG12  ILE  45          2HG1      ILE  45   2.567   2.123  -3.900
  355   HG13  ILE  45          3HG1      ILE  45   2.853   0.437  -3.487
  356   HG21  ILE  45          1HG2      ILE  45   1.531   3.062  -1.111
  357   HG22  ILE  45          2HG2      ILE  45   2.752   3.932  -2.042
  358   HG23  ILE  45          3HG2      ILE  45   3.099   3.428  -0.388
  359   HD11  ILE  45          3HD1      ILE  45   0.528   0.829  -3.930
  360   HD12  ILE  45          1HD1      ILE  45   0.460   2.073  -2.684
  361   HD13  ILE  45          2HD1      ILE  45   0.755   0.390  -2.239
  362    H    ARG  46           H        ARG  46   6.330   3.851  -1.571
  363    HA   ARG  46           HA       ARG  46   7.083   2.911   1.140
  364    HB2  ARG  46           2HB      ARG  46   8.477   4.811  -0.791
  365    HB3  ARG  46           3HB      ARG  46   9.035   4.498   0.852
  366    HG2  ARG  46           2HG      ARG  46   9.385   2.117   0.277
  367    HG3  ARG  46           3HG      ARG  46   8.824   2.437  -1.367
  368    HD2  ARG  46           2HD      ARG  46  10.702   3.922  -1.780
  369    HD3  ARG  46           3HD      ARG  46  11.241   3.792  -0.105
  370    HE   ARG  46           HE       ARG  46  11.407   1.707  -2.184
  371   HH11  ARG  46          1HH1      ARG  46  12.341   2.845   1.012
  372   HH12  ARG  46          2HH1      ARG  46  13.571   1.640   1.213
  373   HH21  ARG  46          1HH2      ARG  46  12.972   0.081  -1.875
  374   HH22  ARG  46          2HH2      ARG  46  13.928   0.073  -0.423
  375    H    ILE  47           H        ILE  47   5.899   3.863   2.668
  376    HA   ILE  47           HA       ILE  47   4.975   6.658   2.336
  377    HB   ILE  47           HB       ILE  47   3.651   4.414   3.939
  378   HG12  ILE  47          2HG1      ILE  47   2.788   5.758   1.325
  379   HG13  ILE  47          3HG1      ILE  47   3.450   4.135   1.460
  380   HG21  ILE  47          1HG2      ILE  47   1.787   6.018   4.296
  381   HG22  ILE  47          2HG2      ILE  47   2.714   7.277   3.479
  382   HG23  ILE  47          3HG2      ILE  47   3.289   6.612   5.008
  383   HD11  ILE  47          3HD1      ILE  47   1.080   4.052   1.143
  384   HD12  ILE  47          1HD1      ILE  47   0.808   5.082   2.548
  385   HD13  ILE  47          2HD1      ILE  47   1.480   3.463   2.754
  386    H    THR  48           H        THR  48   5.890   8.061   3.610
  387    HA   THR  48           HA       THR  48   6.950   7.395   6.292
  388    HB   THR  48           HB       THR  48   8.467   9.029   4.185
  389    HG1  THR  48           HG1      THR  48   8.355   6.314   4.577
  390   HG21  THR  48          3HG2      THR  48   9.079   9.641   6.504
  391   HG22  THR  48          1HG2      THR  48  10.408   8.795   5.707
  392   HG23  THR  48          2HG2      THR  48   9.397   7.944   6.875
  393    H    GLY  49           H        GLY  49   7.149   9.383   7.653
  394    HA2  GLY  49           2HA      GLY  49   6.793  11.688   8.108
  395    HA3  GLY  49           3HA      GLY  49   5.775  11.828   6.681
  396    H    VAL  50           H        VAL  50   4.339   9.324   7.407
  397    HA   VAL  50           HA       VAL  50   2.387  10.289   9.280
  398    HB   VAL  50           HB       VAL  50   1.338   8.027   8.991
  399   HG11  VAL  50          1HG1      VAL  50   0.758   9.820   7.408
  400   HG12  VAL  50          2HG1      VAL  50   0.739   8.249   6.606
  401   HG13  VAL  50          3HG1      VAL  50   2.097   9.350   6.355
  402   HG21  VAL  50          3HG2      VAL  50   2.258   6.400   7.381
  403   HG22  VAL  50          1HG2      VAL  50   3.372   6.661   8.725
  404   HG23  VAL  50          2HG2      VAL  50   3.690   7.411   7.159
  405    HA   PRO  51           HA       PRO  51   4.304   8.745  13.168
  406    HB2  PRO  51           2HB      PRO  51   1.417   8.267  13.950
  407    HB3  PRO  51           3HB      PRO  51   2.698   9.135  14.830
  408    HG2  PRO  51           2HG      PRO  51   0.765  10.469  13.593
  409    HG3  PRO  51           3HG      PRO  51   2.435  11.078  13.580
  410    HD2  PRO  51           2HD      PRO  51   0.903   9.717  11.378
  411    HD3  PRO  51           3HD      PRO  51   2.093  11.031  11.280
  412    H    GLU  52           H        GLU  52   4.262   6.761  14.518
  413    HA   GLU  52           HA       GLU  52   4.312   4.415  12.897
  414    HB2  GLU  52           2HB      GLU  52   5.964   4.806  14.663
  415    HB3  GLU  52           3HB      GLU  52   4.713   4.771  15.902
  416    HG2  GLU  52           2HG      GLU  52   4.306   2.407  15.470
  417    HG3  GLU  52           3HG      GLU  52   5.437   2.425  14.118
  418    H    GLN  53           H        GLN  53   2.034   5.675  15.276
  419    HA   GLN  53           HA       GLN  53   0.318   3.410  15.489
  420    HB2  GLN  53           2HB      GLN  53  -1.419   5.052  16.224
  421    HB3  GLN  53           3HB      GLN  53   0.107   5.258  17.070
  422    HG2  GLN  53           2HG      GLN  53   0.629   7.255  15.853
  423    HG3  GLN  53           3HG      GLN  53  -0.668   6.969  14.696
  424   HE21  GLN  53          1HE2      GLN  53  -2.801   7.466  15.290
  425   HE22  GLN  53          2HE2      GLN  53  -3.172   8.448  16.668
  426    H    VAL  54           H        VAL  54   0.624   6.008  13.169
  427    HA   VAL  54           HA       VAL  54  -1.768   5.377  11.679
  428    HB   VAL  54           HB       VAL  54   0.515   7.322  11.099
  429   HG11  VAL  54          1HG1      VAL  54  -2.179   7.067   9.714
  430   HG12  VAL  54          2HG1      VAL  54  -0.598   6.724   9.008
  431   HG13  VAL  54          3HG1      VAL  54  -1.017   8.372   9.463
  432   HG21  VAL  54          3HG2      VAL  54  -2.264   7.850  12.215
  433   HG22  VAL  54          1HG2      VAL  54  -1.048   9.074  11.836
  434   HG23  VAL  54          2HG2      VAL  54  -0.753   7.908  13.127
  435    H    ARG  55           H        ARG  55   1.694   4.600  11.474
  436    HA   ARG  55           HA       ARG  55   1.740   3.521   8.848
  437    HB2  ARG  55           2HB      ARG  55   3.483   2.844  11.258
  438    HB3  ARG  55           3HB      ARG  55   3.756   2.185   9.648
  439    HG2  ARG  55           2HG      ARG  55   3.969   4.591   8.830
  440    HG3  ARG  55           3HG      ARG  55   3.988   5.069  10.526
  441    HD2  ARG  55           2HD      ARG  55   5.985   3.243   9.152
  442    HD3  ARG  55           3HD      ARG  55   6.267   4.910   9.643
  443    HE   ARG  55           HE       ARG  55   5.617   3.739  11.974
  444   HH11  ARG  55          1HH1      ARG  55   7.973   2.800   9.526
  445   HH12  ARG  55          2HH1      ARG  55   9.030   2.050  10.672
  446   HH21  ARG  55          1HH2      ARG  55   7.054   2.776  13.459
  447   HH22  ARG  55          2HH2      ARG  55   8.511   2.035  12.890
  448    H    LYS  56           H        LYS  56   0.865   2.153  11.969
  449    HA   LYS  56           HA       LYS  56   0.330  -0.516  11.228
  450    HB2  LYS  56           2HB      LYS  56  -1.032   1.212  13.343
  451    HB3  LYS  56           3HB      LYS  56  -1.192  -0.540  13.228
  452    HG2  LYS  56           2HG      LYS  56   1.175  -0.838  13.715
  453    HG3  LYS  56           3HG      LYS  56   1.433   0.909  13.699
  454    HD2  LYS  56           2HD      LYS  56  -0.049   1.148  15.671
  455    HD3  LYS  56           3HD      LYS  56  -0.321  -0.598  15.681
  456    HE2  LYS  56           2HE      LYS  56   1.349   0.080  17.364
  457    HE3  LYS  56           3HE      LYS  56   2.057  -0.985  16.150
  458    HZ1  LYS  56           3HZ      LYS  56   3.512   0.853  16.656
  459    HZ2  LYS  56           1HZ      LYS  56   2.317   1.976  16.240
  460    HZ3  LYS  56           2HZ      LYS  56   2.985   0.964  15.055
  461    H    GLU  57           H        GLU  57  -1.536   2.443  10.834
  462    HA   GLU  57           HA       GLU  57  -3.989   1.148  10.028
  463    HB2  GLU  57           2HB      GLU  57  -3.136   4.076   9.809
  464    HB3  GLU  57           3HB      GLU  57  -4.762   3.464   9.516
  465    HG2  GLU  57           2HG      GLU  57  -3.264   3.369  12.139
  466    HG3  GLU  57           3HG      GLU  57  -4.595   4.453  11.743
  467    H    LEU  58           H        LEU  58  -1.230   2.685   8.341
  468    HA   LEU  58           HA       LEU  58  -2.192   2.242   5.698
  469    HB2  LEU  58           2HB      LEU  58   0.585   2.709   6.818
  470    HB3  LEU  58           3HB      LEU  58   0.397   2.215   5.151
  471    HG   LEU  58           HG       LEU  58   0.628   4.539   5.012
  472   HD11  LEU  58          1HD1      LEU  58  -1.489   5.452   4.192
  473   HD12  LEU  58          2HD1      LEU  58  -2.372   4.116   4.932
  474   HD13  LEU  58          3HD1      LEU  58  -1.230   3.803   3.624
  475   HD21  LEU  58          3HD2      LEU  58  -0.525   6.213   6.369
  476   HD22  LEU  58          1HD2      LEU  58   0.436   5.123   7.365
  477   HD23  LEU  58          2HD2      LEU  58  -1.319   4.940   7.299
  478    H    ALA  59           H        ALA  59  -0.581   0.159   8.038
  479    HA   ALA  59           HA       ALA  59  -0.142  -2.093   6.377
  480    HB1  ALA  59           3HB      ALA  59  -0.690  -2.017   9.370
  481    HB2  ALA  59           1HB      ALA  59   0.891  -1.867   8.608
  482    HB3  ALA  59           2HB      ALA  59  -0.009  -3.378   8.476
  483    H    LYS  60           H        LYS  60  -2.968  -0.973   8.266
  484    HA   LYS  60           HA       LYS  60  -4.621  -3.254   7.882
  485    HB2  LYS  60           2HB      LYS  60  -5.603  -0.392   8.232
  486    HB3  LYS  60           3HB      LYS  60  -6.518  -1.862   8.539
  487    HG2  LYS  60           2HG      LYS  60  -4.230  -0.726  10.137
  488    HG3  LYS  60           3HG      LYS  60  -5.903  -0.937  10.613
  489    HD2  LYS  60           2HD      LYS  60  -5.649  -3.358  10.670
  490    HD3  LYS  60           3HD      LYS  60  -3.993  -3.222  10.067
  491    HE2  LYS  60           2HE      LYS  60  -4.153  -3.614  12.549
  492    HE3  LYS  60           3HE      LYS  60  -3.265  -2.154  12.112
  493    HZ1  LYS  60           3HZ      LYS  60  -4.846  -1.879  13.974
  494    HZ2  LYS  60           1HZ      LYS  60  -6.125  -2.172  12.908
  495    HZ3  LYS  60           2HZ      LYS  60  -5.132  -0.817  12.688
  496    H    GLU  61           H        GLU  61  -4.095  -0.302   6.005
  497    HA   GLU  61           HA       GLU  61  -6.170  -0.735   4.099
  498    HB2  GLU  61           2HB      GLU  61  -3.682   1.013   3.852
  499    HB3  GLU  61           3HB      GLU  61  -5.118   1.101   2.839
  500    HG2  GLU  61           2HG      GLU  61  -4.886   1.806   5.763
  501    HG3  GLU  61           3HG      GLU  61  -5.220   2.897   4.424
  502    H    ALA  62           H        ALA  62  -2.689  -1.343   4.134
  503    HA   ALA  62           HA       ALA  62  -2.255  -2.532   1.679
  504    HB1  ALA  62           3HB      ALA  62  -0.524  -1.993   3.371
  505    HB2  ALA  62           1HB      ALA  62  -0.362  -3.646   2.794
  506    HB3  ALA  62           2HB      ALA  62  -1.082  -3.333   4.372
  507    H    GLU  63           H        GLU  63  -3.318  -4.069   4.703
  508    HA   GLU  63           HA       GLU  63  -3.595  -6.692   3.750
  509    HB2  GLU  63           2HB      GLU  63  -4.732  -5.235   6.184
  510    HB3  GLU  63           3HB      GLU  63  -4.972  -6.968   5.906
  511    HG2  GLU  63           2HG      GLU  63  -2.209  -5.738   6.000
  512    HG3  GLU  63           3HG      GLU  63  -3.052  -6.247   7.444
  513    H    ARG  64           H        ARG  64  -6.105  -4.137   4.153
  514    HA   ARG  64           HA       ARG  64  -8.302  -5.867   3.564
  515    HB2  ARG  64           2HB      ARG  64  -9.690  -3.845   3.471
  516    HB3  ARG  64           3HB      ARG  64  -8.601  -3.777   4.850
  517    HG2  ARG  64           2HG      ARG  64  -7.120  -2.246   3.617
  518    HG3  ARG  64           3HG      ARG  64  -8.205  -2.303   2.230
  519    HD2  ARG  64           2HD      ARG  64  -9.021  -1.297   4.981
  520    HD3  ARG  64           3HD      ARG  64  -8.447  -0.256   3.679
  521    HE   ARG  64           HE       ARG  64 -10.809  -1.965   3.245
  522   HH11  ARG  64          1HH1      ARG  64  -9.455   1.290   3.527
  523   HH12  ARG  64          2HH1      ARG  64 -10.899   2.058   2.913
  524   HH21  ARG  64          1HH2      ARG  64 -12.652  -0.950   2.410
  525   HH22  ARG  64          2HH2      ARG  64 -12.705   0.787   2.279
  526    H    LEU  65           H        LEU  65  -6.219  -3.843   1.578
  527    HA   LEU  65           HA       LEU  65  -7.764  -4.124  -0.859
  528    HB2  LEU  65           2HB      LEU  65  -4.959  -3.064  -0.337
  529    HB3  LEU  65           3HB      LEU  65  -5.762  -2.992  -1.898
  530    HG   LEU  65           HG       LEU  65  -6.731  -1.611   0.637
  531   HD11  LEU  65          1HD1      LEU  65  -4.684  -0.592  -0.233
  532   HD12  LEU  65          2HD1      LEU  65  -6.065   0.483  -0.418
  533   HD13  LEU  65          3HD1      LEU  65  -5.439  -0.392  -1.818
  534   HD21  LEU  65          3HD2      LEU  65  -8.374  -0.475  -0.799
  535   HD22  LEU  65          1HD2      LEU  65  -8.617  -2.220  -0.791
  536   HD23  LEU  65          2HD2      LEU  65  -7.851  -1.444  -2.178
  537    H    ALA  66           H        ALA  66  -5.005  -5.736   0.625
  538    HA   ALA  66           HA       ALA  66  -4.094  -7.249  -1.576
  539    HB1  ALA  66           3HB      ALA  66  -3.996  -7.980   1.367
  540    HB2  ALA  66           1HB      ALA  66  -2.815  -6.982   0.514
  541    HB3  ALA  66           2HB      ALA  66  -3.005  -8.683   0.085
  542    H    LYS  67           H        LYS  67  -6.329  -8.169   1.042
  543    HA   LYS  67           HA       LYS  67  -6.958 -10.749  -0.065
  544    HB2  LYS  67           2HB      LYS  67  -8.538 -10.930   1.818
  545    HB3  LYS  67           3HB      LYS  67  -6.970 -10.346   2.359
  546    HG2  LYS  67           2HG      LYS  67  -7.905  -8.011   2.357
  547    HG3  LYS  67           3HG      LYS  67  -9.489  -8.697   2.002
  548    HD2  LYS  67           2HD      LYS  67  -7.814  -9.221   4.492
  549    HD3  LYS  67           3HD      LYS  67  -9.274  -8.237   4.407
  550    HE2  LYS  67           2HE      LYS  67 -10.570 -10.284   3.774
  551    HE3  LYS  67           3HE      LYS  67  -9.100 -11.241   3.972
  552    HZ1  LYS  67           3HZ      LYS  67  -9.029 -10.506   6.313
  553    HZ2  LYS  67           1HZ      LYS  67 -10.436 -11.378   5.955
  554    HZ3  LYS  67           2HZ      LYS  67 -10.494  -9.694   6.092
  555    H    GLU  68           H        GLU  68  -8.185  -7.559  -0.524
  556    HA   GLU  68           HA       GLU  68 -10.815  -8.179  -1.472
  557    HB2  GLU  68           2HB      GLU  68 -10.101  -5.917  -0.630
  558    HB3  GLU  68           3HB      GLU  68  -9.100  -5.721  -2.062
  559    HG2  GLU  68           2HG      GLU  68 -11.132  -4.481  -2.376
  560    HG3  GLU  68           3HG      GLU  68 -11.173  -5.869  -3.461
  561    H    PHE  69           H        PHE  69  -7.740  -7.338  -3.092
  562    HA   PHE  69           HA       PHE  69  -8.878  -7.878  -5.753
  563    HB2  PHE  69           2HB      PHE  69  -6.214  -6.588  -4.990
  564    HB3  PHE  69           3HB      PHE  69  -6.909  -6.653  -6.607
  565    HD1  PHE  69           HD1      PHE  69  -9.635  -5.825  -6.388
  566    HD2  PHE  69           HD2      PHE  69  -6.274  -4.385  -4.167
  567    HE1  PHE  69           HE1      PHE  69 -10.811  -3.706  -5.965
  568    HE2  PHE  69           HE2      PHE  69  -7.461  -2.274  -3.751
  569    HZ   PHE  69           HZ       PHE  69  -9.713  -1.928  -4.650
  570    H    ASN  70           H        ASN  70  -7.623  -9.827  -3.558
  571    HA   ASN  70           HA       ASN  70  -6.749 -11.911  -3.543
  572    HB2  ASN  70           2HB      ASN  70  -8.416 -12.183  -5.419
  573    HB3  ASN  70           3HB      ASN  70  -7.139 -11.832  -6.573
  574   HD21  ASN  70          1HD2      ASN  70  -5.702 -13.475  -7.122
  575   HD22  ASN  70          2HD2      ASN  70  -5.873 -15.107  -6.579
  576    H    ILE  71           H        ILE  71  -5.021  -9.563  -3.849
  577    HA   ILE  71           HA       ILE  71  -2.580 -10.730  -5.048
  578    HB   ILE  71           HB       ILE  71  -1.625  -8.411  -4.899
  579   HG12  ILE  71          2HG1      ILE  71  -4.478  -7.640  -4.109
  580   HG13  ILE  71          3HG1      ILE  71  -3.032  -7.442  -3.131
  581   HG21  ILE  71          1HG2      ILE  71  -4.156  -8.660  -6.564
  582   HG22  ILE  71          2HG2      ILE  71  -2.564  -9.285  -7.003
  583   HG23  ILE  71          3HG2      ILE  71  -2.820  -7.546  -6.866
  584   HD11  ILE  71          3HD1      ILE  71  -3.700  -5.954  -5.665
  585   HD12  ILE  71          1HD1      ILE  71  -2.193  -5.790  -4.759
  586   HD13  ILE  71          2HD1      ILE  71  -3.723  -5.326  -4.017
  587    H    THR  72           H        THR  72  -0.646 -10.646  -3.877
  588    HA   THR  72           HA       THR  72  -0.907 -11.111  -1.004
  589    HB   THR  72           HB       THR  72   1.618 -11.737  -1.339
  590    HG1  THR  72           HG1      THR  72   0.796 -11.506  -4.053
  591   HG21  THR  72          3HG2      THR  72   1.078 -13.934  -2.346
  592   HG22  THR  72          1HG2      THR  72  -0.492 -13.315  -2.863
  593   HG23  THR  72          2HG2      THR  72  -0.127 -13.474  -1.143
  594    H    VAL  73           H        VAL  73   0.249  -9.884   0.594
  595    HA   VAL  73           HA       VAL  73   1.737  -7.497  -0.305
  596    HB   VAL  73           HB       VAL  73  -0.616  -6.806   0.343
  597   HG11  VAL  73          1HG1      VAL  73  -1.289  -6.713   2.698
  598   HG12  VAL  73          2HG1      VAL  73   0.174  -7.584   3.170
  599   HG13  VAL  73          3HG1      VAL  73  -1.044  -8.380   2.173
  600   HG21  VAL  73          3HG2      VAL  73   1.551  -5.613   2.111
  601   HG22  VAL  73          1HG2      VAL  73   0.040  -4.844   1.620
  602   HG23  VAL  73          2HG2      VAL  73   1.273  -5.205   0.414
  603    H    THR  74           H        THR  74   3.357  -6.850   1.000
  604    HA   THR  74           HA       THR  74   3.922  -8.125   3.574
  605    HB   THR  74           HB       THR  74   5.273  -9.407   1.970
  606    HG1  THR  74           HG1      THR  74   7.278  -7.767   2.963
  607   HG21  THR  74          3HG2      THR  74   6.999  -8.375   0.538
  608   HG22  THR  74          1HG2      THR  74   6.467  -6.766   1.036
  609   HG23  THR  74          2HG2      THR  74   5.391  -7.797   0.092
  610    H    TYR  75           H        TYR  75   4.795  -6.614   5.023
  611    HA   TYR  75           HA       TYR  75   5.615  -3.980   4.044
  612    HB2  TYR  75           2HB      TYR  75   4.070  -2.835   5.745
  613    HB3  TYR  75           3HB      TYR  75   3.294  -3.488   4.311
  614    HD1  TYR  75           HD1      TYR  75   3.840  -4.123   7.979
  615    HD2  TYR  75           HD2      TYR  75   1.544  -5.143   4.506
  616    HE1  TYR  75           HE1      TYR  75   2.244  -5.351   9.381
  617    HE2  TYR  75           HE2      TYR  75  -0.043  -6.364   5.930
  618    HH   TYR  75           HH       TYR  75  -0.141  -7.422   8.089
  619    H    THR  76           H        THR  76   6.947  -2.836   5.422
  620    HA   THR  76           HA       THR  76   8.093  -4.365   7.685
  621    HB   THR  76           HB       THR  76   9.477  -2.150   6.083
  622    HG1  THR  76           HG1      THR  76   9.790  -3.604   4.598
  623   HG21  THR  76          3HG2      THR  76  10.452  -2.574   8.326
  624   HG22  THR  76          1HG2      THR  76  11.545  -3.122   7.051
  625   HG23  THR  76          2HG2      THR  76  10.580  -4.293   7.949
  626    H    ILE  77           H        ILE  77   7.593  -3.549   9.615
  627    HA   ILE  77           HA       ILE  77   7.769  -0.668  10.126
  628    HB   ILE  77           HB       ILE  77   5.755  -1.017  11.813
  629   HG12  ILE  77          2HG1      ILE  77   5.188  -3.233   9.780
  630   HG13  ILE  77          3HG1      ILE  77   5.400  -3.417  11.516
  631   HG21  ILE  77          1HG2      ILE  77   5.729   0.602   9.965
  632   HG22  ILE  77          2HG2      ILE  77   4.149  -0.149  10.186
  633   HG23  ILE  77          3HG2      ILE  77   5.189  -0.662   8.856
  634   HD11  ILE  77          3HD1      ILE  77   3.090  -2.060  10.132
  635   HD12  ILE  77          1HD1      ILE  77   3.311  -2.171  11.881
  636   HD13  ILE  77          2HD1      ILE  77   3.082  -3.636  10.928
  637    H    ARG  78           H        ARG  78   9.136  -0.361  11.707
  638    HA   ARG  78           HA       ARG  78   9.498  -2.296  13.905
  639    HB2  ARG  78           2HB      ARG  78  11.984  -1.934  13.748
  640    HB3  ARG  78           3HB      ARG  78  11.322  -2.789  12.364
  641    HG2  ARG  78           2HG      ARG  78  11.513  -0.829  10.957
  642    HG3  ARG  78           3HG      ARG  78  11.936   0.191  12.329
  643    HD2  ARG  78           2HD      ARG  78  14.051  -1.094  12.602
  644    HD3  ARG  78           3HD      ARG  78  13.620  -2.075  11.200
  645    HE   ARG  78           HE       ARG  78  13.618   0.188   9.974
  646   HH11  ARG  78          1HH1      ARG  78  15.847  -0.555  12.615
  647   HH12  ARG  78          2HH1      ARG  78  17.079   0.511  12.021
  648   HH21  ARG  78          1HH2      ARG  78  15.263   1.537   9.203
  649   HH22  ARG  78          2HH2      ARG  78  16.750   1.698  10.087
  650    H    GLY  79           H        GLY  79  10.174  -1.321  15.858
  651    HA2  GLY  79           2HA      GLY  79  11.073   0.947  16.746
  652    HA3  GLY  79           3HA      GLY  79   9.546   1.554  16.112
  653    H    SER  80           H        SER  80   7.764  -0.300  16.704
  654    HA   SER  80           HA       SER  80   7.370  -0.411  19.529
  655    HB2  SER  80           2HB      SER  80   5.488  -1.992  18.888
  656    HB3  SER  80           3HB      SER  80   5.459  -0.456  18.025
  657    HG   SER  80           HG       SER  80   5.451  -2.828  16.968
  658    H    LEU  81           H        LEU  81   8.975  -2.412  17.217
  659    HA   LEU  81           HA       LEU  81   9.088  -4.829  18.832
  660    HB2  LEU  81           2HB      LEU  81  10.383  -4.174  16.155
  661    HB3  LEU  81           3HB      LEU  81  10.219  -5.775  16.859
  662    HG   LEU  81           HG       LEU  81   7.910  -4.018  15.930
  663   HD11  LEU  81          1HD1      LEU  81   9.215  -4.847  14.025
  664   HD12  LEU  81          2HD1      LEU  81   7.640  -5.632  14.085
  665   HD13  LEU  81          3HD1      LEU  81   9.079  -6.505  14.620
  666   HD21  LEU  81          3HD2      LEU  81   7.885  -6.871  16.983
  667   HD22  LEU  81          1HD2      LEU  81   6.495  -6.010  16.315
  668   HD23  LEU  81          2HD2      LEU  81   7.245  -5.445  17.805
  669    H    GLU  82           H        GLU  82  10.238  -2.970  20.348
  670    HA   GLU  82           HA       GLU  82  13.125  -2.955  20.087
  671    HB2  GLU  82           2HB      GLU  82  13.069  -1.813  22.310
  672    HB3  GLU  82           3HB      GLU  82  12.078  -1.021  21.100
  673    HG2  GLU  82           2HG      GLU  82  10.798  -0.882  23.059
  674    HG3  GLU  82           3HG      GLU  82  10.079  -2.216  22.168
  675    H    HIS  83           H        HIS  83  14.165  -3.648  22.497
  676    HA   HIS  83           HA       HIS  83  14.146  -6.518  22.322
  677    HB2  HIS  83           2HB      HIS  83  15.617  -4.599  24.179
  678    HB3  HIS  83           3HB      HIS  83  15.774  -6.349  24.324
  679    HD1  HIS  83           HD1      HIS  83  17.803  -7.172  23.196
  680    HD2  HIS  83           HD2      HIS  83  16.232  -3.857  21.250
  681    HE1  HIS  83           HE1      HIS  83  19.331  -6.746  21.251
  682    HE2  HIS  83           HE2      HIS  83  18.382  -4.720  20.113
  683    H    HIS  84           H        HIS  84  13.997  -4.933  25.490
  684    HA   HIS  84           HA       HIS  84  11.338  -5.916  26.142
  685    HB2  HIS  84           2HB      HIS  84  13.825  -7.014  27.542
  686    HB3  HIS  84           3HB      HIS  84  12.220  -7.082  28.255
  687    HD1  HIS  84           HD1      HIS  84  10.487  -8.669  27.083
  688    HD2  HIS  84           HD2      HIS  84  14.395  -9.030  25.704
  689    HE1  HIS  84           HE1      HIS  84  10.556 -10.825  25.799
  690    HE2  HIS  84           HE2      HIS  84  12.894 -10.985  24.909
  691    H    HIS  85           H        HIS  85  10.553  -4.062  26.904
  692    HA   HIS  85           HA       HIS  85  12.027  -1.887  27.890
  693    HB2  HIS  85           2HB      HIS  85   9.757  -1.728  26.867
  694    HB3  HIS  85           3HB      HIS  85   9.065  -2.467  28.307
  695    HD1  HIS  85           HD1      HIS  85  10.958   0.661  27.274
  696    HD2  HIS  85           HD2      HIS  85   8.409  -0.650  30.288
  697    HE1  HIS  85           HE1      HIS  85  10.454   2.689  28.664
  698    HE2  HIS  85           HE2      HIS  85   8.879   1.888  30.444
  699    H    HIS  86           H        HIS  86  10.485  -4.577  29.567
  700    HA   HIS  86           HA       HIS  86  12.058  -3.966  31.992
  701    HB2  HIS  86           2HB      HIS  86   9.082  -4.633  31.965
  702    HB3  HIS  86           3HB      HIS  86  10.080  -4.852  33.395
  703    HD1  HIS  86           HD1      HIS  86   7.813  -2.512  32.016
  704    HD2  HIS  86           HD2      HIS  86  11.409  -2.207  34.081
  705    HE1  HIS  86           HE1      HIS  86   7.855  -0.184  32.969
  706    HE2  HIS  86           HE2      HIS  86   9.929  -0.120  34.391
  707    H    HIS  87           H        HIS  87  11.840  -5.956  33.516
  708    HA   HIS  87           HA       HIS  87  11.538  -8.558  32.366
  709    HB2  HIS  87           2HB      HIS  87  13.908  -9.277  32.526
  710    HB3  HIS  87           3HB      HIS  87  13.748  -7.964  31.365
  711    HD1  HIS  87           HD1      HIS  87  15.613  -8.973  34.333
  712    HD2  HIS  87           HD2      HIS  87  14.699  -5.387  32.440
  713    HE1  HIS  87           HE1      HIS  87  17.290  -7.312  35.178
  714    HE2  HIS  87           HE2      HIS  87  16.856  -5.231  33.858
  715    H    HIS  88           H        HIS  88  12.801 -10.122  34.163
  716    HA   HIS  88           HA       HIS  88  11.810  -9.393  36.773
  717    HB2  HIS  88           2HB      HIS  88  13.503 -11.781  35.878
  718    HB3  HIS  88           3HB      HIS  88  12.905 -11.558  37.520
  719    HD1  HIS  88           HD1      HIS  88  10.034 -10.933  37.240
  720    HD2  HIS  88           HD2      HIS  88  11.912 -13.656  34.725
  721    HE1  HIS  88           HE1      HIS  88   8.210 -12.415  36.364
  722    HE2  HIS  88           HE2      HIS  88   9.344 -13.918  34.707
  Start of MODEL   15
    1    H1   MET   1           1H       MET   1  12.241  10.469  11.543
    2    H2   MET   1           2H       MET   1  11.622   9.264  10.533
    3    H3   MET   1           3H       MET   1  12.545   8.836  11.882
    4    HA   MET   1           HA       MET   1  10.902   9.680  13.367
    5    HB2  MET   1           2HB      MET   1   8.783  10.574  12.606
    6    HB3  MET   1           3HB      MET   1  10.063  11.475  11.819
    7    HG2  MET   1           2HG      MET   1   9.676  10.131   9.748
    8    HG3  MET   1           3HG      MET   1   8.325   9.337  10.556
    9    HE1  MET   1           3HE      MET   1   7.100  11.913  12.238
   10    HE2  MET   1           1HE      MET   1   6.110  10.709  11.408
   11    HE3  MET   1           2HE      MET   1   5.872  12.425  11.082
   12    H    GLY   2           H        GLY   2  10.824   7.680  10.527
   13    HA2  GLY   2           2HA      GLY   2  10.380   5.248  11.111
   14    HA3  GLY   2           3HA      GLY   2   8.820   5.838  11.670
   15    H    GLU   3           H        GLU   3  10.615   4.773   9.006
   16    HA   GLU   3           HA       GLU   3   8.672   5.649   6.990
   17    HB2  GLU   3           2HB      GLU   3  11.128   5.715   6.455
   18    HB3  GLU   3           3HB      GLU   3  11.218   3.972   6.680
   19    HG2  GLU   3           2HG      GLU   3   9.521   3.742   4.789
   20    HG3  GLU   3           3HG      GLU   3   9.707   5.471   4.505
   21    H    MET   4           H        MET   4   7.373   4.169   5.882
   22    HA   MET   4           HA       MET   4   7.519   1.284   6.532
   23    HB2  MET   4           2HB      MET   4   5.518   2.287   7.668
   24    HB3  MET   4           3HB      MET   4   4.964   2.918   6.125
   25    HG2  MET   4           2HG      MET   4   4.728   0.595   5.287
   26    HG3  MET   4           3HG      MET   4   5.230  -0.003   6.874
   27    HE1  MET   4           3HE      MET   4   3.101  -1.448   7.256
   28    HE2  MET   4           1HE      MET   4   2.555  -1.032   5.628
   29    HE3  MET   4           2HE      MET   4   1.459  -0.863   6.997
   30    H    ASP   5           H        ASP   5   7.364  -0.021   4.676
   31    HA   ASP   5           HA       ASP   5   6.766   1.296   2.109
   32    HB2  ASP   5           2HB      ASP   5   8.450  -0.184   1.029
   33    HB3  ASP   5           3HB      ASP   5   9.188   0.909   2.191
   34    H    ILE   6           H        ILE   6   5.069   0.419   1.197
   35    HA   ILE   6           HA       ILE   6   3.914  -2.097   2.244
   36    HB   ILE   6           HB       ILE   6   2.484   0.223   0.852
   37   HG12  ILE   6          2HG1      ILE   6   2.603  -0.390   3.840
   38   HG13  ILE   6          3HG1      ILE   6   3.449   0.931   3.044
   39   HG21  ILE   6          1HG2      ILE   6   0.409  -0.845   1.676
   40   HG22  ILE   6          2HG2      ILE   6   1.359  -2.166   2.354
   41   HG23  ILE   6          3HG2      ILE   6   1.312  -1.923   0.607
   42   HD11  ILE   6          3HD1      ILE   6   1.269   1.877   2.385
   43   HD12  ILE   6          1HD1      ILE   6   1.510   1.771   4.127
   44   HD13  ILE   6          2HD1      ILE   6   0.472   0.603   3.315
   45    H    ARG   7           H        ARG   7   4.164  -3.740   0.808
   46    HA   ARG   7           HA       ARG   7   4.689  -3.081  -2.036
   47    HB2  ARG   7           2HB      ARG   7   6.674  -3.799  -0.584
   48    HB3  ARG   7           3HB      ARG   7   5.915  -5.378  -0.442
   49    HG2  ARG   7           2HG      ARG   7   6.141  -5.754  -2.840
   50    HG3  ARG   7           3HG      ARG   7   6.737  -4.109  -3.073
   51    HD2  ARG   7           2HD      ARG   7   8.653  -4.762  -1.469
   52    HD3  ARG   7           3HD      ARG   7   8.127  -6.431  -1.717
   53    HE   ARG   7           HE       ARG   7   8.409  -5.571  -4.244
   54   HH11  ARG   7          1HH1      ARG   7  10.601  -5.325  -1.487
   55   HH12  ARG   7          2HH1      ARG   7  12.026  -5.341  -2.474
   56   HH21  ARG   7          1HH2      ARG   7  10.299  -5.535  -5.509
   57   HH22  ARG   7          2HH2      ARG   7  11.855  -5.460  -4.741
   58    H    PHE   8           H        PHE   8   3.088  -3.779  -3.272
   59    HA   PHE   8           HA       PHE   8   1.435  -6.117  -2.527
   60    HB2  PHE   8           2HB      PHE   8   0.929  -3.771  -4.416
   61    HB3  PHE   8           3HB      PHE   8  -0.097  -5.200  -4.387
   62    HD1  PHE   8           HD2      PHE   8  -1.494  -5.704  -2.402
   63    HD2  PHE   8           HD1      PHE   8   0.762  -2.077  -2.688
   64    HE1  PHE   8           HE2      PHE   8  -2.859  -4.710  -0.617
   65    HE2  PHE   8           HE1      PHE   8  -0.603  -1.108  -0.906
   66    HZ   PHE   8           HZ       PHE   8  -2.414  -2.410   0.132
   67    H    ARG   9           H        ARG   9   1.805  -7.917  -3.623
   68    HA   ARG   9           HA       ARG   9   3.032  -7.826  -6.312
   69    HB2  ARG   9           2HB      ARG   9   4.666  -8.454  -4.468
   70    HB3  ARG   9           3HB      ARG   9   3.663  -9.857  -4.122
   71    HG2  ARG   9           2HG      ARG   9   4.100 -10.730  -6.393
   72    HG3  ARG   9           3HG      ARG   9   5.094  -9.311  -6.742
   73    HD2  ARG   9           2HD      ARG   9   6.638  -9.962  -4.907
   74    HD3  ARG   9           3HD      ARG   9   5.645 -11.393  -4.601
   75    HE   ARG   9           HE       ARG   9   6.559 -11.222  -7.314
   76   HH11  ARG   9          1HH1      ARG   9   7.504 -12.282  -4.095
   77   HH12  ARG   9          2HH1      ARG   9   8.660 -13.429  -4.684
   78   HH21  ARG   9          1HH2      ARG   9   8.092 -12.696  -8.065
   79   HH22  ARG   9          2HH2      ARG   9   8.991 -13.662  -6.939
   80    H    GLY  10           H        GLY  10   1.632  -8.682  -7.718
   81    HA2  GLY  10           2HA      GLY  10   0.086 -11.066  -7.209
   82    HA3  GLY  10           3HA      GLY  10  -0.890  -9.597  -7.212
   83    H    ASP  11           H        ASP  11  -1.122 -11.768  -8.995
   84    HA   ASP  11           HA       ASP  11   0.335 -11.676 -11.381
   85    HB2  ASP  11           2HB      ASP  11  -0.911 -13.648 -10.646
   86    HB3  ASP  11           3HB      ASP  11  -2.439 -12.791 -10.796
   87    H    ASP  12           H        ASP  12  -2.442  -9.798 -10.397
   88    HA   ASP  12           HA       ASP  12  -2.952  -8.855 -13.153
   89    HB2  ASP  12           2HB      ASP  12  -4.877  -9.806 -11.739
   90    HB3  ASP  12           3HB      ASP  12  -4.736  -8.379 -10.724
   91    H    LEU  13           H        LEU  13  -1.799  -7.105 -13.639
   92    HA   LEU  13           HA       LEU  13  -0.486  -5.381 -11.865
   93    HB2  LEU  13           2HB      LEU  13   0.270  -5.723 -14.162
   94    HB3  LEU  13           3HB      LEU  13  -1.203  -5.010 -14.790
   95    HG   LEU  13           HG       LEU  13  -0.520  -2.793 -13.848
   96   HD11  LEU  13          1HD1      LEU  13   1.767  -2.416 -13.037
   97   HD12  LEU  13          2HD1      LEU  13   2.078  -4.154 -13.080
   98   HD13  LEU  13          3HD1      LEU  13   0.863  -3.498 -11.978
   99   HD21  LEU  13          3HD2      LEU  13   1.509  -4.035 -15.728
  100   HD22  LEU  13          1HD2      LEU  13   1.237  -2.305 -15.494
  101   HD23  LEU  13          2HD2      LEU  13  -0.037  -3.310 -16.179
  102    H    GLU  14           H        GLU  14  -3.710  -5.147 -13.263
  103    HA   GLU  14           HA       GLU  14  -4.018  -2.323 -12.683
  104    HB2  GLU  14           2HB      GLU  14  -6.060  -4.378 -13.625
  105    HB3  GLU  14           3HB      GLU  14  -6.382  -2.657 -13.444
  106    HG2  GLU  14           2HG      GLU  14  -4.406  -3.914 -15.368
  107    HG3  GLU  14           3HG      GLU  14  -5.967  -3.205 -15.781
  108    H    ALA  15           H        ALA  15  -4.768  -5.388 -11.139
  109    HA   ALA  15           HA       ALA  15  -6.435  -4.462  -9.033
  110    HB1  ALA  15           3HB      ALA  15  -4.526  -6.829  -9.215
  111    HB2  ALA  15           1HB      ALA  15  -6.255  -6.835  -9.567
  112    HB3  ALA  15           2HB      ALA  15  -5.690  -6.587  -7.917
  113    H    LEU  16           H        LEU  16  -2.925  -4.692  -9.488
  114    HA   LEU  16           HA       LEU  16  -2.082  -3.778  -6.936
  115    HB2  LEU  16           2HB      LEU  16  -0.630  -3.484  -9.598
  116    HB3  LEU  16           3HB      LEU  16   0.101  -3.329  -8.008
  117    HG   LEU  16           HG       LEU  16  -1.027  -5.886  -9.207
  118   HD11  LEU  16          1HD1      LEU  16   1.851  -5.077  -8.710
  119   HD12  LEU  16          2HD1      LEU  16   1.048  -5.186 -10.280
  120   HD13  LEU  16          3HD1      LEU  16   1.296  -6.642  -9.321
  121   HD21  LEU  16          3HD2      LEU  16  -1.343  -5.872  -6.778
  122   HD22  LEU  16          1HD2      LEU  16   0.366  -5.495  -6.535
  123   HD23  LEU  16          2HD2      LEU  16  -0.112  -7.042  -7.244
  124    H    GLU  17           H        GLU  17  -2.899  -2.154  -9.979
  125    HA   GLU  17           HA       GLU  17  -2.157   0.488  -9.306
  126    HB2  GLU  17           2HB      GLU  17  -4.050  -0.659 -11.387
  127    HB3  GLU  17           3HB      GLU  17  -3.795   1.072 -11.236
  128    HG2  GLU  17           2HG      GLU  17  -1.551  -0.901 -11.740
  129    HG3  GLU  17           3HG      GLU  17  -2.430  -0.075 -13.023
  130    H    LYS  18           H        LYS  18  -5.230  -1.273  -8.862
  131    HA   LYS  18           HA       LYS  18  -6.715   1.007  -7.919
  132    HB2  LYS  18           2HB      LYS  18  -7.262  -1.960  -8.004
  133    HB3  LYS  18           3HB      LYS  18  -8.207  -0.985  -6.893
  134    HG2  LYS  18           2HG      LYS  18  -9.521  -1.196  -8.835
  135    HG3  LYS  18           3HG      LYS  18  -8.886   0.447  -8.876
  136    HD2  LYS  18           2HD      LYS  18  -7.250  -0.176 -10.562
  137    HD3  LYS  18           3HD      LYS  18  -7.677  -1.880 -10.401
  138    HE2  LYS  18           2HE      LYS  18  -9.584   0.256 -11.405
  139    HE3  LYS  18           3HE      LYS  18  -8.624  -0.795 -12.450
  140    HZ1  LYS  18           3HZ      LYS  18 -10.674  -1.693 -10.494
  141    HZ2  LYS  18           1HZ      LYS  18  -9.731  -2.712 -11.470
  142    HZ3  LYS  18           2HZ      LYS  18 -10.849  -1.659 -12.174
  143    H    ALA  19           H        ALA  19  -4.869  -1.626  -6.366
  144    HA   ALA  19           HA       ALA  19  -5.375  -0.935  -3.669
  145    HB1  ALA  19           3HB      ALA  19  -3.378  -2.286  -3.153
  146    HB2  ALA  19           1HB      ALA  19  -2.932  -2.300  -4.864
  147    HB3  ALA  19           2HB      ALA  19  -4.406  -3.110  -4.328
  148    H    LEU  20           H        LEU  20  -2.799  -0.012  -5.932
  149    HA   LEU  20           HA       LEU  20  -1.275   1.721  -4.372
  150    HB2  LEU  20           2HB      LEU  20  -0.561   0.829  -6.541
  151    HB3  LEU  20           3HB      LEU  20  -1.821   1.720  -7.367
  152    HG   LEU  20           HG       LEU  20  -0.683   3.843  -6.940
  153   HD11  LEU  20          1HD1      LEU  20   0.228   3.415  -4.721
  154   HD12  LEU  20          2HD1      LEU  20   1.479   3.996  -5.816
  155   HD13  LEU  20          3HD1      LEU  20   1.403   2.282  -5.396
  156   HD21  LEU  20          3HD2      LEU  20   1.284   1.782  -7.987
  157   HD22  LEU  20          1HD2      LEU  20   1.330   3.524  -8.285
  158   HD23  LEU  20          2HD2      LEU  20   0.003   2.556  -8.923
  159    H    LYS  21           H        LYS  21  -4.081   2.398  -6.457
  160    HA   LYS  21           HA       LYS  21  -4.370   5.149  -6.173
  161    HB2  LYS  21           2HB      LYS  21  -5.793   3.970  -7.722
  162    HB3  LYS  21           3HB      LYS  21  -6.433   2.931  -6.457
  163    HG2  LYS  21           2HG      LYS  21  -7.620   4.894  -5.468
  164    HG3  LYS  21           3HG      LYS  21  -6.991   5.905  -6.771
  165    HD2  LYS  21           2HD      LYS  21  -9.318   5.239  -7.209
  166    HD3  LYS  21           3HD      LYS  21  -8.232   4.571  -8.431
  167    HE2  LYS  21           2HE      LYS  21  -9.925   2.920  -7.739
  168    HE3  LYS  21           3HE      LYS  21  -8.311   2.374  -7.279
  169    HZ1  LYS  21           3HZ      LYS  21  -8.757   3.150  -5.023
  170    HZ2  LYS  21           1HZ      LYS  21  -9.907   2.022  -5.518
  171    HZ3  LYS  21           2HZ      LYS  21 -10.302   3.656  -5.483
  172    H    GLU  22           H        GLU  22  -5.559   2.519  -4.109
  173    HA   GLU  22           HA       GLU  22  -6.847   4.154  -2.193
  174    HB2  GLU  22           2HB      GLU  22  -5.943   1.264  -2.136
  175    HB3  GLU  22           3HB      GLU  22  -6.718   2.018  -0.753
  176    HG2  GLU  22           2HG      GLU  22  -7.932   1.693  -3.506
  177    HG3  GLU  22           3HG      GLU  22  -8.334   0.750  -2.072
  178    H    MET  23           H        MET  23  -3.539   2.651  -2.168
  179    HA   MET  23           HA       MET  23  -3.072   3.498   0.549
  180    HB2  MET  23           2HB      MET  23  -0.969   2.578  -1.453
  181    HB3  MET  23           3HB      MET  23  -0.807   2.649   0.301
  182    HG2  MET  23           2HG      MET  23  -2.544   0.791  -1.314
  183    HG3  MET  23           3HG      MET  23  -1.206   0.376  -0.254
  184    HE1  MET  23           3HE      MET  23  -2.770   0.744   3.289
  185    HE2  MET  23           1HE      MET  23  -1.683   1.853   2.453
  186    HE3  MET  23           2HE      MET  23  -1.421   0.112   2.347
  187    H    ILE  24           H        ILE  24  -2.331   4.960  -2.589
  188    HA   ILE  24           HA       ILE  24  -0.860   7.190  -1.618
  189    HB   ILE  24           HB       ILE  24  -2.701   6.963  -4.056
  190   HG12  ILE  24          2HG1      ILE  24   0.349   6.907  -3.843
  191   HG13  ILE  24          3HG1      ILE  24  -0.684   5.526  -4.182
  192   HG21  ILE  24          1HG2      ILE  24  -1.694   9.070  -4.896
  193   HG22  ILE  24          2HG2      ILE  24  -0.816   9.254  -3.378
  194   HG23  ILE  24          3HG2      ILE  24  -2.577   9.333  -3.390
  195   HD11  ILE  24          3HD1      ILE  24   0.386   6.291  -6.199
  196   HD12  ILE  24          1HD1      ILE  24  -0.264   7.916  -5.977
  197   HD13  ILE  24          2HD1      ILE  24  -1.351   6.566  -6.307
  198    H    ARG  25           H        ARG  25  -4.339   6.640  -2.189
  199    HA   ARG  25           HA       ARG  25  -5.439   9.031  -1.287
  200    HB2  ARG  25           2HB      ARG  25  -6.793   7.471  -2.519
  201    HB3  ARG  25           3HB      ARG  25  -6.487   6.185  -1.368
  202    HG2  ARG  25           2HG      ARG  25  -7.888   7.355   0.309
  203    HG3  ARG  25           3HG      ARG  25  -8.221   8.621  -0.874
  204    HD2  ARG  25           2HD      ARG  25  -9.315   6.968  -2.350
  205    HD3  ARG  25           3HD      ARG  25  -8.948   5.682  -1.190
  206    HE   ARG  25           HE       ARG  25 -10.473   7.891  -0.106
  207   HH11  ARG  25          1HH1      ARG  25 -10.729   4.738  -1.683
  208   HH12  ARG  25          2HH1      ARG  25 -12.344   4.461  -1.109
  209   HH21  ARG  25          1HH2      ARG  25 -12.565   7.466   0.672
  210   HH22  ARG  25          2HH2      ARG  25 -13.373   6.000   0.222
  211    H    GLN  26           H        GLN  26  -4.415   6.204   0.616
  212    HA   GLN  26           HA       GLN  26  -5.574   7.145   3.083
  213    HB2  GLN  26           2HB      GLN  26  -3.343   5.083   2.913
  214    HB3  GLN  26           3HB      GLN  26  -4.531   5.280   4.185
  215    HG2  GLN  26           2HG      GLN  26  -4.870   4.010   1.472
  216    HG3  GLN  26           3HG      GLN  26  -5.160   3.311   3.056
  217   HE21  GLN  26          1HE2      GLN  26  -6.919   3.331   0.734
  218   HE22  GLN  26          2HE2      GLN  26  -8.374   4.130   1.205
  219    H    ALA  27           H        ALA  27  -2.307   7.126   1.644
  220    HA   ALA  27           HA       ALA  27  -0.882   8.498   3.648
  221    HB1  ALA  27           3HB      ALA  27  -0.456   8.573   0.635
  222    HB2  ALA  27           1HB      ALA  27   0.208   7.367   1.741
  223    HB3  ALA  27           2HB      ALA  27   0.732   9.049   1.852
  224    H    ARG  28           H        ARG  28  -3.045   9.651   1.137
  225    HA   ARG  28           HA       ARG  28  -2.442  12.445   1.347
  226    HB2  ARG  28           2HB      ARG  28  -4.786  10.954   0.099
  227    HB3  ARG  28           3HB      ARG  28  -4.611  12.702   0.014
  228    HG2  ARG  28           2HG      ARG  28  -2.576  10.738  -1.087
  229    HG3  ARG  28           3HG      ARG  28  -3.852  11.475  -2.043
  230    HD2  ARG  28           2HD      ARG  28  -2.902  13.716  -1.541
  231    HD3  ARG  28           3HD      ARG  28  -1.603  12.943  -0.628
  232    HE   ARG  28           HE       ARG  28  -1.191  11.746  -2.894
  233   HH11  ARG  28          1HH1      ARG  28  -2.127  15.121  -2.544
  234   HH12  ARG  28          2HH1      ARG  28  -1.350  15.608  -4.015
  235   HH21  ARG  28          1HH2      ARG  28  -0.183  12.411  -4.821
  236   HH22  ARG  28          2HH2      ARG  28  -0.250  14.075  -5.297
  237    H    LYS  29           H        LYS  29  -4.995  10.303   2.717
  238    HA   LYS  29           HA       LYS  29  -6.495  12.444   3.897
  239    HB2  LYS  29           2HB      LYS  29  -7.905  10.794   4.882
  240    HB3  LYS  29           3HB      LYS  29  -7.407  10.103   3.346
  241    HG2  LYS  29           2HG      LYS  29  -5.710   8.742   4.552
  242    HG3  LYS  29           3HG      LYS  29  -6.298   9.395   6.079
  243    HD2  LYS  29           2HD      LYS  29  -8.533   8.373   5.615
  244    HD3  LYS  29           3HD      LYS  29  -7.887   7.687   4.119
  245    HE2  LYS  29           2HE      LYS  29  -6.192   6.445   5.490
  246    HE3  LYS  29           3HE      LYS  29  -6.978   7.051   6.949
  247    HZ1  LYS  29           3HZ      LYS  29  -9.002   5.925   6.274
  248    HZ2  LYS  29           1HZ      LYS  29  -7.715   4.835   6.393
  249    HZ3  LYS  29           2HZ      LYS  29  -8.242   5.356   4.878
  250    H    PHE  30           H        PHE  30  -3.747  10.557   4.919
  251    HA   PHE  30           HA       PHE  30  -3.767  11.517   7.678
  252    HB2  PHE  30           2HB      PHE  30  -1.897   9.713   6.090
  253    HB3  PHE  30           3HB      PHE  30  -1.498  10.254   7.715
  254    HD1  PHE  30           HD1      PHE  30  -3.647   9.972   9.409
  255    HD2  PHE  30           HD2      PHE  30  -2.765   7.520   6.010
  256    HE1  PHE  30           HE1      PHE  30  -4.869   8.101  10.427
  257    HE2  PHE  30           HE2      PHE  30  -4.004   5.661   7.039
  258    HZ   PHE  30           HZ       PHE  30  -5.046   5.951   9.244
  259    H    ALA  31           H        ALA  31  -2.662  12.709   4.703
  260    HA   ALA  31           HA       ALA  31  -1.286  14.324   3.971
  261    HB1  ALA  31           3HB      ALA  31  -2.475  15.765   5.585
  262    HB2  ALA  31           1HB      ALA  31  -0.793  16.261   5.390
  263    HB3  ALA  31           2HB      ALA  31  -1.289  15.362   6.826
  264    H    GLY  32           H        GLY  32   0.173  12.537   3.613
  265    HA2  GLY  32           2HA      GLY  32   2.825  13.035   4.845
  266    HA3  GLY  32           3HA      GLY  32   2.218  11.383   4.685
  267    H    THR  33           H        THR  33   4.293  11.268   3.384
  268    HA   THR  33           HA       THR  33   3.956  12.211   0.599
  269    HB   THR  33           HB       THR  33   6.486  11.475   2.148
  270    HG1  THR  33           HG1      THR  33   6.685  13.901   1.280
  271   HG21  THR  33          3HG2      THR  33   6.750  10.848  -0.240
  272   HG22  THR  33          1HG2      THR  33   7.759  12.241   0.172
  273   HG23  THR  33          2HG2      THR  33   6.256  12.472  -0.719
  274    H    VAL  34           H        VAL  34   4.030  10.659  -1.049
  275    HA   VAL  34           HA       VAL  34   4.416   7.831  -0.311
  276    HB   VAL  34           HB       VAL  34   1.989   8.244  -0.274
  277   HG11  VAL  34          1HG1      VAL  34   1.841  10.164  -1.783
  278   HG12  VAL  34          2HG1      VAL  34   0.711   8.898  -2.263
  279   HG13  VAL  34          3HG1      VAL  34   2.210   9.130  -3.166
  280   HG21  VAL  34          3HG2      VAL  34   1.249   6.465  -1.827
  281   HG22  VAL  34          1HG2      VAL  34   2.741   6.023  -0.993
  282   HG23  VAL  34          2HG2      VAL  34   2.795   6.556  -2.675
  283    H    THR  35           H        THR  35   5.492   6.663  -1.762
  284    HA   THR  35           HA       THR  35   6.006   7.618  -4.523
  285    HB   THR  35           HB       THR  35   8.067   6.387  -2.609
  286    HG1  THR  35           HG1      THR  35   7.446   9.021  -3.303
  287   HG21  THR  35          3HG2      THR  35   8.538   5.742  -4.953
  288   HG22  THR  35          1HG2      THR  35   9.751   6.872  -4.344
  289   HG23  THR  35          2HG2      THR  35   8.485   7.439  -5.436
  290    H    TYR  36           H        TYR  36   6.509   5.732  -5.988
  291    HA   TYR  36           HA       TYR  36   6.215   3.053  -4.882
  292    HB2  TYR  36           2HB      TYR  36   4.398   2.371  -6.369
  293    HB3  TYR  36           3HB      TYR  36   3.872   3.687  -5.335
  294    HD1  TYR  36           HD2      TYR  36   3.365   5.923  -6.298
  295    HD2  TYR  36           HD1      TYR  36   4.600   2.688  -8.824
  296    HE1  TYR  36           HE2      TYR  36   2.580   7.160  -8.278
  297    HE2  TYR  36           HE1      TYR  36   3.807   3.933 -10.791
  298    HH   TYR  36           HH       TYR  36   2.210   5.701 -11.327
  299    H    THR  37           H        THR  37   6.825   1.389  -6.322
  300    HA   THR  37           HA       THR  37   8.041   2.138  -8.917
  301    HB   THR  37           HB       THR  37   9.244   0.248  -6.838
  302    HG1  THR  37           HG1      THR  37   9.764   2.896  -7.628
  303   HG21  THR  37          3HG2      THR  37   9.730  -0.595  -9.103
  304   HG22  THR  37          1HG2      THR  37  11.192   0.087  -8.383
  305   HG23  THR  37          2HG2      THR  37  10.296   1.002  -9.596
  306    H    LEU  38           H        LEU  38   6.831   1.128 -10.422
  307    HA   LEU  38           HA       LEU  38   5.586  -1.490  -9.987
  308    HB2  LEU  38           2HB      LEU  38   5.536   0.429 -12.354
  309    HB3  LEU  38           3HB      LEU  38   4.678  -1.102 -12.327
  310    HG   LEU  38           HG       LEU  38   4.119   1.198 -10.415
  311   HD11  LEU  38          1HD1      LEU  38   2.090   1.606 -11.744
  312   HD12  LEU  38          2HD1      LEU  38   2.610   0.398 -12.922
  313   HD13  LEU  38          3HD1      LEU  38   3.555   1.872 -12.687
  314   HD21  LEU  38          3HD2      LEU  38   3.523  -0.973  -9.477
  315   HD22  LEU  38          1HD2      LEU  38   2.590  -1.372 -10.928
  316   HD23  LEU  38          2HD2      LEU  38   2.072  -0.052  -9.875
  317    H    ASP  39           H        ASP  39   6.458  -3.357 -10.769
  318    HA   ASP  39           HA       ASP  39   8.022  -3.440 -13.210
  319    HB2  ASP  39           2HB      ASP  39   9.798  -3.096 -11.482
  320    HB3  ASP  39           3HB      ASP  39   9.223  -4.507 -10.599
  321    H    GLY  40           H        GLY  40   6.529  -4.733 -14.167
  322    HA2  GLY  40           2HA      GLY  40   5.469  -6.647 -14.808
  323    HA3  GLY  40           3HA      GLY  40   6.469  -7.524 -13.660
  324    H    ASN  41           H        ASN  41   5.580  -8.211 -11.807
  325    HA   ASN  41           HA       ASN  41   2.744  -7.582 -11.192
  326    HB2  ASN  41           2HB      ASN  41   4.337 -10.144 -10.726
  327    HB3  ASN  41           3HB      ASN  41   2.706  -9.874 -10.123
  328   HD21  ASN  41          1HD2      ASN  41   1.603  -8.584 -12.395
  329   HD22  ASN  41          2HD2      ASN  41   1.496  -9.759 -13.654
  330    H    ASP  42           H        ASP  42   5.477  -6.419 -10.232
  331    HA   ASP  42           HA       ASP  42   4.967  -6.665  -7.313
  332    HB2  ASP  42           2HB      ASP  42   7.144  -7.669  -8.059
  333    HB3  ASP  42           3HB      ASP  42   7.635  -6.105  -8.697
  334    H    LEU  43           H        LEU  43   4.604  -4.866  -6.254
  335    HA   LEU  43           HA       LEU  43   5.126  -2.175  -7.381
  336    HB2  LEU  43           2HB      LEU  43   2.769  -2.520  -7.726
  337    HB3  LEU  43           3HB      LEU  43   2.580  -3.331  -6.181
  338    HG   LEU  43           HG       LEU  43   2.957  -1.134  -5.016
  339   HD11  LEU  43          1HD1      LEU  43   2.803   0.969  -6.241
  340   HD12  LEU  43          2HD1      LEU  43   2.844   0.096  -7.772
  341   HD13  LEU  43          3HD1      LEU  43   4.240   0.055  -6.695
  342   HD21  LEU  43          3HD2      LEU  43   0.735  -0.245  -5.434
  343   HD22  LEU  43          1HD2      LEU  43   0.705  -2.007  -5.406
  344   HD23  LEU  43          2HD2      LEU  43   0.628  -1.150  -6.948
  345    H    GLU  44           H        GLU  44   6.611  -1.303  -6.000
  346    HA   GLU  44           HA       GLU  44   6.448  -1.858  -3.089
  347    HB2  GLU  44           2HB      GLU  44   8.598  -2.467  -4.178
  348    HB3  GLU  44           3HB      GLU  44   8.792  -0.805  -4.729
  349    HG2  GLU  44           2HG      GLU  44   8.894  -0.058  -2.341
  350    HG3  GLU  44           3HG      GLU  44   8.774  -1.742  -1.834
  351    H    ILE  45           H        ILE  45   5.090  -0.350  -2.309
  352    HA   ILE  45           HA       ILE  45   5.267   2.508  -3.004
  353    HB   ILE  45           HB       ILE  45   3.460   1.083  -0.980
  354   HG12  ILE  45          2HG1      ILE  45   2.711   1.939  -3.808
  355   HG13  ILE  45          3HG1      ILE  45   3.116   0.290  -3.349
  356   HG21  ILE  45          1HG2      ILE  45   2.048   3.103  -1.031
  357   HG22  ILE  45          2HG2      ILE  45   3.184   3.873  -2.138
  358   HG23  ILE  45          3HG2      ILE  45   3.688   3.483  -0.493
  359   HD11  ILE  45          3HD1      ILE  45   0.731   0.573  -3.507
  360   HD12  ILE  45          1HD1      ILE  45   0.768   1.882  -2.326
  361   HD13  ILE  45          2HD1      ILE  45   1.193   0.239  -1.839
  362    H    ARG  46           H        ARG  46   6.219   4.017  -1.565
  363    HA   ARG  46           HA       ARG  46   6.948   3.121   1.176
  364    HB2  ARG  46           2HB      ARG  46   8.590   4.962  -0.625
  365    HB3  ARG  46           3HB      ARG  46   8.961   4.593   1.054
  366    HG2  ARG  46           2HG      ARG  46   9.288   2.210   0.438
  367    HG3  ARG  46           3HG      ARG  46   8.967   2.617  -1.249
  368    HD2  ARG  46           2HD      ARG  46  11.275   3.623   0.450
  369    HD3  ARG  46           3HD      ARG  46  11.366   2.465  -0.880
  370    HE   ARG  46           HE       ARG  46  10.413   5.212  -1.383
  371   HH11  ARG  46          1HH1      ARG  46  12.899   2.762  -1.965
  372   HH12  ARG  46          2HH1      ARG  46  13.635   3.672  -3.244
  373   HH21  ARG  46          1HH2      ARG  46  11.420   6.371  -3.045
  374   HH22  ARG  46          2HH2      ARG  46  12.797   5.700  -3.850
  375    H    ILE  47           H        ILE  47   5.886   4.234   2.606
  376    HA   ILE  47           HA       ILE  47   4.969   7.005   2.098
  377    HB   ILE  47           HB       ILE  47   3.701   4.946   3.966
  378   HG12  ILE  47          2HG1      ILE  47   2.750   6.024   1.273
  379   HG13  ILE  47          3HG1      ILE  47   3.287   4.383   1.602
  380   HG21  ILE  47          1HG2      ILE  47   1.898   6.614   4.303
  381   HG22  ILE  47          2HG2      ILE  47   2.781   7.771   3.305
  382   HG23  ILE  47          3HG2      ILE  47   3.458   7.241   4.847
  383   HD11  ILE  47          3HD1      ILE  47   0.900   4.459   1.410
  384   HD12  ILE  47          1HD1      ILE  47   0.788   5.690   2.668
  385   HD13  ILE  47          2HD1      ILE  47   1.347   4.064   3.068
  386    H    THR  48           H        THR  48   5.847   8.504   3.321
  387    HA   THR  48           HA       THR  48   7.100   7.941   5.929
  388    HB   THR  48           HB       THR  48   8.467   9.564   3.725
  389    HG1  THR  48           HG1      THR  48   8.665   6.833   4.388
  390   HG21  THR  48          3HG2      THR  48   9.175  10.206   6.014
  391   HG22  THR  48          1HG2      THR  48  10.488   9.414   5.131
  392   HG23  THR  48          2HG2      THR  48   9.581   8.523   6.353
  393    H    GLY  49           H        GLY  49   7.376   9.956   7.191
  394    HA2  GLY  49           2HA      GLY  49   6.914  12.185   7.745
  395    HA3  GLY  49           3HA      GLY  49   5.897  12.345   6.321
  396    H    VAL  50           H        VAL  50   5.307   9.498   8.048
  397    HA   VAL  50           HA       VAL  50   2.988  10.628   9.495
  398    HB   VAL  50           HB       VAL  50   1.775   8.491   8.999
  399   HG11  VAL  50          1HG1      VAL  50   1.330  10.437   7.579
  400   HG12  VAL  50          2HG1      VAL  50   1.217   8.954   6.630
  401   HG13  VAL  50          3HG1      VAL  50   2.647   9.982   6.495
  402   HG21  VAL  50          3HG2      VAL  50   4.101   7.846   7.144
  403   HG22  VAL  50          1HG2      VAL  50   2.593   6.930   7.257
  404   HG23  VAL  50          2HG2      VAL  50   3.694   6.994   8.634
  405    HA   PRO  51           HA       PRO  51   4.852   8.584  13.119
  406    HB2  PRO  51           2HB      PRO  51   2.596   8.440  14.744
  407    HB3  PRO  51           3HB      PRO  51   3.551   9.916  14.510
  408    HG2  PRO  51           2HG      PRO  51   0.990   9.111  13.196
  409    HG3  PRO  51           3HG      PRO  51   1.482  10.702  13.812
  410    HD2  PRO  51           2HD      PRO  51   1.562  10.107  11.162
  411    HD3  PRO  51           3HD      PRO  51   2.745  11.203  11.911
  412    H    GLU  52           H        GLU  52   4.395   6.638  14.586
  413    HA   GLU  52           HA       GLU  52   4.288   4.347  12.911
  414    HB2  GLU  52           2HB      GLU  52   5.757   4.442  14.902
  415    HB3  GLU  52           3HB      GLU  52   4.344   4.463  15.958
  416    HG2  GLU  52           2HG      GLU  52   3.693   2.219  15.063
  417    HG3  GLU  52           3HG      GLU  52   5.172   2.196  14.105
  418    H    GLN  53           H        GLN  53   2.011   5.681  15.304
  419    HA   GLN  53           HA       GLN  53   0.085   3.688  15.434
  420    HB2  GLN  53           2HB      GLN  53  -1.557   5.490  15.962
  421    HB3  GLN  53           3HB      GLN  53  -0.057   5.667  16.861
  422    HG2  GLN  53           2HG      GLN  53   0.644   7.530  15.551
  423    HG3  GLN  53           3HG      GLN  53  -0.584   7.232  14.321
  424   HE21  GLN  53          1HE2      GLN  53  -2.731   7.880  14.728
  425   HE22  GLN  53          2HE2      GLN  53  -3.135   8.981  15.998
  426    H    VAL  54           H        VAL  54   0.633   6.101  12.964
  427    HA   VAL  54           HA       VAL  54  -1.684   5.578  11.367
  428    HB   VAL  54           HB       VAL  54   0.885   7.141  10.876
  429   HG11  VAL  54          1HG1      VAL  54  -0.218   8.129   8.884
  430   HG12  VAL  54          2HG1      VAL  54  -1.534   6.965   9.054
  431   HG13  VAL  54          3HG1      VAL  54   0.099   6.404   8.688
  432   HG21  VAL  54          3HG2      VAL  54  -1.959   8.073  11.404
  433   HG22  VAL  54          1HG2      VAL  54  -0.558   9.120  11.145
  434   HG23  VAL  54          2HG2      VAL  54  -0.638   8.085  12.573
  435    H    ARG  55           H        ARG  55   1.783   4.681  11.198
  436    HA   ARG  55           HA       ARG  55   1.726   3.307   8.737
  437    HB2  ARG  55           2HB      ARG  55   3.577   2.960  11.134
  438    HB3  ARG  55           3HB      ARG  55   3.839   2.185   9.574
  439    HG2  ARG  55           2HG      ARG  55   3.900   4.469   8.522
  440    HG3  ARG  55           3HG      ARG  55   3.818   5.167  10.138
  441    HD2  ARG  55           2HD      ARG  55   6.016   3.308   9.166
  442    HD3  ARG  55           3HD      ARG  55   6.129   5.067   9.194
  443    HE   ARG  55           HE       ARG  55   5.841   4.896  11.668
  444   HH11  ARG  55          1HH1      ARG  55   7.180   2.136   9.912
  445   HH12  ARG  55          2HH1      ARG  55   8.053   1.539  11.284
  446   HH21  ARG  55          1HH2      ARG  55   7.064   4.143  13.417
  447   HH22  ARG  55          2HH2      ARG  55   7.986   2.683  13.275
  448    H    LYS  56           H        LYS  56   0.954   2.222  12.016
  449    HA   LYS  56           HA       LYS  56   0.521  -0.502  11.493
  450    HB2  LYS  56           2HB      LYS  56  -0.896   1.281  13.522
  451    HB3  LYS  56           3HB      LYS  56  -0.929  -0.478  13.530
  452    HG2  LYS  56           2HG      LYS  56   1.554   1.227  13.891
  453    HG3  LYS  56           3HG      LYS  56   0.660   0.446  15.190
  454    HD2  LYS  56           2HD      LYS  56   1.246  -1.766  14.331
  455    HD3  LYS  56           3HD      LYS  56   2.014  -1.056  12.908
  456    HE2  LYS  56           2HE      LYS  56   3.652  -1.810  14.639
  457    HE3  LYS  56           3HE      LYS  56   3.777  -0.086  14.285
  458    HZ1  LYS  56           3HZ      LYS  56   3.889  -0.528  16.657
  459    HZ2  LYS  56           1HZ      LYS  56   2.371  -1.275  16.621
  460    HZ3  LYS  56           2HZ      LYS  56   2.511   0.375  16.293
  461    H    GLU  57           H        GLU  57  -1.721   2.301  11.246
  462    HA   GLU  57           HA       GLU  57  -4.037   0.844  10.531
  463    HB2  GLU  57           2HB      GLU  57  -3.370   3.731   9.788
  464    HB3  GLU  57           3HB      GLU  57  -4.970   3.001   9.754
  465    HG2  GLU  57           2HG      GLU  57  -3.275   3.580  12.188
  466    HG3  GLU  57           3HG      GLU  57  -4.776   4.371  11.729
  467    H    LEU  58           H        LEU  58  -1.473   2.302   8.563
  468    HA   LEU  58           HA       LEU  58  -2.473   1.822   5.995
  469    HB2  LEU  58           2HB      LEU  58   0.276   2.276   7.133
  470    HB3  LEU  58           3HB      LEU  58   0.179   1.661   5.499
  471    HG   LEU  58           HG       LEU  58   0.445   4.044   5.367
  472   HD11  LEU  58          1HD1      LEU  58  -2.445   3.380   4.730
  473   HD12  LEU  58          2HD1      LEU  58  -1.042   3.108   3.687
  474   HD13  LEU  58          3HD1      LEU  58  -1.520   4.750   4.099
  475   HD21  LEU  58          3HD2      LEU  58  -0.301   4.686   7.592
  476   HD22  LEU  58          1HD2      LEU  58  -1.979   4.365   7.148
  477   HD23  LEU  58          2HD2      LEU  58  -1.085   5.670   6.358
  478    H    ALA  59           H        ALA  59  -0.792  -0.323   8.246
  479    HA   ALA  59           HA       ALA  59  -0.216  -2.471   6.521
  480    HB1  ALA  59           3HB      ALA  59  -0.025  -3.813   8.573
  481    HB2  ALA  59           1HB      ALA  59  -0.814  -2.534   9.498
  482    HB3  ALA  59           2HB      ALA  59   0.765  -2.248   8.764
  483    H    LYS  60           H        LYS  60  -3.059  -1.802   8.582
  484    HA   LYS  60           HA       LYS  60  -4.388  -4.283   8.088
  485    HB2  LYS  60           2HB      LYS  60  -5.320  -1.660   9.313
  486    HB3  LYS  60           3HB      LYS  60  -6.437  -2.993   9.064
  487    HG2  LYS  60           2HG      LYS  60  -5.647  -2.930  11.384
  488    HG3  LYS  60           3HG      LYS  60  -5.126  -4.414  10.585
  489    HD2  LYS  60           2HD      LYS  60  -2.871  -3.535  10.319
  490    HD3  LYS  60           3HD      LYS  60  -3.373  -1.963  10.940
  491    HE2  LYS  60           2HE      LYS  60  -2.124  -3.206  12.632
  492    HE3  LYS  60           3HE      LYS  60  -3.794  -2.976  13.154
  493    HZ1  LYS  60           3HZ      LYS  60  -3.053  -5.213  13.610
  494    HZ2  LYS  60           1HZ      LYS  60  -2.643  -5.460  11.989
  495    HZ3  LYS  60           2HZ      LYS  60  -4.260  -5.257  12.426
  496    H    GLU  61           H        GLU  61  -4.563  -1.073   6.604
  497    HA   GLU  61           HA       GLU  61  -6.805  -1.602   4.894
  498    HB2  GLU  61           2HB      GLU  61  -4.622   0.515   4.588
  499    HB3  GLU  61           3HB      GLU  61  -6.168   0.493   3.736
  500    HG2  GLU  61           2HG      GLU  61  -7.326   0.615   5.959
  501    HG3  GLU  61           3HG      GLU  61  -5.747   0.819   6.712
  502    H    ALA  62           H        ALA  62  -3.289  -1.834   4.556
  503    HA   ALA  62           HA       ALA  62  -3.125  -2.554   1.848
  504    HB1  ALA  62           3HB      ALA  62  -0.897  -3.301   2.365
  505    HB2  ALA  62           1HB      ALA  62  -1.277  -3.455   4.082
  506    HB3  ALA  62           2HB      ALA  62  -1.225  -1.864   3.322
  507    H    GLU  63           H        GLU  63  -3.572  -4.542   4.765
  508    HA   GLU  63           HA       GLU  63  -3.551  -7.097   3.533
  509    HB2  GLU  63           2HB      GLU  63  -4.807  -6.165   6.144
  510    HB3  GLU  63           3HB      GLU  63  -4.650  -7.855   5.668
  511    HG2  GLU  63           2HG      GLU  63  -2.231  -7.718   5.722
  512    HG3  GLU  63           3HG      GLU  63  -2.300  -5.975   6.004
  513    H    ARG  64           H        ARG  64  -6.183  -4.774   4.209
  514    HA   ARG  64           HA       ARG  64  -8.324  -6.522   3.558
  515    HB2  ARG  64           2HB      ARG  64  -9.771  -4.737   3.916
  516    HB3  ARG  64           3HB      ARG  64  -8.364  -4.115   4.758
  517    HG2  ARG  64           2HG      ARG  64  -7.798  -2.763   2.749
  518    HG3  ARG  64           3HG      ARG  64  -9.250  -3.361   1.960
  519    HD2  ARG  64           2HD      ARG  64 -10.628  -2.291   3.712
  520    HD3  ARG  64           3HD      ARG  64  -9.158  -1.674   4.486
  521    HE   ARG  64           HE       ARG  64  -9.773  -1.013   1.683
  522   HH11  ARG  64          1HH1      ARG  64  -9.215   0.127   4.956
  523   HH12  ARG  64          2HH1      ARG  64  -9.123   1.794   4.487
  524   HH21  ARG  64          1HH2      ARG  64  -9.662   1.196   1.086
  525   HH22  ARG  64          2HH2      ARG  64  -9.376   2.391   2.306
  526    H    LEU  65           H        LEU  65  -6.316  -4.310   1.657
  527    HA   LEU  65           HA       LEU  65  -7.718  -4.567  -0.831
  528    HB2  LEU  65           2HB      LEU  65  -4.857  -3.684  -0.273
  529    HB3  LEU  65           3HB      LEU  65  -5.683  -3.499  -1.817
  530    HG   LEU  65           HG       LEU  65  -6.501  -2.152   0.782
  531   HD11  LEU  65          1HD1      LEU  65  -4.402  -1.274  -0.073
  532   HD12  LEU  65          2HD1      LEU  65  -5.697  -0.090  -0.209
  533   HD13  LEU  65          3HD1      LEU  65  -5.149  -0.962  -1.644
  534   HD21  LEU  65          3HD2      LEU  65  -8.454  -2.565  -0.613
  535   HD22  LEU  65          1HD2      LEU  65  -7.660  -1.817  -2.004
  536   HD23  LEU  65          2HD2      LEU  65  -8.073  -0.847  -0.587
  537    H    ALA  66           H        ALA  66  -5.054  -6.273   0.709
  538    HA   ALA  66           HA       ALA  66  -4.086  -7.789  -1.424
  539    HB1  ALA  66           3HB      ALA  66  -4.274  -8.643   1.491
  540    HB2  ALA  66           1HB      ALA  66  -2.978  -7.672   0.787
  541    HB3  ALA  66           2HB      ALA  66  -3.209  -9.343   0.266
  542    H    LYS  67           H        LYS  67  -6.656  -8.621   0.923
  543    HA   LYS  67           HA       LYS  67  -7.312 -11.092  -0.442
  544    HB2  LYS  67           2HB      LYS  67  -8.946 -11.427   1.334
  545    HB3  LYS  67           3HB      LYS  67  -7.415 -10.912   2.030
  546    HG2  LYS  67           2HG      LYS  67  -8.301  -8.630   2.328
  547    HG3  LYS  67           3HG      LYS  67  -9.836  -9.118   1.606
  548    HD2  LYS  67           2HD      LYS  67  -8.657 -10.213   4.195
  549    HD3  LYS  67           3HD      LYS  67  -9.985  -9.062   4.073
  550    HE2  LYS  67           2HE      LYS  67 -11.396 -10.744   2.996
  551    HE3  LYS  67           3HE      LYS  67 -10.058 -11.895   2.978
  552    HZ1  LYS  67           3HZ      LYS  67 -11.323 -10.776   5.426
  553    HZ2  LYS  67           1HZ      LYS  67 -10.072 -11.916   5.384
  554    HZ3  LYS  67           2HZ      LYS  67 -11.607 -12.319   4.793
  555    H    GLU  68           H        GLU  68  -8.344  -7.813  -0.637
  556    HA   GLU  68           HA       GLU  68 -10.987  -8.139  -1.673
  557    HB2  GLU  68           2HB      GLU  68 -10.097  -6.009  -0.673
  558    HB3  GLU  68           3HB      GLU  68  -9.023  -5.826  -2.052
  559    HG2  GLU  68           2HG      GLU  68 -10.894  -4.334  -2.316
  560    HG3  GLU  68           3HG      GLU  68 -11.031  -5.606  -3.527
  561    H    PHE  69           H        PHE  69  -7.813  -7.582  -3.160
  562    HA   PHE  69           HA       PHE  69  -8.878  -7.988  -5.877
  563    HB2  PHE  69           2HB      PHE  69  -6.175  -6.896  -4.983
  564    HB3  PHE  69           3HB      PHE  69  -6.767  -6.955  -6.636
  565    HD1  PHE  69           HD1      PHE  69  -8.974  -5.641  -7.149
  566    HD2  PHE  69           HD2      PHE  69  -6.546  -4.934  -3.698
  567    HE1  PHE  69           HE1      PHE  69 -10.007  -3.431  -6.851
  568    HE2  PHE  69           HE2      PHE  69  -7.592  -2.733  -3.415
  569    HZ   PHE  69           HZ       PHE  69  -9.324  -1.985  -4.981
  570    H    ASN  70           H        ASN  70  -7.658  -9.998  -3.618
  571    HA   ASN  70           HA       ASN  70  -6.766 -12.087  -3.579
  572    HB2  ASN  70           2HB      ASN  70  -8.366 -12.436  -5.518
  573    HB3  ASN  70           3HB      ASN  70  -7.046 -12.080  -6.627
  574   HD21  ASN  70          1HD2      ASN  70  -7.030 -14.076  -7.612
  575   HD22  ASN  70          2HD2      ASN  70  -6.590 -15.549  -6.817
  576    H    ILE  71           H        ILE  71  -5.107  -9.639  -4.005
  577    HA   ILE  71           HA       ILE  71  -2.592 -10.740  -5.148
  578    HB   ILE  71           HB       ILE  71  -1.772  -8.391  -5.120
  579   HG12  ILE  71          2HG1      ILE  71  -4.543  -7.687  -4.033
  580   HG13  ILE  71          3HG1      ILE  71  -3.013  -7.497  -3.189
  581   HG21  ILE  71          1HG2      ILE  71  -3.187  -7.487  -6.934
  582   HG22  ILE  71          2HG2      ILE  71  -4.452  -8.651  -6.538
  583   HG23  ILE  71          3HG2      ILE  71  -2.895  -9.215  -7.152
  584   HD11  ILE  71          3HD1      ILE  71  -3.827  -5.369  -3.954
  585   HD12  ILE  71          1HD1      ILE  71  -3.912  -5.947  -5.618
  586   HD13  ILE  71          2HD1      ILE  71  -2.345  -5.780  -4.817
  587    H    THR  72           H        THR  72  -0.614 -10.244  -3.910
  588    HA   THR  72           HA       THR  72  -1.040 -10.795  -1.038
  589    HB   THR  72           HB       THR  72   1.542 -11.039  -2.642
  590    HG1  THR  72           HG1      THR  72  -0.665 -12.728  -2.375
  591   HG21  THR  72          3HG2      THR  72   0.727 -12.300  -0.007
  592   HG22  THR  72          1HG2      THR  72   1.864 -10.961  -0.178
  593   HG23  THR  72          2HG2      THR  72   2.261 -12.549  -0.840
  594    H    VAL  73           H        VAL  73   0.194  -9.631   0.538
  595    HA   VAL  73           HA       VAL  73   1.543  -7.158  -0.319
  596    HB   VAL  73           HB       VAL  73  -0.786  -6.615   0.502
  597   HG11  VAL  73          1HG1      VAL  73  -1.052  -8.328   2.242
  598   HG12  VAL  73          2HG1      VAL  73  -1.330  -6.713   2.896
  599   HG13  VAL  73          3HG1      VAL  73   0.191  -7.547   3.225
  600   HG21  VAL  73          3HG2      VAL  73  -0.083  -4.729   1.944
  601   HG22  VAL  73          1HG2      VAL  73   0.947  -4.907   0.526
  602   HG23  VAL  73          2HG2      VAL  73   1.514  -5.449   2.108
  603    H    THR  74           H        THR  74   3.262  -6.588   0.921
  604    HA   THR  74           HA       THR  74   3.916  -7.903   3.440
  605    HB   THR  74           HB       THR  74   5.059  -9.381   1.859
  606    HG1  THR  74           HG1      THR  74   6.467  -9.257   3.432
  607   HG21  THR  74          3HG2      THR  74   6.763  -8.613   0.262
  608   HG22  THR  74          1HG2      THR  74   6.438  -6.933   0.694
  609   HG23  THR  74          2HG2      THR  74   5.196  -7.891  -0.114
  610    H    TYR  75           H        TYR  75   5.139  -6.507   4.758
  611    HA   TYR  75           HA       TYR  75   6.036  -3.935   3.773
  612    HB2  TYR  75           2HB      TYR  75   4.477  -2.701   5.451
  613    HB3  TYR  75           3HB      TYR  75   3.777  -3.235   3.930
  614    HD1  TYR  75           HD1      TYR  75   4.122  -4.290   7.534
  615    HD2  TYR  75           HD2      TYR  75   1.781  -4.538   3.954
  616    HE1  TYR  75           HE1      TYR  75   2.356  -5.489   8.756
  617    HE2  TYR  75           HE2      TYR  75   0.028  -5.738   5.187
  618    HH   TYR  75           HH       TYR  75  -0.230  -7.066   7.186
  619    H    THR  76           H        THR  76   7.078  -2.647   5.441
  620    HA   THR  76           HA       THR  76   8.144  -4.305   7.646
  621    HB   THR  76           HB       THR  76   9.457  -1.826   6.455
  622    HG1  THR  76           HG1      THR  76   9.765  -3.115   4.795
  623   HG21  THR  76          3HG2      THR  76  10.597  -4.067   8.172
  624   HG22  THR  76          1HG2      THR  76  10.254  -2.423   8.724
  625   HG23  THR  76          2HG2      THR  76  11.512  -2.708   7.521
  626    H    ILE  77           H        ILE  77   7.314  -3.812   9.522
  627    HA   ILE  77           HA       ILE  77   7.454  -1.155  10.634
  628    HB   ILE  77           HB       ILE  77   5.135  -1.460  11.806
  629   HG12  ILE  77          2HG1      ILE  77   4.541  -3.174   9.345
  630   HG13  ILE  77          3HG1      ILE  77   4.683  -3.773  10.991
  631   HG21  ILE  77          1HG2      ILE  77   3.913  -0.197  10.096
  632   HG22  ILE  77          2HG2      ILE  77   5.136  -0.613   8.897
  633   HG23  ILE  77          3HG2      ILE  77   5.567   0.397  10.279
  634   HD11  ILE  77          3HD1      ILE  77   2.736  -2.446  11.650
  635   HD12  ILE  77          1HD1      ILE  77   2.366  -3.577  10.351
  636   HD13  ILE  77          2HD1      ILE  77   2.570  -1.861   9.992
  637    H    ARG  78           H        ARG  78   8.431  -1.421  12.535
  638    HA   ARG  78           HA       ARG  78   8.734  -4.093  13.663
  639    HB2  ARG  78           2HB      ARG  78  10.035  -1.444  14.398
  640    HB3  ARG  78           3HB      ARG  78  10.401  -2.975  15.177
  641    HG2  ARG  78           2HG      ARG  78  10.797  -2.507  12.206
  642    HG3  ARG  78           3HG      ARG  78  12.052  -2.201  13.406
  643    HD2  ARG  78           2HD      ARG  78  12.476  -4.353  12.437
  644    HD3  ARG  78           3HD      ARG  78  11.905  -4.621  14.080
  645    HE   ARG  78           HE       ARG  78   9.703  -5.206  13.061
  646   HH11  ARG  78          1HH1      ARG  78  12.597  -5.548  11.070
  647   HH12  ARG  78          2HH1      ARG  78  11.882  -6.747  10.040
  648   HH21  ARG  78          1HH2      ARG  78   8.807  -6.795  11.706
  649   HH22  ARG  78          2HH2      ARG  78   9.747  -7.448  10.401
  650    H    GLY  79           H        GLY  79   7.395  -4.815  15.152
  651    HA2  GLY  79           2HA      GLY  79   6.133  -2.992  17.133
  652    HA3  GLY  79           3HA      GLY  79   5.233  -4.264  16.308
  653    H    SER  80           H        SER  80   7.829  -3.601  18.546
  654    HA   SER  80           HA       SER  80   8.569  -4.602  20.415
  655    HB2  SER  80           2HB      SER  80   6.175  -6.442  20.078
  656    HB3  SER  80           3HB      SER  80   7.175  -6.346  21.530
  657    HG   SER  80           HG       SER  80   6.316  -3.892  20.736
  658    H    LEU  81           H        LEU  81   9.218  -5.633  17.593
  659    HA   LEU  81           HA       LEU  81  10.469  -8.213  18.338
  660    HB2  LEU  81           2HB      LEU  81   9.660  -7.186  15.590
  661    HB3  LEU  81           3HB      LEU  81  10.551  -8.675  15.863
  662    HG   LEU  81           HG       LEU  81   7.707  -8.111  16.805
  663   HD11  LEU  81          1HD1      LEU  81   7.028  -9.813  15.183
  664   HD12  LEU  81          2HD1      LEU  81   8.696  -9.968  14.623
  665   HD13  LEU  81          3HD1      LEU  81   7.823  -8.449  14.402
  666   HD21  LEU  81          3HD2      LEU  81   7.636 -10.472  17.517
  667   HD22  LEU  81          1HD2      LEU  81   8.837  -9.554  18.421
  668   HD23  LEU  81          2HD2      LEU  81   9.352 -10.649  17.135
  669    H    GLU  82           H        GLU  82  11.406  -5.198  18.459
  670    HA   GLU  82           HA       GLU  82  13.961  -5.326  17.053
  671    HB2  GLU  82           2HB      GLU  82  12.993  -3.379  19.203
  672    HB3  GLU  82           3HB      GLU  82  14.443  -3.185  18.223
  673    HG2  GLU  82           2HG      GLU  82  13.114  -2.879  16.210
  674    HG3  GLU  82           3HG      GLU  82  11.628  -3.247  17.090
  675    H    HIS  83           H        HIS  83  15.941  -5.934  18.012
  676    HA   HIS  83           HA       HIS  83  16.082  -6.533  20.859
  677    HB2  HIS  83           2HB      HIS  83  16.685  -8.940  20.522
  678    HB3  HIS  83           3HB      HIS  83  15.018  -8.574  20.105
  679    HD1  HIS  83           HD1      HIS  83  17.690 -10.539  18.926
  680    HD2  HIS  83           HD2      HIS  83  14.898  -8.096  17.046
  681    HE1  HIS  83           HE1      HIS  83  17.621 -11.294  16.535
  682    HE2  HIS  83           HE2      HIS  83  16.067  -9.682  15.397
  683    H    HIS  84           H        HIS  84  17.807  -5.089  20.983
  684    HA   HIS  84           HA       HIS  84  20.368  -5.818  19.804
  685    HB2  HIS  84           2HB      HIS  84  19.785  -3.440  20.505
  686    HB3  HIS  84           3HB      HIS  84  19.829  -3.970  22.183
  687    HD1  HIS  84           HD1      HIS  84  22.005  -3.103  19.280
  688    HD2  HIS  84           HD2      HIS  84  22.468  -4.451  23.186
  689    HE1  HIS  84           HE1      HIS  84  24.453  -2.892  19.786
  690    HE2  HIS  84           HE2      HIS  84  24.724  -3.875  22.080
  691    H    HIS  85           H        HIS  85  18.845  -5.911  23.031
  692    HA   HIS  85           HA       HIS  85  19.792  -8.642  23.458
  693    HB2  HIS  85           2HB      HIS  85  20.561  -6.324  25.265
  694    HB3  HIS  85           3HB      HIS  85  20.276  -7.904  25.984
  695    HD1  HIS  85           HD1      HIS  85  21.821  -9.896  24.960
  696    HD2  HIS  85           HD2      HIS  85  23.106  -6.002  24.261
  697    HE1  HIS  85           HE1      HIS  85  24.246 -10.083  24.357
  698    HE2  HIS  85           HE2      HIS  85  24.948  -7.738  23.776
  699    H    HIS  86           H        HIS  86  18.215  -9.863  24.282
  700    HA   HIS  86           HA       HIS  86  15.909  -8.648  25.700
  701    HB2  HIS  86           2HB      HIS  86  15.911 -10.574  23.368
  702    HB3  HIS  86           3HB      HIS  86  14.681 -10.809  24.600
  703    HD1  HIS  86           HD1      HIS  86  13.312 -10.280  22.216
  704    HD2  HIS  86           HD2      HIS  86  15.008  -7.091  24.278
  705    HE1  HIS  86           HE1      HIS  86  12.083  -8.237  21.438
  706    HE2  HIS  86           HE2      HIS  86  13.191  -6.322  22.632
  707    H    HIS  87           H        HIS  87  16.793  -9.155  27.715
  708    HA   HIS  87           HA       HIS  87  17.532 -11.797  28.536
  709    HB2  HIS  87           2HB      HIS  87  18.247  -9.751  29.785
  710    HB3  HIS  87           3HB      HIS  87  16.576  -9.445  30.257
  711    HD1  HIS  87           HD1      HIS  87  15.698 -10.717  32.282
  712    HD2  HIS  87           HD2      HIS  87  19.423 -12.076  31.027
  713    HE1  HIS  87           HE1      HIS  87  16.467 -12.328  34.052
  714    HE2  HIS  87           HE2      HIS  87  18.745 -13.086  33.301
  715    H    HIS  88           H        HIS  88  14.543  -9.914  28.612
  716    HA   HIS  88           HA       HIS  88  12.968 -12.296  29.347
  717    HB2  HIS  88           2HB      HIS  88  12.455 -10.210  30.593
  718    HB3  HIS  88           3HB      HIS  88  12.102  -9.378  29.079
  719    HD1  HIS  88           HD1      HIS  88   9.877 -10.008  27.875
  720    HD2  HIS  88           HD2      HIS  88  10.398 -11.878  31.549
  721    HE1  HIS  88           HE1      HIS  88   7.636 -10.978  28.470
  722    HE2  HIS  88           HE2      HIS  88   7.955 -12.001  30.738
  Start of MODEL   16
    1    H1   MET   1           1H       MET   1   9.276  11.377  10.350
    2    H2   MET   1           2H       MET   1  10.222  12.163  11.507
    3    H3   MET   1           3H       MET   1   9.094  11.010  11.988
    4    HA   MET   1           HA       MET   1  11.524  10.548  10.401
    5    HB2  MET   1           2HB      MET   1  12.325   9.298  12.352
    6    HB3  MET   1           3HB      MET   1  11.934  10.940  12.829
    7    HG2  MET   1           2HG      MET   1   9.835  10.155  13.864
    8    HG3  MET   1           3HG      MET   1  10.169   8.514  13.320
    9    HE1  MET   1           3HE      MET   1  12.737  11.148  14.859
   10    HE2  MET   1           1HE      MET   1  12.655  10.692  16.559
   11    HE3  MET   1           2HE      MET   1  11.249  11.411  15.772
   12    H    GLY   2           H        GLY   2   8.361   9.429  11.383
   13    HA2  GLY   2           2HA      GLY   2   8.716   6.627  11.111
   14    HA3  GLY   2           3HA      GLY   2   7.192   7.491  11.176
   15    H    GLU   3           H        GLU   3   9.235   5.690   9.251
   16    HA   GLU   3           HA       GLU   3   7.593   6.257   6.853
   17    HB2  GLU   3           2HB      GLU   3   9.439   5.692   5.401
   18    HB3  GLU   3           3HB      GLU   3   9.982   6.943   6.503
   19    HG2  GLU   3           2HG      GLU   3  10.601   4.006   6.881
   20    HG3  GLU   3           3HG      GLU   3  11.638   5.108   5.989
   21    H    MET   4           H        MET   4   7.348   4.370   5.468
   22    HA   MET   4           HA       MET   4   7.457   1.728   6.698
   23    HB2  MET   4           2HB      MET   4   5.318   2.722   7.539
   24    HB3  MET   4           3HB      MET   4   4.814   3.055   5.887
   25    HG2  MET   4           2HG      MET   4   4.738   0.668   5.407
   26    HG3  MET   4           3HG      MET   4   5.320   0.305   7.036
   27    HE1  MET   4           3HE      MET   4   1.666  -0.853   7.492
   28    HE2  MET   4           1HE      MET   4   3.362  -1.211   7.812
   29    HE3  MET   4           2HE      MET   4   2.765  -1.166   6.150
   30    H    ASP   5           H        ASP   5   7.461   0.084   5.074
   31    HA   ASP   5           HA       ASP   5   7.312   0.981   2.264
   32    HB2  ASP   5           2HB      ASP   5   9.654   0.468   3.028
   33    HB3  ASP   5           3HB      ASP   5   9.140  -1.131   3.552
   34    H    ILE   6           H        ILE   6   5.649  -0.070   1.280
   35    HA   ILE   6           HA       ILE   6   4.541  -2.588   2.396
   36    HB   ILE   6           HB       ILE   6   2.914  -0.265   1.204
   37   HG12  ILE   6          2HG1      ILE   6   3.100  -1.059   4.151
   38   HG13  ILE   6          3HG1      ILE   6   3.905   0.332   3.437
   39   HG21  ILE   6          1HG2      ILE   6   1.987  -2.823   2.578
   40   HG22  ILE   6          2HG2      ILE   6   1.883  -2.471   0.851
   41   HG23  ILE   6          3HG2      ILE   6   0.937  -1.527   2.000
   42   HD11  ILE   6          3HD1      ILE   6   0.932  -0.085   3.629
   43   HD12  ILE   6          1HD1      ILE   6   1.732   1.296   2.869
   44   HD13  ILE   6          2HD1      ILE   6   1.920   1.006   4.598
   45    H    ARG   7           H        ARG   7   5.096  -4.042   0.833
   46    HA   ARG   7           HA       ARG   7   4.814  -3.272  -2.005
   47    HB2  ARG   7           2HB      ARG   7   7.031  -4.185  -1.399
   48    HB3  ARG   7           3HB      ARG   7   6.283  -5.671  -0.812
   49    HG2  ARG   7           2HG      ARG   7   5.448  -6.156  -3.083
   50    HG3  ARG   7           3HG      ARG   7   6.156  -4.660  -3.680
   51    HD2  ARG   7           2HD      ARG   7   7.788  -6.887  -2.434
   52    HD3  ARG   7           3HD      ARG   7   7.474  -6.756  -4.167
   53    HE   ARG   7           HE       ARG   7   8.786  -4.544  -2.706
   54   HH11  ARG   7          1HH1      ARG   7   8.905  -6.987  -5.256
   55   HH12  ARG   7          2HH1      ARG   7  10.358  -6.349  -5.960
   56   HH21  ARG   7          1HH2      ARG   7  10.709  -3.735  -3.663
   57   HH22  ARG   7          2HH2      ARG   7  11.369  -4.519  -5.058
   58    H    PHE   8           H        PHE   8   3.244  -4.066  -3.178
   59    HA   PHE   8           HA       PHE   8   1.628  -6.402  -2.369
   60    HB2  PHE   8           2HB      PHE   8   1.060  -4.088  -4.289
   61    HB3  PHE   8           3HB      PHE   8   0.046  -5.524  -4.184
   62    HD1  PHE   8           HD1      PHE   8   1.047  -2.404  -2.460
   63    HD2  PHE   8           HD2      PHE   8  -1.414  -5.898  -2.266
   64    HE1  PHE   8           HE1      PHE   8  -0.290  -1.376  -0.666
   65    HE2  PHE   8           HE2      PHE   8  -2.748  -4.863  -0.486
   66    HZ   PHE   8           HZ       PHE   8  -2.192  -2.597   0.317
   67    H    ARG   9           H        ARG   9   1.280  -7.986  -4.045
   68    HA   ARG   9           HA       ARG   9   2.764  -7.800  -6.545
   69    HB2  ARG   9           2HB      ARG   9   4.301  -8.861  -4.703
   70    HB3  ARG   9           3HB      ARG   9   3.213 -10.239  -4.753
   71    HG2  ARG   9           2HG      ARG   9   3.683 -10.592  -7.123
   72    HG3  ARG   9           3HG      ARG   9   4.698  -9.152  -7.166
   73    HD2  ARG   9           2HD      ARG   9   5.950 -10.571  -5.183
   74    HD3  ARG   9           3HD      ARG   9   5.303 -11.890  -6.171
   75    HE   ARG   9           HE       ARG   9   6.678  -9.777  -7.601
   76   HH11  ARG   9          1HH1      ARG   9   6.991 -12.973  -6.188
   77   HH12  ARG   9          2HH1      ARG   9   8.416 -13.359  -7.102
   78   HH21  ARG   9          1HH2      ARG   9   8.564 -10.218  -8.688
   79   HH22  ARG   9          2HH2      ARG   9   9.315 -11.779  -8.532
   80    H    GLY  10           H        GLY  10   1.556  -8.726  -8.124
   81    HA2  GLY  10           2HA      GLY  10  -0.207 -10.964  -7.633
   82    HA3  GLY  10           3HA      GLY  10  -1.066  -9.444  -7.851
   83    H    ASP  11           H        ASP  11  -1.192 -11.789  -9.413
   84    HA   ASP  11           HA       ASP  11   0.258 -11.695 -11.825
   85    HB2  ASP  11           2HB      ASP  11  -0.862 -13.713 -11.071
   86    HB3  ASP  11           3HB      ASP  11  -2.432 -12.922 -11.084
   87    H    ASP  12           H        ASP  12  -2.486  -9.913 -10.713
   88    HA   ASP  12           HA       ASP  12  -3.064  -8.814 -13.394
   89    HB2  ASP  12           2HB      ASP  12  -5.003  -9.813 -12.242
   90    HB3  ASP  12           3HB      ASP  12  -4.747  -8.761 -10.853
   91    H    LEU  13           H        LEU  13  -1.879  -7.082 -13.770
   92    HA   LEU  13           HA       LEU  13  -0.786  -5.310 -11.858
   93    HB2  LEU  13           2HB      LEU  13   0.174  -5.695 -14.126
   94    HB3  LEU  13           3HB      LEU  13  -1.187  -4.850 -14.838
   95    HG   LEU  13           HG       LEU  13  -0.469  -2.753 -13.650
   96   HD11  LEU  13          1HD1      LEU  13   1.980  -4.344 -12.823
   97   HD12  LEU  13          2HD1      LEU  13   0.725  -3.718 -11.749
   98   HD13  LEU  13          3HD1      LEU  13   1.760  -2.601 -12.634
   99   HD21  LEU  13          3HD2      LEU  13   1.447  -2.252 -15.096
  100   HD22  LEU  13          1HD2      LEU  13   0.201  -3.138 -15.975
  101   HD23  LEU  13          2HD2      LEU  13   1.661  -3.972 -15.436
  102    H    GLU  14           H        GLU  14  -3.916  -5.379 -13.404
  103    HA   GLU  14           HA       GLU  14  -4.726  -2.681 -12.923
  104    HB2  GLU  14           2HB      GLU  14  -6.271  -5.268 -13.276
  105    HB3  GLU  14           3HB      GLU  14  -7.112  -3.801 -12.803
  106    HG2  GLU  14           2HG      GLU  14  -5.478  -4.102 -15.333
  107    HG3  GLU  14           3HG      GLU  14  -7.226  -4.289 -15.215
  108    H    ALA  15           H        ALA  15  -4.899  -5.667 -11.008
  109    HA   ALA  15           HA       ALA  15  -6.411  -4.683  -8.829
  110    HB1  ALA  15           3HB      ALA  15  -4.484  -7.033  -9.027
  111    HB2  ALA  15           1HB      ALA  15  -6.212  -7.071  -9.373
  112    HB3  ALA  15           2HB      ALA  15  -5.649  -6.778  -7.729
  113    H    LEU  16           H        LEU  16  -2.969  -4.875  -9.546
  114    HA   LEU  16           HA       LEU  16  -1.912  -4.041  -7.065
  115    HB2  LEU  16           2HB      LEU  16  -0.777  -3.779  -9.879
  116    HB3  LEU  16           3HB      LEU  16   0.141  -3.444  -8.415
  117    HG   LEU  16           HG       LEU  16  -1.043  -6.152  -9.136
  118   HD11  LEU  16          1HD1      LEU  16   0.781  -5.537 -10.644
  119   HD12  LEU  16          2HD1      LEU  16   1.263  -6.853  -9.578
  120   HD13  LEU  16          3HD1      LEU  16   1.838  -5.211  -9.266
  121   HD21  LEU  16          3HD2      LEU  16   0.783  -5.358  -6.841
  122   HD22  LEU  16          1HD2      LEU  16   0.293  -7.003  -7.255
  123   HD23  LEU  16          2HD2      LEU  16  -0.913  -5.841  -6.718
  124    H    GLU  17           H        GLU  17  -2.476  -2.175 -10.073
  125    HA   GLU  17           HA       GLU  17  -1.686   0.332  -8.960
  126    HB2  GLU  17           2HB      GLU  17  -3.257  -0.262 -11.507
  127    HB3  GLU  17           3HB      GLU  17  -2.585   1.311 -11.074
  128    HG2  GLU  17           2HG      GLU  17  -0.313   0.404 -11.108
  129    HG3  GLU  17           3HG      GLU  17  -0.939  -1.208 -11.466
  130    H    LYS  18           H        LYS  18  -4.709  -1.366  -9.020
  131    HA   LYS  18           HA       LYS  18  -6.433   0.817  -8.314
  132    HB2  LYS  18           2HB      LYS  18  -6.711  -2.206  -8.327
  133    HB3  LYS  18           3HB      LYS  18  -7.935  -1.234  -7.513
  134    HG2  LYS  18           2HG      LYS  18  -8.575  -0.139  -9.529
  135    HG3  LYS  18           3HG      LYS  18  -7.144  -0.709 -10.390
  136    HD2  LYS  18           2HD      LYS  18  -7.983  -2.955 -10.494
  137    HD3  LYS  18           3HD      LYS  18  -9.288  -2.607  -9.369
  138    HE2  LYS  18           2HE      LYS  18 -10.137  -2.733 -11.648
  139    HE3  LYS  18           3HE      LYS  18 -10.312  -1.088 -11.034
  140    HZ1  LYS  18           3HZ      LYS  18  -8.222  -2.079 -12.897
  141    HZ2  LYS  18           1HZ      LYS  18  -8.248  -0.525 -12.232
  142    HZ3  LYS  18           2HZ      LYS  18  -9.488  -1.023 -13.260
  143    H    ALA  19           H        ALA  19  -4.856  -1.819  -6.441
  144    HA   ALA  19           HA       ALA  19  -5.582  -0.989  -3.839
  145    HB1  ALA  19           3HB      ALA  19  -3.684  -2.364  -3.052
  146    HB2  ALA  19           1HB      ALA  19  -3.049  -2.447  -4.702
  147    HB3  ALA  19           2HB      ALA  19  -4.590  -3.207  -4.308
  148    H    LEU  20           H        LEU  20  -2.800  -0.201  -5.875
  149    HA   LEU  20           HA       LEU  20  -1.246   1.422  -4.301
  150    HB2  LEU  20           2HB      LEU  20  -0.561   0.647  -6.497
  151    HB3  LEU  20           3HB      LEU  20  -1.839   1.525  -7.288
  152    HG   LEU  20           HG       LEU  20   0.624   2.383  -7.476
  153   HD11  LEU  20          1HD1      LEU  20  -0.051   4.726  -7.686
  154   HD12  LEU  20          2HD1      LEU  20  -1.548   4.388  -6.818
  155   HD13  LEU  20          3HD1      LEU  20  -1.258   3.647  -8.391
  156   HD21  LEU  20          3HD2      LEU  20   1.389   3.926  -5.742
  157   HD22  LEU  20          1HD2      LEU  20   1.159   2.310  -5.072
  158   HD23  LEU  20          2HD2      LEU  20  -0.035   3.572  -4.764
  159    H    LYS  21           H        LYS  21  -3.909   2.442  -6.452
  160    HA   LYS  21           HA       LYS  21  -3.764   5.187  -5.913
  161    HB2  LYS  21           2HB      LYS  21  -4.889   4.197  -7.887
  162    HB3  LYS  21           3HB      LYS  21  -6.141   3.523  -6.864
  163    HG2  LYS  21           2HG      LYS  21  -5.755   6.512  -6.832
  164    HG3  LYS  21           3HG      LYS  21  -6.496   5.794  -8.257
  165    HD2  LYS  21           2HD      LYS  21  -7.520   5.465  -5.409
  166    HD3  LYS  21           3HD      LYS  21  -8.166   6.600  -6.596
  167    HE2  LYS  21           2HE      LYS  21  -8.803   4.735  -8.068
  168    HE3  LYS  21           3HE      LYS  21  -8.118   3.578  -6.921
  169    HZ1  LYS  21           3HZ      LYS  21  -9.751   4.319  -5.278
  170    HZ2  LYS  21           1HZ      LYS  21 -10.520   3.732  -6.667
  171    HZ3  LYS  21           2HZ      LYS  21 -10.410   5.399  -6.391
  172    H    GLU  22           H        GLU  22  -5.422   2.581  -4.225
  173    HA   GLU  22           HA       GLU  22  -7.018   4.259  -2.514
  174    HB2  GLU  22           2HB      GLU  22  -6.282   1.326  -2.187
  175    HB3  GLU  22           3HB      GLU  22  -7.569   2.172  -1.337
  176    HG2  GLU  22           2HG      GLU  22  -7.522   1.841  -4.340
  177    HG3  GLU  22           3HG      GLU  22  -8.255   0.669  -3.255
  178    H    MET  23           H        MET  23  -3.884   2.564  -2.197
  179    HA   MET  23           HA       MET  23  -3.465   3.205   0.552
  180    HB2  MET  23           2HB      MET  23  -1.472   2.434  -1.617
  181    HB3  MET  23           3HB      MET  23  -1.089   2.522   0.100
  182    HG2  MET  23           2HG      MET  23  -3.092   0.641  -1.166
  183    HG3  MET  23           3HG      MET  23  -1.468   0.215  -0.641
  184    HE1  MET  23           3HE      MET  23  -1.759   0.416   3.237
  185    HE2  MET  23           1HE      MET  23  -1.139   1.654   2.146
  186    HE3  MET  23           2HE      MET  23  -0.743  -0.046   1.869
  187    H    ILE  24           H        ILE  24  -2.672   4.845  -2.480
  188    HA   ILE  24           HA       ILE  24  -1.151   6.988  -1.365
  189    HB   ILE  24           HB       ILE  24  -2.756   6.871  -3.979
  190   HG12  ILE  24          2HG1      ILE  24   0.234   6.587  -3.384
  191   HG13  ILE  24          3HG1      ILE  24  -0.840   5.347  -4.019
  192   HG21  ILE  24          1HG2      ILE  24  -2.587   9.221  -3.246
  193   HG22  ILE  24          2HG2      ILE  24  -1.585   8.945  -4.668
  194   HG23  ILE  24          3HG2      ILE  24  -0.838   9.059  -3.073
  195   HD11  ILE  24          3HD1      ILE  24   0.581   6.189  -5.756
  196   HD12  ILE  24          1HD1      ILE  24   0.054   7.845  -5.448
  197   HD13  ILE  24          2HD1      ILE  24  -1.087   6.656  -6.085
  198    H    ARG  25           H        ARG  25  -4.592   6.479  -2.081
  199    HA   ARG  25           HA       ARG  25  -5.694   8.913  -1.298
  200    HB2  ARG  25           2HB      ARG  25  -6.968   7.076  -2.408
  201    HB3  ARG  25           3HB      ARG  25  -6.888   6.124  -0.930
  202    HG2  ARG  25           2HG      ARG  25  -8.231   7.864   0.232
  203    HG3  ARG  25           3HG      ARG  25  -8.329   8.769  -1.279
  204    HD2  ARG  25           2HD      ARG  25  -9.464   6.761  -2.318
  205    HD3  ARG  25           3HD      ARG  25  -9.505   6.028  -0.706
  206    HE   ARG  25           HE       ARG  25 -10.650   8.682  -0.883
  207   HH11  ARG  25          1HH1      ARG  25 -11.401   5.242  -1.113
  208   HH12  ARG  25          2HH1      ARG  25 -13.090   5.490  -0.799
  209   HH21  ARG  25          1HH2      ARG  25 -12.837   8.959  -0.456
  210   HH22  ARG  25          2HH2      ARG  25 -13.900   7.588  -0.429
  211    H    GLN  26           H        GLN  26  -4.738   6.105   0.658
  212    HA   GLN  26           HA       GLN  26  -5.589   7.143   3.180
  213    HB2  GLN  26           2HB      GLN  26  -3.473   5.026   2.613
  214    HB3  GLN  26           3HB      GLN  26  -4.193   5.359   4.183
  215    HG2  GLN  26           2HG      GLN  26  -5.487   4.104   1.765
  216    HG3  GLN  26           3HG      GLN  26  -5.262   3.411   3.367
  217   HE21  GLN  26          1HE2      GLN  26  -7.214   5.426   1.377
  218   HE22  GLN  26          2HE2      GLN  26  -8.493   5.697   2.505
  219    H    ALA  27           H        ALA  27  -2.423   7.014   1.553
  220    HA   ALA  27           HA       ALA  27  -0.866   8.225   3.539
  221    HB1  ALA  27           3HB      ALA  27   0.089   6.998   1.650
  222    HB2  ALA  27           1HB      ALA  27   0.791   8.612   1.753
  223    HB3  ALA  27           2HB      ALA  27  -0.440   8.258   0.533
  224    H    ARG  28           H        ARG  28  -3.010   9.641   1.179
  225    HA   ARG  28           HA       ARG  28  -2.055  12.368   1.524
  226    HB2  ARG  28           2HB      ARG  28  -4.438  11.296  -0.049
  227    HB3  ARG  28           3HB      ARG  28  -3.903  12.976  -0.043
  228    HG2  ARG  28           2HG      ARG  28  -1.732  12.275  -1.039
  229    HG3  ARG  28           3HG      ARG  28  -2.310  10.609  -1.085
  230    HD2  ARG  28           2HD      ARG  28  -3.449  12.980  -2.597
  231    HD3  ARG  28           3HD      ARG  28  -2.617  11.578  -3.279
  232    HE   ARG  28           HE       ARG  28  -5.159  11.228  -1.819
  233   HH11  ARG  28          1HH1      ARG  28  -3.419  10.986  -4.879
  234   HH12  ARG  28          2HH1      ARG  28  -4.689  10.083  -5.646
  235   HH21  ARG  28          1HH2      ARG  28  -6.795  10.089  -2.838
  236   HH22  ARG  28          2HH2      ARG  28  -6.600   9.580  -4.486
  237    H    LYS  29           H        LYS  29  -4.859  10.397   2.593
  238    HA   LYS  29           HA       LYS  29  -6.257  12.584   3.815
  239    HB2  LYS  29           2HB      LYS  29  -7.720  10.978   4.862
  240    HB3  LYS  29           3HB      LYS  29  -7.393  10.432   3.225
  241    HG2  LYS  29           2HG      LYS  29  -5.864   8.738   4.042
  242    HG3  LYS  29           3HG      LYS  29  -6.023   9.329   5.693
  243    HD2  LYS  29           2HD      LYS  29  -8.303   8.152   4.046
  244    HD3  LYS  29           3HD      LYS  29  -7.361   7.258   5.241
  245    HE2  LYS  29           2HE      LYS  29  -8.138   8.787   7.010
  246    HE3  LYS  29           3HE      LYS  29  -9.060   9.708   5.819
  247    HZ1  LYS  29           3HZ      LYS  29 -10.454   8.149   7.040
  248    HZ2  LYS  29           1HZ      LYS  29  -9.513   6.850   6.505
  249    HZ3  LYS  29           2HZ      LYS  29 -10.412   7.754   5.397
  250    H    PHE  30           H        PHE  30  -3.648  10.533   4.876
  251    HA   PHE  30           HA       PHE  30  -3.685  11.570   7.621
  252    HB2  PHE  30           2HB      PHE  30  -1.792   9.596   6.252
  253    HB3  PHE  30           3HB      PHE  30  -1.740  10.022   7.961
  254    HD1  PHE  30           HD1      PHE  30  -4.368   9.866   8.995
  255    HD2  PHE  30           HD2      PHE  30  -2.633   7.428   5.943
  256    HE1  PHE  30           HE1      PHE  30  -5.948   8.061   9.521
  257    HE2  PHE  30           HE2      PHE  30  -4.233   5.630   6.473
  258    HZ   PHE  30           HZ       PHE  30  -5.892   5.949   8.261
  259    H    ALA  31           H        ALA  31  -2.729  12.774   4.748
  260    HA   ALA  31           HA       ALA  31  -1.319  14.329   3.944
  261    HB1  ALA  31           3HB      ALA  31  -2.471  15.696   5.640
  262    HB2  ALA  31           1HB      ALA  31  -0.808  16.232   5.387
  263    HB3  ALA  31           2HB      ALA  31  -1.223  15.287   6.817
  264    H    GLY  32           H        GLY  32   0.088  12.480   3.566
  265    HA2  GLY  32           2HA      GLY  32   2.749  12.782   4.822
  266    HA3  GLY  32           3HA      GLY  32   2.033  11.193   4.551
  267    H    THR  33           H        THR  33   4.278  11.290   3.384
  268    HA   THR  33           HA       THR  33   4.056  12.270   0.610
  269    HB   THR  33           HB       THR  33   6.530  11.363   2.183
  270    HG1  THR  33           HG1      THR  33   5.308  13.450   2.710
  271   HG21  THR  33          3HG2      THR  33   6.784  11.108  -0.281
  272   HG22  THR  33          1HG2      THR  33   7.821  12.392   0.346
  273   HG23  THR  33          2HG2      THR  33   6.328  12.801  -0.500
  274    H    VAL  34           H        VAL  34   4.177  10.689  -1.048
  275    HA   VAL  34           HA       VAL  34   4.435   7.861  -0.291
  276    HB   VAL  34           HB       VAL  34   2.046   8.362  -0.089
  277   HG11  VAL  34          1HG1      VAL  34   2.084   9.289  -2.978
  278   HG12  VAL  34          2HG1      VAL  34   1.846  10.303  -1.554
  279   HG13  VAL  34          3HG1      VAL  34   0.644   9.080  -1.973
  280   HG21  VAL  34          3HG2      VAL  34   1.127   6.642  -1.594
  281   HG22  VAL  34          1HG2      VAL  34   2.662   6.129  -0.887
  282   HG23  VAL  34          2HG2      VAL  34   2.603   6.684  -2.562
  283    H    THR  35           H        THR  35   5.379   6.654  -1.815
  284    HA   THR  35           HA       THR  35   5.670   7.577  -4.605
  285    HB   THR  35           HB       THR  35   7.960   6.352  -2.963
  286    HG1  THR  35           HG1      THR  35   8.155   8.309  -2.163
  287   HG21  THR  35          3HG2      THR  35   8.146   6.046  -5.424
  288   HG22  THR  35          1HG2      THR  35   9.386   7.138  -4.804
  289   HG23  THR  35          2HG2      THR  35   7.980   7.790  -5.645
  290    H    TYR  36           H        TYR  36   6.163   5.682  -6.043
  291    HA   TYR  36           HA       TYR  36   5.883   3.016  -4.889
  292    HB2  TYR  36           2HB      TYR  36   4.074   2.342  -6.432
  293    HB3  TYR  36           3HB      TYR  36   3.545   3.615  -5.342
  294    HD1  TYR  36           HD2      TYR  36   3.160   5.941  -6.218
  295    HD2  TYR  36           HD1      TYR  36   4.140   2.721  -8.861
  296    HE1  TYR  36           HE2      TYR  36   2.407   7.276  -8.131
  297    HE2  TYR  36           HE1      TYR  36   3.366   4.071 -10.766
  298    HH   TYR  36           HH       TYR  36   2.004   5.932 -11.269
  299    H    THR  37           H        THR  37   6.686   1.361  -6.186
  300    HA   THR  37           HA       THR  37   7.893   2.089  -8.795
  301    HB   THR  37           HB       THR  37   9.017   0.032  -6.830
  302    HG1  THR  37           HG1      THR  37   9.850   2.689  -7.418
  303   HG21  THR  37          3HG2      THR  37   9.580  -0.427  -9.206
  304   HG22  THR  37          1HG2      THR  37  11.004   0.075  -8.293
  305   HG23  THR  37          2HG2      THR  37  10.205   1.217  -9.375
  306    H    LEU  38           H        LEU  38   6.660   1.150 -10.316
  307    HA   LEU  38           HA       LEU  38   5.430  -1.493  -9.947
  308    HB2  LEU  38           2HB      LEU  38   5.271   0.598 -12.161
  309    HB3  LEU  38           3HB      LEU  38   4.494  -0.974 -12.285
  310    HG   LEU  38           HG       LEU  38   3.874   1.057 -10.105
  311   HD11  LEU  38          1HD1      LEU  38   2.303   0.486 -12.638
  312   HD12  LEU  38          2HD1      LEU  38   3.206   1.961 -12.275
  313   HD13  LEU  38          3HD1      LEU  38   1.796   1.535 -11.310
  314   HD21  LEU  38          3HD2      LEU  38   1.913  -0.328  -9.650
  315   HD22  LEU  38          1HD2      LEU  38   3.401  -1.252  -9.442
  316   HD23  LEU  38          2HD2      LEU  38   2.413  -1.483 -10.889
  317    H    ASP  39           H        ASP  39   6.589  -3.246 -10.499
  318    HA   ASP  39           HA       ASP  39   8.380  -3.228 -12.843
  319    HB2  ASP  39           2HB      ASP  39   9.804  -2.866 -10.812
  320    HB3  ASP  39           3HB      ASP  39   9.147  -4.325 -10.084
  321    H    GLY  40           H        GLY  40   7.003  -4.502 -14.015
  322    HA2  GLY  40           2HA      GLY  40   5.964  -6.374 -14.802
  323    HA3  GLY  40           3HA      GLY  40   6.894  -7.302 -13.633
  324    H    ASN  41           H        ASN  41   5.901  -8.046 -11.828
  325    HA   ASN  41           HA       ASN  41   3.041  -7.379 -11.415
  326    HB2  ASN  41           2HB      ASN  41   4.522  -9.965 -10.764
  327    HB3  ASN  41           3HB      ASN  41   2.838  -9.637 -10.350
  328   HD21  ASN  41          1HD2      ASN  41   1.311  -9.368 -12.126
  329   HD22  ASN  41          2HD2      ASN  41   1.625 -10.094 -13.660
  330    H    ASP  42           H        ASP  42   5.761  -6.303 -10.224
  331    HA   ASP  42           HA       ASP  42   5.065  -6.509  -7.353
  332    HB2  ASP  42           2HB      ASP  42   7.648  -5.675  -8.758
  333    HB3  ASP  42           3HB      ASP  42   7.384  -5.431  -7.033
  334    H    LEU  43           H        LEU  43   4.488  -4.782  -6.221
  335    HA   LEU  43           HA       LEU  43   4.700  -2.035  -7.308
  336    HB2  LEU  43           2HB      LEU  43   2.366  -2.669  -7.528
  337    HB3  LEU  43           3HB      LEU  43   2.366  -3.470  -5.964
  338    HG   LEU  43           HG       LEU  43   2.617  -1.214  -4.866
  339   HD11  LEU  43          1HD1      LEU  43   2.120   0.818  -6.112
  340   HD12  LEU  43          2HD1      LEU  43   2.075  -0.095  -7.620
  341   HD13  LEU  43          3HD1      LEU  43   3.585   0.044  -6.717
  342   HD21  LEU  43          3HD2      LEU  43   0.140  -1.583  -6.569
  343   HD22  LEU  43          1HD2      LEU  43   0.263  -0.602  -5.105
  344   HD23  LEU  43          2HD2      LEU  43   0.454  -2.352  -5.011
  345    H    GLU  44           H        GLU  44   6.341  -1.230  -5.966
  346    HA   GLU  44           HA       GLU  44   6.291  -1.852  -3.065
  347    HB2  GLU  44           2HB      GLU  44   8.435  -2.295  -4.295
  348    HB3  GLU  44           3HB      GLU  44   8.523  -0.584  -4.728
  349    HG2  GLU  44           2HG      GLU  44   8.578  -0.016  -2.279
  350    HG3  GLU  44           3HG      GLU  44   8.611  -1.739  -1.918
  351    H    ILE  45           H        ILE  45   4.922  -0.433  -2.155
  352    HA   ILE  45           HA       ILE  45   4.859   2.420  -2.877
  353    HB   ILE  45           HB       ILE  45   3.139   0.936  -0.810
  354   HG12  ILE  45          2HG1      ILE  45   2.473   1.594  -3.722
  355   HG13  ILE  45          3HG1      ILE  45   2.825  -0.012  -3.095
  356   HG21  ILE  45          1HG2      ILE  45   3.234   3.380  -0.457
  357   HG22  ILE  45          2HG2      ILE  45   1.628   2.893  -0.996
  358   HG23  ILE  45          3HG2      ILE  45   2.743   3.658  -2.131
  359   HD11  ILE  45          3HD1      ILE  45   0.829   0.098  -1.695
  360   HD12  ILE  45          1HD1      ILE  45   0.466   0.294  -3.407
  361   HD13  ILE  45          2HD1      ILE  45   0.467   1.701  -2.347
  362    H    ARG  46           H        ARG  46   6.147   3.820  -1.767
  363    HA   ARG  46           HA       ARG  46   7.189   3.139   0.920
  364    HB2  ARG  46           2HB      ARG  46   8.391   4.915  -1.262
  365    HB3  ARG  46           3HB      ARG  46   9.119   4.626   0.319
  366    HG2  ARG  46           2HG      ARG  46   9.335   2.225  -0.229
  367    HG3  ARG  46           3HG      ARG  46   8.609   2.527  -1.811
  368    HD2  ARG  46           2HD      ARG  46  11.200   3.772  -0.835
  369    HD3  ARG  46           3HD      ARG  46  11.094   2.357  -1.880
  370    HE   ARG  46           HE       ARG  46  10.444   5.142  -2.611
  371   HH11  ARG  46          1HH1      ARG  46  10.800   1.797  -3.621
  372   HH12  ARG  46          2HH1      ARG  46  10.816   2.169  -5.306
  373   HH21  ARG  46          1HH2      ARG  46  10.540   5.620  -4.860
  374   HH22  ARG  46          2HH2      ARG  46  10.669   4.326  -6.009
  375    H    ILE  47           H        ILE  47   5.909   4.154   2.336
  376    HA   ILE  47           HA       ILE  47   4.940   6.912   1.830
  377    HB   ILE  47           HB       ILE  47   3.813   4.861   3.807
  378   HG12  ILE  47          2HG1      ILE  47   2.699   5.763   1.100
  379   HG13  ILE  47          3HG1      ILE  47   3.427   4.197   1.429
  380   HG21  ILE  47          1HG2      ILE  47   1.930   6.475   4.056
  381   HG22  ILE  47          2HG2      ILE  47   2.765   7.610   2.993
  382   HG23  ILE  47          3HG2      ILE  47   3.468   7.186   4.555
  383   HD11  ILE  47          3HD1      ILE  47   1.030   4.045   1.345
  384   HD12  ILE  47          1HD1      ILE  47   0.874   5.241   2.632
  385   HD13  ILE  47          2HD1      ILE  47   1.613   3.672   2.966
  386    H    THR  48           H        THR  48   5.976   8.436   2.926
  387    HA   THR  48           HA       THR  48   7.378   7.848   5.470
  388    HB   THR  48           HB       THR  48   8.264   9.688   3.185
  389    HG1  THR  48           HG1      THR  48   8.484   7.159   3.228
  390   HG21  THR  48          3HG2      THR  48  10.369   9.981   4.458
  391   HG22  THR  48          1HG2      THR  48   9.721   9.006   5.780
  392   HG23  THR  48          2HG2      THR  48   8.994  10.566   5.394
  393    H    GLY  49           H        GLY  49   7.229   9.476   7.047
  394    HA2  GLY  49           2HA      GLY  49   6.797  11.605   7.928
  395    HA3  GLY  49           3HA      GLY  49   5.985  12.069   6.440
  396    H    VAL  50           H        VAL  50   5.446   9.215   8.462
  397    HA   VAL  50           HA       VAL  50   2.866  10.236   9.433
  398    HB   VAL  50           HB       VAL  50   1.808   7.917   8.907
  399   HG11  VAL  50          1HG1      VAL  50   1.133   8.576   6.608
  400   HG12  VAL  50          2HG1      VAL  50   2.441   9.762   6.566
  401   HG13  VAL  50          3HG1      VAL  50   1.118   9.952   7.714
  402   HG21  VAL  50          3HG2      VAL  50   3.890   6.718   8.324
  403   HG22  VAL  50          1HG2      VAL  50   4.109   7.761   6.918
  404   HG23  VAL  50          2HG2      VAL  50   2.729   6.657   6.997
  405    HA   PRO  51           HA       PRO  51   4.492   8.524  13.269
  406    HB2  PRO  51           2HB      PRO  51   2.135   8.422  14.739
  407    HB3  PRO  51           3HB      PRO  51   3.034   9.920  14.418
  408    HG2  PRO  51           2HG      PRO  51   0.627   8.830  13.025
  409    HG3  PRO  51           3HG      PRO  51   0.976  10.499  13.524
  410    HD2  PRO  51           2HD      PRO  51   1.281   9.675  10.959
  411    HD3  PRO  51           3HD      PRO  51   2.343  10.905  11.683
  412    H    GLU  52           H        GLU  52   4.003   6.783  14.877
  413    HA   GLU  52           HA       GLU  52   4.297   4.272  13.761
  414    HB2  GLU  52           2HB      GLU  52   5.135   4.843  16.013
  415    HB3  GLU  52           3HB      GLU  52   3.492   5.083  16.596
  416    HG2  GLU  52           2HG      GLU  52   4.317   2.974  17.426
  417    HG3  GLU  52           3HG      GLU  52   3.034   2.671  16.261
  418    H    GLN  53           H        GLN  53   1.446   5.525  15.526
  419    HA   GLN  53           HA       GLN  53  -0.220   3.308  15.274
  420    HB2  GLN  53           2HB      GLN  53  -2.120   4.891  15.697
  421    HB3  GLN  53           3HB      GLN  53  -0.792   5.067  16.839
  422    HG2  GLN  53           2HG      GLN  53  -0.068   7.107  15.844
  423    HG3  GLN  53           3HG      GLN  53  -1.077   6.856  14.421
  424   HE21  GLN  53          1HE2      GLN  53  -3.280   7.284  14.528
  425   HE22  GLN  53          2HE2      GLN  53  -3.993   8.203  15.809
  426    H    VAL  54           H        VAL  54   0.229   6.044  13.086
  427    HA   VAL  54           HA       VAL  54  -1.939   5.414  11.341
  428    HB   VAL  54           HB       VAL  54   0.424   7.317  11.087
  429   HG11  VAL  54          1HG1      VAL  54  -0.676   8.315   9.109
  430   HG12  VAL  54          2HG1      VAL  54  -1.847   6.993   9.094
  431   HG13  VAL  54          3HG1      VAL  54  -0.139   6.660   8.805
  432   HG21  VAL  54          3HG2      VAL  54  -1.301   9.063  11.375
  433   HG22  VAL  54          1HG2      VAL  54  -1.292   7.942  12.735
  434   HG23  VAL  54          2HG2      VAL  54  -2.552   7.821  11.504
  435    H    ARG  55           H        ARG  55   1.547   4.724  11.284
  436    HA   ARG  55           HA       ARG  55   1.651   3.500   8.734
  437    HB2  ARG  55           2HB      ARG  55   3.385   3.077  11.212
  438    HB3  ARG  55           3HB      ARG  55   3.733   2.343   9.646
  439    HG2  ARG  55           2HG      ARG  55   3.898   4.598   8.634
  440    HG3  ARG  55           3HG      ARG  55   3.601   5.323  10.213
  441    HD2  ARG  55           2HD      ARG  55   5.941   3.494   9.596
  442    HD3  ARG  55           3HD      ARG  55   6.010   5.252   9.509
  443    HE   ARG  55           HE       ARG  55   5.538   5.307  11.912
  444   HH11  ARG  55          1HH1      ARG  55   6.716   2.258  10.605
  445   HH12  ARG  55          2HH1      ARG  55   7.353   1.715  12.123
  446   HH21  ARG  55          1HH2      ARG  55   6.409   4.598  13.870
  447   HH22  ARG  55          2HH2      ARG  55   7.177   3.046  13.982
  448    H    LYS  56           H        LYS  56   0.883   2.257  11.954
  449    HA   LYS  56           HA       LYS  56   0.435  -0.457  11.189
  450    HB2  LYS  56           2HB      LYS  56  -0.584   1.133  13.580
  451    HB3  LYS  56           3HB      LYS  56  -0.689  -0.621  13.420
  452    HG2  LYS  56           2HG      LYS  56   1.732  -0.836  13.446
  453    HG3  LYS  56           3HG      LYS  56   1.924   0.918  13.376
  454    HD2  LYS  56           2HD      LYS  56   2.341   0.156  15.651
  455    HD3  LYS  56           3HD      LYS  56   0.860   1.114  15.617
  456    HE2  LYS  56           2HE      LYS  56  -0.478  -0.965  15.639
  457    HE3  LYS  56           3HE      LYS  56   1.009  -1.919  15.672
  458    HZ1  LYS  56           3HZ      LYS  56   0.107  -0.013  17.772
  459    HZ2  LYS  56           1HZ      LYS  56   1.571  -0.864  17.788
  460    HZ3  LYS  56           2HZ      LYS  56   0.105  -1.701  17.875
  461    H    GLU  57           H        GLU  57  -1.600   2.441  11.139
  462    HA   GLU  57           HA       GLU  57  -4.079   1.123  10.549
  463    HB2  GLU  57           2HB      GLU  57  -3.173   4.004  10.048
  464    HB3  GLU  57           3HB      GLU  57  -4.807   3.425   9.721
  465    HG2  GLU  57           2HG      GLU  57  -5.108   2.867  12.096
  466    HG3  GLU  57           3HG      GLU  57  -3.451   3.367  12.422
  467    H    LEU  58           H        LEU  58  -1.423   2.418   8.583
  468    HA   LEU  58           HA       LEU  58  -2.489   1.837   6.013
  469    HB2  LEU  58           2HB      LEU  58   0.274   2.450   7.066
  470    HB3  LEU  58           3HB      LEU  58   0.166   1.704   5.485
  471    HG   LEU  58           HG       LEU  58   0.378   4.082   5.188
  472   HD11  LEU  58          1HD1      LEU  58  -1.041   2.966   3.555
  473   HD12  LEU  58          2HD1      LEU  58  -1.595   4.614   3.827
  474   HD13  LEU  58          3HD1      LEU  58  -2.474   3.263   4.546
  475   HD21  LEU  58          3HD2      LEU  58  -2.081   4.471   6.924
  476   HD22  LEU  58          1HD2      LEU  58  -1.232   5.737   6.029
  477   HD23  LEU  58          2HD2      LEU  58  -0.421   4.895   7.346
  478    H    ALA  59           H        ALA  59  -0.845  -0.113   8.411
  479    HA   ALA  59           HA       ALA  59  -0.223  -2.372   6.840
  480    HB1  ALA  59           3HB      ALA  59   0.753  -1.981   9.065
  481    HB2  ALA  59           1HB      ALA  59  -0.031  -3.558   8.989
  482    HB3  ALA  59           2HB      ALA  59  -0.825  -2.217   9.819
  483    H    LYS  60           H        LYS  60  -3.129  -1.532   8.766
  484    HA   LYS  60           HA       LYS  60  -4.596  -3.913   8.256
  485    HB2  LYS  60           2HB      LYS  60  -5.396  -1.142   9.169
  486    HB3  LYS  60           3HB      LYS  60  -6.654  -2.275   8.695
  487    HG2  LYS  60           2HG      LYS  60  -6.394  -2.326  11.094
  488    HG3  LYS  60           3HG      LYS  60  -5.859  -3.871  10.428
  489    HD2  LYS  60           2HD      LYS  60  -3.529  -3.265  10.734
  490    HD3  LYS  60           3HD      LYS  60  -3.970  -1.610  11.168
  491    HE2  LYS  60           2HE      LYS  60  -4.620  -4.095  12.788
  492    HE3  LYS  60           3HE      LYS  60  -3.366  -2.909  13.158
  493    HZ1  LYS  60           3HZ      LYS  60  -5.131  -1.216  13.313
  494    HZ2  LYS  60           1HZ      LYS  60  -5.285  -2.442  14.467
  495    HZ3  LYS  60           2HZ      LYS  60  -6.293  -2.426  13.112
  496    H    GLU  61           H        GLU  61  -4.435  -0.757   6.584
  497    HA   GLU  61           HA       GLU  61  -6.366  -1.239   4.598
  498    HB2  GLU  61           2HB      GLU  61  -3.891   0.543   4.490
  499    HB3  GLU  61           3HB      GLU  61  -5.197   0.575   3.305
  500    HG2  GLU  61           2HG      GLU  61  -5.389   1.258   6.236
  501    HG3  GLU  61           3HG      GLU  61  -5.485   2.384   4.884
  502    H    ALA  62           H        ALA  62  -2.898  -1.823   4.671
  503    HA   ALA  62           HA       ALA  62  -2.407  -2.731   2.116
  504    HB1  ALA  62           3HB      ALA  62  -0.695  -2.223   3.845
  505    HB2  ALA  62           1HB      ALA  62  -0.409  -3.777   3.073
  506    HB3  ALA  62           2HB      ALA  62  -1.110  -3.714   4.692
  507    H    GLU  63           H        GLU  63  -3.319  -4.656   4.980
  508    HA   GLU  63           HA       GLU  63  -3.315  -7.163   3.614
  509    HB2  GLU  63           2HB      GLU  63  -4.478  -6.425   6.328
  510    HB3  GLU  63           3HB      GLU  63  -4.229  -8.069   5.736
  511    HG2  GLU  63           2HG      GLU  63  -1.782  -7.607   5.557
  512    HG3  GLU  63           3HG      GLU  63  -2.065  -6.004   6.233
  513    H    ARG  64           H        ARG  64  -5.933  -4.853   4.334
  514    HA   ARG  64           HA       ARG  64  -8.024  -6.707   3.592
  515    HB2  ARG  64           2HB      ARG  64  -9.587  -4.817   3.766
  516    HB3  ARG  64           3HB      ARG  64  -8.554  -4.930   5.184
  517    HG2  ARG  64           2HG      ARG  64  -7.174  -3.080   4.317
  518    HG3  ARG  64           3HG      ARG  64  -8.231  -2.955   2.913
  519    HD2  ARG  64           2HD      ARG  64  -9.177  -2.596   5.780
  520    HD3  ARG  64           3HD      ARG  64  -8.683  -1.266   4.728
  521    HE   ARG  64           HE       ARG  64 -10.966  -3.070   4.134
  522   HH11  ARG  64          1HH1      ARG  64  -9.563   0.164   4.206
  523   HH12  ARG  64          2HH1      ARG  64 -10.969   0.910   3.518
  524   HH21  ARG  64          1HH2      ARG  64 -12.774  -2.076   3.187
  525   HH22  ARG  64          2HH2      ARG  64 -12.789  -0.360   2.940
  526    H    LEU  65           H        LEU  65  -6.211  -4.146   1.924
  527    HA   LEU  65           HA       LEU  65  -7.741  -4.305  -0.520
  528    HB2  LEU  65           2HB      LEU  65  -4.985  -3.127   0.017
  529    HB3  LEU  65           3HB      LEU  65  -5.864  -2.950  -1.494
  530    HG   LEU  65           HG       LEU  65  -6.761  -1.863   1.205
  531   HD11  LEU  65          1HD1      LEU  65  -5.681  -0.389  -1.215
  532   HD12  LEU  65          2HD1      LEU  65  -4.847  -0.648   0.318
  533   HD13  LEU  65          3HD1      LEU  65  -6.293   0.354   0.269
  534   HD21  LEU  65          3HD2      LEU  65  -8.080  -1.517  -1.507
  535   HD22  LEU  65          1HD2      LEU  65  -8.553  -0.706  -0.012
  536   HD23  LEU  65          2HD2      LEU  65  -8.707  -2.455  -0.148
  537    H    ALA  66           H        ALA  66  -4.977  -5.946   0.811
  538    HA   ALA  66           HA       ALA  66  -4.010  -7.305  -1.446
  539    HB1  ALA  66           3HB      ALA  66  -2.840  -7.275   0.716
  540    HB2  ALA  66           1HB      ALA  66  -3.065  -8.923   0.129
  541    HB3  ALA  66           2HB      ALA  66  -4.094  -8.295   1.423
  542    H    LYS  67           H        LYS  67  -6.497  -8.308   0.929
  543    HA   LYS  67           HA       LYS  67  -7.073 -10.768  -0.480
  544    HB2  LYS  67           2HB      LYS  67  -8.751 -11.160   1.237
  545    HB3  LYS  67           3HB      LYS  67  -7.272 -10.583   1.994
  546    HG2  LYS  67           2HG      LYS  67  -8.268  -8.321   2.194
  547    HG3  LYS  67           3HG      LYS  67  -9.762  -8.919   1.474
  548    HD2  LYS  67           2HD      LYS  67  -8.552  -9.789   4.129
  549    HD3  LYS  67           3HD      LYS  67  -9.988  -8.788   3.905
  550    HE2  LYS  67           2HE      LYS  67  -9.696 -11.697   3.094
  551    HE3  LYS  67           3HE      LYS  67 -10.607 -11.082   4.468
  552    HZ1  LYS  67           3HZ      LYS  67 -12.047  -9.896   2.914
  553    HZ2  LYS  67           1HZ      LYS  67 -12.076 -11.564   2.649
  554    HZ3  LYS  67           2HZ      LYS  67 -11.208 -10.558   1.606
  555    H    GLU  68           H        GLU  68  -8.285  -7.514  -0.521
  556    HA   GLU  68           HA       GLU  68 -10.865  -7.903  -1.659
  557    HB2  GLU  68           2HB      GLU  68 -10.060  -5.794  -0.539
  558    HB3  GLU  68           3HB      GLU  68  -8.997  -5.494  -1.906
  559    HG2  GLU  68           2HG      GLU  68 -10.885  -4.097  -2.221
  560    HG3  GLU  68           3HG      GLU  68 -11.090  -5.428  -3.357
  561    H    PHE  69           H        PHE  69  -7.744  -6.918  -3.091
  562    HA   PHE  69           HA       PHE  69  -8.757  -7.216  -5.813
  563    HB2  PHE  69           2HB      PHE  69  -6.117  -6.144  -4.724
  564    HB3  PHE  69           3HB      PHE  69  -6.581  -6.133  -6.419
  565    HD1  PHE  69           HD1      PHE  69  -8.865  -4.923  -6.982
  566    HD2  PHE  69           HD2      PHE  69  -6.601  -4.217  -3.429
  567    HE1  PHE  69           HE1      PHE  69  -9.981  -2.753  -6.688
  568    HE2  PHE  69           HE2      PHE  69  -7.725  -2.050  -3.141
  569    HZ   PHE  69           HZ       PHE  69  -9.419  -1.315  -4.768
  570    H    ASN  70           H        ASN  70  -7.559  -9.346  -3.676
  571    HA   ASN  70           HA       ASN  70  -6.630 -11.398  -3.724
  572    HB2  ASN  70           2HB      ASN  70  -8.459 -11.774  -5.417
  573    HB3  ASN  70           3HB      ASN  70  -7.325 -11.369  -6.704
  574   HD21  ASN  70          1HD2      ASN  70  -7.366 -13.367  -7.701
  575   HD22  ASN  70          2HD2      ASN  70  -6.752 -14.814  -6.985
  576    H    ILE  71           H        ILE  71  -4.770  -9.624  -3.602
  577    HA   ILE  71           HA       ILE  71  -2.499 -10.631  -5.192
  578    HB   ILE  71           HB       ILE  71  -1.501  -8.318  -5.084
  579   HG12  ILE  71          2HG1      ILE  71  -4.257  -7.513  -4.014
  580   HG13  ILE  71          3HG1      ILE  71  -2.713  -7.345  -3.187
  581   HG21  ILE  71          1HG2      ILE  71  -2.799  -7.341  -6.928
  582   HG22  ILE  71          2HG2      ILE  71  -4.164  -8.397  -6.559
  583   HG23  ILE  71          3HG2      ILE  71  -2.651  -9.088  -7.143
  584   HD11  ILE  71          3HD1      ILE  71  -3.619  -5.808  -5.624
  585   HD12  ILE  71          1HD1      ILE  71  -2.018  -5.687  -4.886
  586   HD13  ILE  71          2HD1      ILE  71  -3.448  -5.201  -3.977
  587    H    THR  72           H        THR  72  -0.500 -10.632  -3.998
  588    HA   THR  72           HA       THR  72  -0.788 -11.171  -1.163
  589    HB   THR  72           HB       THR  72   1.743 -11.672  -1.402
  590    HG1  THR  72           HG1      THR  72   1.170 -11.569  -4.179
  591   HG21  THR  72          3HG2      THR  72   0.059 -13.483  -1.386
  592   HG22  THR  72          1HG2      THR  72   1.384 -13.845  -2.493
  593   HG23  THR  72          2HG2      THR  72  -0.166 -13.292  -3.128
  594    H    VAL  73           H        VAL  73   0.241  -9.992   0.475
  595    HA   VAL  73           HA       VAL  73   1.547  -7.440  -0.248
  596    HB   VAL  73           HB       VAL  73  -0.866  -7.111   0.522
  597   HG11  VAL  73          1HG1      VAL  73  -1.400  -7.236   2.925
  598   HG12  VAL  73          2HG1      VAL  73   0.163  -7.993   3.245
  599   HG13  VAL  73          3HG1      VAL  73  -1.033  -8.824   2.249
  600   HG21  VAL  73          3HG2      VAL  73   0.758  -5.282   0.576
  601   HG22  VAL  73          1HG2      VAL  73   1.274  -5.753   2.200
  602   HG23  VAL  73          2HG2      VAL  73  -0.370  -5.166   1.925
  603    H    THR  74           H        THR  74   3.125  -6.779   1.119
  604    HA   THR  74           HA       THR  74   3.543  -7.962   3.735
  605    HB   THR  74           HB       THR  74   4.964  -9.358   2.222
  606    HG1  THR  74           HG1      THR  74   5.606  -8.645   4.436
  607   HG21  THR  74          3HG2      THR  74   6.937  -8.400   1.095
  608   HG22  THR  74          1HG2      THR  74   6.438  -6.773   1.567
  609   HG23  THR  74          2HG2      THR  74   5.451  -7.708   0.441
  610    H    TYR  75           H        TYR  75   4.770  -6.513   5.078
  611    HA   TYR  75           HA       TYR  75   5.620  -3.952   3.994
  612    HB2  TYR  75           2HB      TYR  75   4.269  -2.715   5.797
  613    HB3  TYR  75           3HB      TYR  75   3.356  -3.326   4.424
  614    HD1  TYR  75           HD1      TYR  75   4.158  -4.026   8.029
  615    HD2  TYR  75           HD2      TYR  75   1.535  -4.862   4.755
  616    HE1  TYR  75           HE1      TYR  75   2.627  -5.204   9.549
  617    HE2  TYR  75           HE2      TYR  75   0.016  -6.026   6.284
  618    HH   TYR  75           HH       TYR  75   0.061  -7.134   8.417
  619    H    THR  76           H        THR  76   7.010  -2.828   5.346
  620    HA   THR  76           HA       THR  76   8.189  -4.363   7.577
  621    HB   THR  76           HB       THR  76   9.525  -2.243   5.812
  622    HG1  THR  76           HG1      THR  76   9.212  -4.995   5.605
  623   HG21  THR  76          3HG2      THR  76  11.635  -3.048   6.907
  624   HG22  THR  76          1HG2      THR  76  10.673  -4.086   7.962
  625   HG23  THR  76          2HG2      THR  76  10.529  -2.332   8.080
  626    H    ILE  77           H        ILE  77   7.736  -3.565   9.495
  627    HA   ILE  77           HA       ILE  77   8.089  -0.784  10.198
  628    HB   ILE  77           HB       ILE  77   5.891  -0.875  11.655
  629   HG12  ILE  77          2HG1      ILE  77   5.061  -2.819   9.450
  630   HG13  ILE  77          3HG1      ILE  77   5.303  -3.235  11.141
  631   HG21  ILE  77          1HG2      ILE  77   5.649  -0.354   8.688
  632   HG22  ILE  77          2HG2      ILE  77   6.241   0.783   9.899
  633   HG23  ILE  77          3HG2      ILE  77   4.559   0.252   9.940
  634   HD11  ILE  77          3HD1      ILE  77   3.170  -1.405  10.046
  635   HD12  ILE  77          1HD1      ILE  77   3.439  -1.756  11.757
  636   HD13  ILE  77          2HD1      ILE  77   2.962  -3.047  10.657
  637    H    ARG  78           H        ARG  78   9.445  -0.962  11.872
  638    HA   ARG  78           HA       ARG  78   9.133  -3.170  13.835
  639    HB2  ARG  78           2HB      ARG  78  11.710  -1.824  12.924
  640    HB3  ARG  78           3HB      ARG  78  11.600  -3.008  14.223
  641    HG2  ARG  78           2HG      ARG  78  10.756  -4.678  12.543
  642    HG3  ARG  78           3HG      ARG  78  11.042  -3.475  11.282
  643    HD2  ARG  78           2HD      ARG  78  13.130  -4.658  13.130
  644    HD3  ARG  78           3HD      ARG  78  12.909  -5.042  11.419
  645    HE   ARG  78           HE       ARG  78  13.290  -2.275  11.671
  646   HH11  ARG  78          1HH1      ARG  78  15.193  -5.219  12.042
  647   HH12  ARG  78          2HH1      ARG  78  16.693  -4.430  11.669
  648   HH21  ARG  78          1HH2      ARG  78  15.254  -1.268  11.211
  649   HH22  ARG  78          2HH2      ARG  78  16.722  -2.195  11.200
  650    H    GLY  79           H        GLY  79   8.091  -2.229  15.418
  651    HA2  GLY  79           2HA      GLY  79   9.058   0.311  16.636
  652    HA3  GLY  79           3HA      GLY  79   7.344  -0.046  16.405
  653    H    SER  80           H        SER  80  10.266  -1.523  17.739
  654    HA   SER  80           HA       SER  80  10.762  -2.704  19.589
  655    HB2  SER  80           2HB      SER  80   9.898  -0.627  20.731
  656    HB3  SER  80           3HB      SER  80   8.308  -1.383  20.843
  657    HG   SER  80           HG       SER  80  10.618  -2.632  21.890
  658    H    LEU  81           H        LEU  81   9.275  -3.948  17.559
  659    HA   LEU  81           HA       LEU  81   7.154  -5.601  18.291
  660    HB2  LEU  81           2HB      LEU  81   9.449  -6.110  16.349
  661    HB3  LEU  81           3HB      LEU  81   8.093  -7.216  16.512
  662    HG   LEU  81           HG       LEU  81   7.903  -4.325  15.582
  663   HD11  LEU  81          1HD1      LEU  81   7.683  -6.915  14.004
  664   HD12  LEU  81          2HD1      LEU  81   9.000  -5.739  13.921
  665   HD13  LEU  81          3HD1      LEU  81   7.388  -5.289  13.376
  666   HD21  LEU  81          3HD2      LEU  81   5.730  -6.449  15.809
  667   HD22  LEU  81          1HD2      LEU  81   5.544  -4.877  15.024
  668   HD23  LEU  81          2HD2      LEU  81   5.856  -4.963  16.754
  669    H    GLU  82           H        GLU  82  10.583  -6.426  18.226
  670    HA   GLU  82           HA       GLU  82  10.372  -8.845  19.695
  671    HB2  GLU  82           2HB      GLU  82  12.849  -8.752  19.784
  672    HB3  GLU  82           3HB      GLU  82  12.260  -8.437  18.156
  673    HG2  GLU  82           2HG      GLU  82  12.614  -5.995  18.523
  674    HG3  GLU  82           3HG      GLU  82  13.236  -6.347  20.132
  675    H    HIS  83           H        HIS  83   9.993  -9.020  21.818
  676    HA   HIS  83           HA       HIS  83  10.297  -6.844  23.698
  677    HB2  HIS  83           2HB      HIS  83   9.695  -9.805  24.198
  678    HB3  HIS  83           3HB      HIS  83   9.553  -8.512  25.389
  679    HD1  HIS  83           HD1      HIS  83   7.436 -10.460  23.408
  680    HD2  HIS  83           HD2      HIS  83   7.693  -6.373  24.103
  681    HE1  HIS  83           HE1      HIS  83   5.205  -9.527  22.740
  682    HE2  HIS  83           HE2      HIS  83   5.449  -7.040  23.007
  683    H    HIS  84           H        HIS  84  12.392  -6.241  23.808
  684    HA   HIS  84           HA       HIS  84  14.608  -7.995  23.558
  685    HB2  HIS  84           2HB      HIS  84  14.605  -5.520  22.941
  686    HB3  HIS  84           3HB      HIS  84  14.691  -5.147  24.661
  687    HD1  HIS  84           HD1      HIS  84  17.005  -4.898  25.543
  688    HD2  HIS  84           HD2      HIS  84  16.914  -7.207  22.092
  689    HE1  HIS  84           HE1      HIS  84  19.398  -5.467  25.047
  690    HE2  HIS  84           HE2      HIS  84  19.296  -7.016  23.069
  691    H    HIS  85           H        HIS  85  13.029  -6.457  26.347
  692    HA   HIS  85           HA       HIS  85  13.700  -8.717  27.975
  693    HB2  HIS  85           2HB      HIS  85  15.012  -7.664  29.710
  694    HB3  HIS  85           3HB      HIS  85  15.818  -7.287  28.193
  695    HD1  HIS  85           HD1      HIS  85  15.181  -5.713  31.238
  696    HD2  HIS  85           HD2      HIS  85  14.616  -4.517  27.295
  697    HE1  HIS  85           HE1      HIS  85  15.034  -3.211  31.301
  698    HE2  HIS  85           HE2      HIS  85  14.516  -2.530  28.945
  699    H    HIS  86           H        HIS  86  12.070  -9.014  29.432
  700    HA   HIS  86           HA       HIS  86  10.016  -6.978  29.834
  701    HB2  HIS  86           2HB      HIS  86  10.354  -9.818  30.901
  702    HB3  HIS  86           3HB      HIS  86   9.002  -8.783  31.350
  703    HD1  HIS  86           HD1      HIS  86   7.048  -8.700  29.773
  704    HD2  HIS  86           HD2      HIS  86  10.333 -10.581  28.072
  705    HE1  HIS  86           HE1      HIS  86   6.218  -9.702  27.634
  706    HE2  HIS  86           HE2      HIS  86   8.145 -11.062  26.803
  707    H    HIS  87           H        HIS  87   9.738  -5.794  31.744
  708    HA   HIS  87           HA       HIS  87  11.632  -6.149  33.968
  709    HB2  HIS  87           2HB      HIS  87  12.705  -4.540  32.393
  710    HB3  HIS  87           3HB      HIS  87  11.277  -3.515  32.455
  711    HD1  HIS  87           HD1      HIS  87  14.278  -4.528  34.456
  712    HD2  HIS  87           HD2      HIS  87  11.071  -1.904  34.768
  713    HE1  HIS  87           HE1      HIS  87  14.839  -2.998  36.363
  714    HE2  HIS  87           HE2      HIS  87  12.877  -1.444  36.556
  715    H    HIS  88           H        HIS  88  10.323  -6.370  35.643
  716    HA   HIS  88           HA       HIS  88   7.779  -4.961  35.910
  717    HB2  HIS  88           2HB      HIS  88   9.156  -7.028  37.700
  718    HB3  HIS  88           3HB      HIS  88   7.612  -6.275  38.089
  719    HD1  HIS  88           HD1      HIS  88   5.727  -7.764  37.540
  720    HD2  HIS  88           HD2      HIS  88   8.891  -8.327  34.911
  721    HE1  HIS  88           HE1      HIS  88   4.999  -9.602  36.002
  722    HE2  HIS  88           HE2      HIS  88   6.950  -9.970  34.475
  Start of MODEL   17
    1    H1   MET   1           1H       MET   1  13.027   6.400  12.283
    2    H2   MET   1           2H       MET   1  12.647   7.339  13.633
    3    H3   MET   1           3H       MET   1  11.442   6.428  12.878
    4    HA   MET   1           HA       MET   1  13.804   5.402  14.325
    5    HB2  MET   1           2HB      MET   1  12.306   4.670  16.056
    6    HB3  MET   1           3HB      MET   1  11.913   6.349  15.721
    7    HG2  MET   1           2HG      MET   1  10.348   3.924  14.797
    8    HG3  MET   1           3HG      MET   1   9.887   5.048  16.075
    9    HE1  MET   1           3HE      MET   1   7.497   5.337  14.971
   10    HE2  MET   1           1HE      MET   1   7.928   4.225  13.667
   11    HE3  MET   1           2HE      MET   1   7.242   5.806  13.291
   12    H    GLY   2           H        GLY   2  11.466   4.841  11.914
   13    HA2  GLY   2           2HA      GLY   2  12.396   2.517  10.835
   14    HA3  GLY   2           3HA      GLY   2  11.262   1.982  12.080
   15    H    GLU   3           H        GLU   3  11.612   3.632   9.020
   16    HA   GLU   3           HA       GLU   3   8.844   4.462   8.822
   17    HB2  GLU   3           2HB      GLU   3   9.434   5.369   6.648
   18    HB3  GLU   3           3HB      GLU   3  10.662   5.815   7.831
   19    HG2  GLU   3           2HG      GLU   3  12.070   3.894   6.943
   20    HG3  GLU   3           3HG      GLU   3  10.875   3.708   5.658
   21    H    MET   4           H        MET   4   7.781   3.893   6.523
   22    HA   MET   4           HA       MET   4   7.470   0.961   6.706
   23    HB2  MET   4           2HB      MET   4   5.647   2.246   7.811
   24    HB3  MET   4           3HB      MET   4   5.287   3.046   6.281
   25    HG2  MET   4           2HG      MET   4   4.643   0.897   5.298
   26    HG3  MET   4           3HG      MET   4   5.093   0.068   6.794
   27    HE1  MET   4           3HE      MET   4   1.342  -0.363   7.304
   28    HE2  MET   4           1HE      MET   4   2.941  -1.054   7.571
   29    HE3  MET   4           2HE      MET   4   2.376  -0.740   5.929
   30    H    ASP   5           H        ASP   5   7.741  -0.154   4.887
   31    HA   ASP   5           HA       ASP   5   7.260   1.098   2.251
   32    HB2  ASP   5           2HB      ASP   5   9.116  -1.270   2.839
   33    HB3  ASP   5           3HB      ASP   5   8.941  -0.406   1.312
   34    H    ILE   6           H        ILE   6   5.500   0.181   1.302
   35    HA   ILE   6           HA       ILE   6   4.456  -2.415   2.299
   36    HB   ILE   6           HB       ILE   6   2.834  -0.119   1.089
   37   HG12  ILE   6          2HG1      ILE   6   3.087  -0.864   4.036
   38   HG13  ILE   6          3HG1      ILE   6   3.838   0.539   3.287
   39   HG21  ILE   6          1HG2      ILE   6   1.791  -2.329   0.801
   40   HG22  ILE   6          2HG2      ILE   6   0.867  -1.353   1.944
   41   HG23  ILE   6          3HG2      ILE   6   1.926  -2.637   2.536
   42   HD11  ILE   6          3HD1      ILE   6   1.873   1.193   4.486
   43   HD12  ILE   6          1HD1      ILE   6   0.881   0.042   3.591
   44   HD13  ILE   6          2HD1      ILE   6   1.605   1.423   2.761
   45    H    ARG   7           H        ARG   7   4.986  -3.887   0.760
   46    HA   ARG   7           HA       ARG   7   4.984  -3.133  -2.092
   47    HB2  ARG   7           2HB      ARG   7   7.146  -3.917  -1.277
   48    HB3  ARG   7           3HB      ARG   7   6.413  -5.361  -0.598
   49    HG2  ARG   7           2HG      ARG   7   5.854  -6.127  -2.904
   50    HG3  ARG   7           3HG      ARG   7   6.660  -4.698  -3.547
   51    HD2  ARG   7           2HD      ARG   7   8.019  -6.803  -1.835
   52    HD3  ARG   7           3HD      ARG   7   8.047  -6.786  -3.599
   53    HE   ARG   7           HE       ARG   7   9.244  -4.674  -1.881
   54   HH11  ARG   7          1HH1      ARG   7   9.291  -6.577  -4.854
   55   HH12  ARG   7          2HH1      ARG   7  10.766  -5.872  -5.414
   56   HH21  ARG   7          1HH2      ARG   7  11.194  -3.787  -2.644
   57   HH22  ARG   7          2HH2      ARG   7  11.849  -4.287  -4.166
   58    H    PHE   8           H        PHE   8   3.391  -3.878  -3.326
   59    HA   PHE   8           HA       PHE   8   1.744  -6.204  -2.536
   60    HB2  PHE   8           2HB      PHE   8   1.202  -3.879  -4.442
   61    HB3  PHE   8           3HB      PHE   8   0.163  -5.294  -4.351
   62    HD1  PHE   8           HD1      PHE   8   1.282  -2.248  -2.550
   63    HD2  PHE   8           HD2      PHE   8  -1.383  -5.601  -2.499
   64    HE1  PHE   8           HE1      PHE   8  -0.037  -1.194  -0.766
   65    HE2  PHE   8           HE2      PHE   8  -2.690  -4.534  -0.716
   66    HZ   PHE   8           HZ       PHE   8  -2.019  -2.330   0.154
   67    H    ARG   9           H        ARG   9   1.493  -7.892  -4.030
   68    HA   ARG   9           HA       ARG   9   3.016  -7.908  -6.544
   69    HB2  ARG   9           2HB      ARG   9   4.416  -8.792  -4.498
   70    HB3  ARG   9           3HB      ARG   9   3.323 -10.164  -4.513
   71    HG2  ARG   9           2HG      ARG   9   4.031 -10.755  -6.784
   72    HG3  ARG   9           3HG      ARG   9   5.066  -9.326  -6.853
   73    HD2  ARG   9           2HD      ARG   9   6.382 -10.245  -4.933
   74    HD3  ARG   9           3HD      ARG   9   5.387 -11.704  -4.991
   75    HE   ARG   9           HE       ARG   9   6.360 -11.472  -7.521
   76   HH11  ARG   9          1HH1      ARG   9   7.873 -11.649  -4.358
   77   HH12  ARG   9          2HH1      ARG   9   9.323 -12.388  -4.959
   78   HH21  ARG   9          1HH2      ARG   9   8.290 -12.376  -8.313
   79   HH22  ARG   9          2HH2      ARG   9   9.559 -12.799  -7.208
   80    H    GLY  10           H        GLY  10   1.769  -8.987  -8.127
   81    HA2  GLY  10           2HA      GLY  10  -0.336 -10.846  -7.300
   82    HA3  GLY  10           3HA      GLY  10  -0.913  -9.267  -7.813
   83    H    ASP  11           H        ASP  11  -1.552 -11.748  -8.914
   84    HA   ASP  11           HA       ASP  11  -0.320 -12.408 -11.350
   85    HB2  ASP  11           2HB      ASP  11  -1.929 -13.883 -10.218
   86    HB3  ASP  11           3HB      ASP  11  -3.208 -12.687 -10.395
   87    H    ASP  12           H        ASP  12  -2.748 -10.024 -10.511
   88    HA   ASP  12           HA       ASP  12  -3.037  -9.134 -13.319
   89    HB2  ASP  12           2HB      ASP  12  -5.092  -9.980 -12.097
   90    HB3  ASP  12           3HB      ASP  12  -4.913  -8.650 -10.959
   91    H    LEU  13           H        LEU  13  -1.942  -7.331 -13.799
   92    HA   LEU  13           HA       LEU  13  -0.577  -5.627 -12.055
   93    HB2  LEU  13           2HB      LEU  13  -0.141  -5.998 -14.518
   94    HB3  LEU  13           3HB      LEU  13  -1.507  -4.968 -14.881
   95    HG   LEU  13           HG       LEU  13   0.923  -3.920 -13.347
   96   HD11  LEU  13          1HD1      LEU  13   1.822  -3.070 -15.481
   97   HD12  LEU  13          2HD1      LEU  13   0.548  -3.924 -16.359
   98   HD13  LEU  13          3HD1      LEU  13   1.759  -4.830 -15.447
   99   HD21  LEU  13          3HD2      LEU  13   0.228  -1.700 -14.214
  100   HD22  LEU  13          1HD2      LEU  13  -1.046  -2.439 -13.246
  101   HD23  LEU  13          2HD2      LEU  13  -1.166  -2.445 -15.006
  102    H    GLU  14           H        GLU  14  -3.893  -5.403 -13.319
  103    HA   GLU  14           HA       GLU  14  -4.263  -2.625 -12.611
  104    HB2  GLU  14           2HB      GLU  14  -6.327  -4.735 -13.324
  105    HB3  GLU  14           3HB      GLU  14  -6.706  -3.036 -13.040
  106    HG2  GLU  14           2HG      GLU  14  -5.256  -2.411 -14.946
  107    HG3  GLU  14           3HG      GLU  14  -4.932  -4.121 -15.251
  108    H    ALA  15           H        ALA  15  -4.804  -5.738 -11.046
  109    HA   ALA  15           HA       ALA  15  -6.390  -4.889  -8.862
  110    HB1  ALA  15           3HB      ALA  15  -6.109  -7.258  -9.461
  111    HB2  ALA  15           1HB      ALA  15  -5.586  -6.992  -7.799
  112    HB3  ALA  15           2HB      ALA  15  -4.387  -7.177  -9.078
  113    H    LEU  16           H        LEU  16  -2.893  -5.055  -9.410
  114    HA   LEU  16           HA       LEU  16  -1.987  -4.032  -6.915
  115    HB2  LEU  16           2HB      LEU  16  -0.651  -3.938  -9.651
  116    HB3  LEU  16           3HB      LEU  16   0.161  -3.660  -8.115
  117    HG   LEU  16           HG       LEU  16  -1.103  -6.294  -8.975
  118   HD11  LEU  16          1HD1      LEU  16   1.823  -5.523  -8.857
  119   HD12  LEU  16          2HD1      LEU  16   0.867  -5.792 -10.319
  120   HD13  LEU  16          3HD1      LEU  16   1.179  -7.132  -9.217
  121   HD21  LEU  16          3HD2      LEU  16   0.577  -5.640  -6.533
  122   HD22  LEU  16          1HD2      LEU  16   0.013  -7.245  -7.008
  123   HD23  LEU  16          2HD2      LEU  16  -1.150  -6.010  -6.546
  124    H    GLU  17           H        GLU  17  -2.937  -2.524  -9.976
  125    HA   GLU  17           HA       GLU  17  -1.889   0.058  -9.589
  126    HB2  GLU  17           2HB      GLU  17  -2.440  -0.935 -11.792
  127    HB3  GLU  17           3HB      GLU  17  -4.149  -0.962 -11.353
  128    HG2  GLU  17           2HG      GLU  17  -4.023   1.548 -11.139
  129    HG3  GLU  17           3HG      GLU  17  -2.412   1.448 -11.838
  130    H    LYS  18           H        LYS  18  -5.135  -1.333  -9.025
  131    HA   LYS  18           HA       LYS  18  -6.255   1.181  -8.158
  132    HB2  LYS  18           2HB      LYS  18  -7.403  -1.627  -8.266
  133    HB3  LYS  18           3HB      LYS  18  -8.255  -0.334  -7.437
  134    HG2  LYS  18           2HG      LYS  18  -9.238  -0.442  -9.587
  135    HG3  LYS  18           3HG      LYS  18  -8.188   0.976  -9.631
  136    HD2  LYS  18           2HD      LYS  18  -6.487  -0.302 -10.864
  137    HD3  LYS  18           3HD      LYS  18  -7.468  -1.761 -10.744
  138    HE2  LYS  18           2HE      LYS  18  -7.737  -0.886 -12.965
  139    HE3  LYS  18           3HE      LYS  18  -9.244  -0.589 -12.099
  140    HZ1  LYS  18           3HZ      LYS  18  -8.429   1.701 -11.686
  141    HZ2  LYS  18           1HZ      LYS  18  -8.660   1.359 -13.326
  142    HZ3  LYS  18           2HZ      LYS  18  -7.099   1.382 -12.674
  143    H    ALA  19           H        ALA  19  -4.883  -1.737  -6.598
  144    HA   ALA  19           HA       ALA  19  -5.429  -1.077  -3.900
  145    HB1  ALA  19           3HB      ALA  19  -2.992  -2.513  -5.027
  146    HB2  ALA  19           1HB      ALA  19  -4.514  -3.275  -4.551
  147    HB3  ALA  19           2HB      ALA  19  -3.494  -2.505  -3.334
  148    H    LEU  20           H        LEU  20  -2.737  -0.237  -6.038
  149    HA   LEU  20           HA       LEU  20  -1.158   1.391  -4.465
  150    HB2  LEU  20           2HB      LEU  20  -0.485   0.703  -6.691
  151    HB3  LEU  20           3HB      LEU  20  -1.843   1.534  -7.417
  152    HG   LEU  20           HG       LEU  20  -0.841   3.731  -6.742
  153   HD11  LEU  20          1HD1      LEU  20   1.480   3.839  -5.993
  154   HD12  LEU  20          2HD1      LEU  20   1.534   2.078  -5.863
  155   HD13  LEU  20          3HD1      LEU  20   0.457   3.015  -4.821
  156   HD21  LEU  20          3HD2      LEU  20   0.959   2.002  -8.455
  157   HD22  LEU  20          1HD2      LEU  20   0.921   3.769  -8.430
  158   HD23  LEU  20          2HD2      LEU  20  -0.483   2.867  -8.996
  159    H    LYS  21           H        LYS  21  -3.879   2.374  -6.574
  160    HA   LYS  21           HA       LYS  21  -3.841   5.124  -6.087
  161    HB2  LYS  21           2HB      LYS  21  -5.022   3.961  -7.959
  162    HB3  LYS  21           3HB      LYS  21  -6.226   3.365  -6.828
  163    HG2  LYS  21           2HG      LYS  21  -5.783   6.342  -7.163
  164    HG3  LYS  21           3HG      LYS  21  -6.746   5.455  -8.341
  165    HD2  LYS  21           2HD      LYS  21  -7.332   5.685  -5.356
  166    HD3  LYS  21           3HD      LYS  21  -8.169   6.550  -6.646
  167    HE2  LYS  21           2HE      LYS  21  -8.964   4.366  -7.548
  168    HE3  LYS  21           3HE      LYS  21  -8.176   3.543  -6.197
  169    HZ1  LYS  21           3HZ      LYS  21 -10.335   5.562  -5.965
  170    HZ2  LYS  21           1HZ      LYS  21  -9.592   4.751  -4.679
  171    HZ3  LYS  21           2HZ      LYS  21 -10.523   3.892  -5.793
  172    H    GLU  22           H        GLU  22  -5.476   2.496  -4.391
  173    HA   GLU  22           HA       GLU  22  -6.938   4.040  -2.524
  174    HB2  GLU  22           2HB      GLU  22  -5.936   1.173  -2.411
  175    HB3  GLU  22           3HB      GLU  22  -6.984   1.871  -1.182
  176    HG2  GLU  22           2HG      GLU  22  -7.736   1.673  -4.118
  177    HG3  GLU  22           3HG      GLU  22  -8.130   0.443  -2.916
  178    H    MET  23           H        MET  23  -3.681   2.538  -2.325
  179    HA   MET  23           HA       MET  23  -3.220   3.277   0.411
  180    HB2  MET  23           2HB      MET  23  -1.227   2.438  -1.723
  181    HB3  MET  23           3HB      MET  23  -0.861   2.592  -0.005
  182    HG2  MET  23           2HG      MET  23  -2.792   0.633  -1.267
  183    HG3  MET  23           3HG      MET  23  -1.216   0.262  -0.574
  184    HE1  MET  23           3HE      MET  23  -0.710   0.248   2.011
  185    HE2  MET  23           1HE      MET  23  -1.862   0.745   3.251
  186    HE3  MET  23           2HE      MET  23  -1.186   1.943   2.146
  187    H    ILE  24           H        ILE  24  -2.502   4.861  -2.658
  188    HA   ILE  24           HA       ILE  24  -0.895   6.993  -1.667
  189    HB   ILE  24           HB       ILE  24  -2.675   6.800  -4.145
  190   HG12  ILE  24          2HG1      ILE  24   0.361   6.632  -3.838
  191   HG13  ILE  24          3HG1      ILE  24  -0.717   5.287  -4.185
  192   HG21  ILE  24          1HG2      ILE  24  -2.491   9.174  -3.542
  193   HG22  ILE  24          2HG2      ILE  24  -1.562   8.847  -5.003
  194   HG23  ILE  24          3HG2      ILE  24  -0.733   9.037  -3.458
  195   HD11  ILE  24          3HD1      ILE  24  -0.155   7.630  -6.008
  196   HD12  ILE  24          1HD1      ILE  24  -1.266   6.301  -6.355
  197   HD13  ILE  24          2HD1      ILE  24   0.458   5.986  -6.175
  198    H    ARG  25           H        ARG  25  -4.351   6.710  -2.446
  199    HA   ARG  25           HA       ARG  25  -5.495   9.033  -1.564
  200    HB2  ARG  25           2HB      ARG  25  -6.904   7.474  -2.634
  201    HB3  ARG  25           3HB      ARG  25  -6.350   6.141  -1.643
  202    HG2  ARG  25           2HG      ARG  25  -7.658   7.150   0.282
  203    HG3  ARG  25           3HG      ARG  25  -8.358   8.275  -0.889
  204    HD2  ARG  25           2HD      ARG  25  -9.287   6.388  -2.172
  205    HD3  ARG  25           3HD      ARG  25  -8.519   5.236  -1.068
  206    HE   ARG  25           HE       ARG  25 -10.159   7.012   0.384
  207   HH11  ARG  25          1HH1      ARG  25 -10.498   4.243  -1.763
  208   HH12  ARG  25          2HH1      ARG  25 -12.015   3.764  -1.078
  209   HH21  ARG  25          1HH2      ARG  25 -12.111   6.339   1.272
  210   HH22  ARG  25          2HH2      ARG  25 -12.927   4.948   0.639
  211    H    GLN  26           H        GLN  26  -4.663   6.185   0.441
  212    HA   GLN  26           HA       GLN  26  -5.631   7.240   2.901
  213    HB2  GLN  26           2HB      GLN  26  -3.539   5.053   2.571
  214    HB3  GLN  26           3HB      GLN  26  -4.509   5.377   4.004
  215    HG2  GLN  26           2HG      GLN  26  -5.397   4.197   1.373
  216    HG3  GLN  26           3HG      GLN  26  -5.438   3.453   2.962
  217   HE21  GLN  26          1HE2      GLN  26  -7.549   3.862   0.935
  218   HE22  GLN  26          2HE2      GLN  26  -8.835   4.674   1.753
  219    H    ALA  27           H        ALA  27  -2.353   6.978   1.511
  220    HA   ALA  27           HA       ALA  27  -0.880   8.054   3.639
  221    HB1  ALA  27           3HB      ALA  27   0.138   6.821   1.764
  222    HB2  ALA  27           1HB      ALA  27   0.917   8.391   1.987
  223    HB3  ALA  27           2HB      ALA  27  -0.236   8.154   0.669
  224    H    ARG  28           H        ARG  28  -2.700   9.680   1.090
  225    HA   ARG  28           HA       ARG  28  -1.552  12.296   1.520
  226    HB2  ARG  28           2HB      ARG  28  -4.012  11.458  -0.064
  227    HB3  ARG  28           3HB      ARG  28  -3.322  13.081  -0.060
  228    HG2  ARG  28           2HG      ARG  28  -1.200  12.110  -1.014
  229    HG3  ARG  28           3HG      ARG  28  -2.017  10.554  -1.127
  230    HD2  ARG  28           2HD      ARG  28  -2.718  13.110  -2.599
  231    HD3  ARG  28           3HD      ARG  28  -2.112  11.603  -3.292
  232    HE   ARG  28           HE       ARG  28  -4.597  11.220  -1.917
  233   HH11  ARG  28          1HH1      ARG  28  -3.289  12.374  -4.983
  234   HH12  ARG  28          2HH1      ARG  28  -4.757  12.066  -5.852
  235   HH21  ARG  28          1HH2      ARG  28  -6.523  10.914  -3.047
  236   HH22  ARG  28          2HH2      ARG  28  -6.593  11.237  -4.749
  237    H    LYS  29           H        LYS  29  -4.698  10.708   2.362
  238    HA   LYS  29           HA       LYS  29  -5.787  12.992   3.704
  239    HB2  LYS  29           2HB      LYS  29  -7.516  11.502   4.607
  240    HB3  LYS  29           3HB      LYS  29  -7.254  11.161   2.901
  241    HG2  LYS  29           2HG      LYS  29  -5.881   9.198   3.519
  242    HG3  LYS  29           3HG      LYS  29  -6.186   9.519   5.225
  243    HD2  LYS  29           2HD      LYS  29  -8.461   9.032   3.275
  244    HD3  LYS  29           3HD      LYS  29  -7.584   7.690   3.999
  245    HE2  LYS  29           2HE      LYS  29  -9.604   8.076   5.270
  246    HE3  LYS  29           3HE      LYS  29  -8.223   8.536   6.263
  247    HZ1  LYS  29           3HZ      LYS  29  -9.946  10.428   4.756
  248    HZ2  LYS  29           1HZ      LYS  29  -8.675  10.839   5.790
  249    HZ3  LYS  29           2HZ      LYS  29 -10.064  10.106   6.408
  250    H    PHE  30           H        PHE  30  -3.644  10.412   4.718
  251    HA   PHE  30           HA       PHE  30  -3.661  11.167   7.529
  252    HB2  PHE  30           2HB      PHE  30  -1.984   9.138   5.995
  253    HB3  PHE  30           3HB      PHE  30  -1.860   9.400   7.732
  254    HD1  PHE  30           HD1      PHE  30  -4.713   9.632   8.524
  255    HD2  PHE  30           HD2      PHE  30  -2.841   6.933   5.796
  256    HE1  PHE  30           HE1      PHE  30  -6.478   7.978   8.933
  257    HE2  PHE  30           HE2      PHE  30  -4.615   5.287   6.204
  258    HZ   PHE  30           HZ       PHE  30  -6.439   5.805   7.774
  259    H    ALA  31           H        ALA  31  -2.458  12.694   4.945
  260    HA   ALA  31           HA       ALA  31  -1.237  14.566   4.762
  261    HB1  ALA  31           3HB      ALA  31  -2.113  15.143   6.993
  262    HB2  ALA  31           1HB      ALA  31  -0.481  15.779   6.765
  263    HB3  ALA  31           2HB      ALA  31  -0.741  14.334   7.748
  264    H    GLY  32           H        GLY  32   0.038  11.731   4.863
  265    HA2  GLY  32           2HA      GLY  32   2.891  12.376   5.248
  266    HA3  GLY  32           3HA      GLY  32   2.185  10.785   5.000
  267    H    THR  33           H        THR  33   4.257  11.002   3.571
  268    HA   THR  33           HA       THR  33   3.620  11.990   0.854
  269    HB   THR  33           HB       THR  33   6.286  11.388   2.220
  270    HG1  THR  33           HG1      THR  33   4.997  13.450   2.520
  271   HG21  THR  33          3HG2      THR  33   7.415  12.153   0.164
  272   HG22  THR  33          1HG2      THR  33   5.855  12.324  -0.647
  273   HG23  THR  33          2HG2      THR  33   6.433  10.724  -0.174
  274    H    VAL  34           H        VAL  34   3.881  10.509  -0.906
  275    HA   VAL  34           HA       VAL  34   4.393   7.676  -0.285
  276    HB   VAL  34           HB       VAL  34   1.955   7.962  -0.287
  277   HG11  VAL  34          1HG1      VAL  34   2.187   9.104  -3.094
  278   HG12  VAL  34          2HG1      VAL  34   1.752  10.002  -1.638
  279   HG13  VAL  34          3HG1      VAL  34   0.681   8.738  -2.244
  280   HG21  VAL  34          3HG2      VAL  34   2.808   5.851  -1.187
  281   HG22  VAL  34          1HG2      VAL  34   2.868   6.541  -2.813
  282   HG23  VAL  34          2HG2      VAL  34   1.314   6.312  -2.004
  283    H    THR  35           H        THR  35   5.651   6.676  -1.768
  284    HA   THR  35           HA       THR  35   6.007   7.709  -4.500
  285    HB   THR  35           HB       THR  35   8.325   7.053  -2.603
  286    HG1  THR  35           HG1      THR  35   7.083   9.417  -3.363
  287   HG21  THR  35          3HG2      THR  35   8.871   6.354  -4.906
  288   HG22  THR  35          1HG2      THR  35   9.813   7.780  -4.455
  289   HG23  THR  35          2HG2      THR  35   8.410   7.947  -5.512
  290    H    TYR  36           H        TYR  36   6.161   5.994  -5.963
  291    HA   TYR  36           HA       TYR  36   6.151   3.236  -4.857
  292    HB2  TYR  36           2HB      TYR  36   4.150   2.709  -6.234
  293    HB3  TYR  36           3HB      TYR  36   3.814   3.951  -5.036
  294    HD1  TYR  36           HD2      TYR  36   3.444   6.322  -5.743
  295    HD2  TYR  36           HD1      TYR  36   4.049   3.236  -8.653
  296    HE1  TYR  36           HE2      TYR  36   2.599   7.810  -7.505
  297    HE2  TYR  36           HE1      TYR  36   3.207   4.732 -10.408
  298    HH   TYR  36           HH       TYR  36   1.817   6.705 -10.647
  299    H    THR  37           H        THR  37   6.600   1.589  -6.341
  300    HA   THR  37           HA       THR  37   7.717   2.361  -8.977
  301    HB   THR  37           HB       THR  37   8.725   0.127  -7.158
  302    HG1  THR  37           HG1      THR  37   9.566   1.837  -6.185
  303   HG21  THR  37          3HG2      THR  37   9.893   1.258  -9.732
  304   HG22  THR  37          1HG2      THR  37   9.116  -0.321  -9.568
  305   HG23  THR  37          2HG2      THR  37  10.636   0.010  -8.730
  306    H    LEU  38           H        LEU  38   5.999   1.757 -10.279
  307    HA   LEU  38           HA       LEU  38   4.798  -0.908 -10.137
  308    HB2  LEU  38           2HB      LEU  38   4.472   1.428 -12.063
  309    HB3  LEU  38           3HB      LEU  38   3.692  -0.123 -12.339
  310    HG   LEU  38           HG       LEU  38   3.191   1.663  -9.921
  311   HD11  LEU  38          1HD1      LEU  38   2.313   2.710 -11.935
  312   HD12  LEU  38          2HD1      LEU  38   0.996   2.125 -10.923
  313   HD13  LEU  38          3HD1      LEU  38   1.459   1.228 -12.371
  314   HD21  LEU  38          3HD2      LEU  38   1.789  -0.888 -10.797
  315   HD22  LEU  38          1HD2      LEU  38   1.309   0.153  -9.449
  316   HD23  LEU  38          2HD2      LEU  38   2.850  -0.699  -9.394
  317    H    ASP  39           H        ASP  39   5.997  -2.584 -10.881
  318    HA   ASP  39           HA       ASP  39   7.402  -2.381 -13.457
  319    HB2  ASP  39           2HB      ASP  39   9.062  -1.877 -11.585
  320    HB3  ASP  39           3HB      ASP  39   8.793  -3.506 -10.975
  321    H    GLY  40           H        GLY  40   5.905  -3.700 -14.383
  322    HA2  GLY  40           2HA      GLY  40   5.106  -5.668 -15.216
  323    HA3  GLY  40           3HA      GLY  40   6.255  -6.518 -14.191
  324    H    ASN  41           H        ASN  41   5.399  -7.747 -12.658
  325    HA   ASN  41           HA       ASN  41   2.644  -7.241 -11.663
  326    HB2  ASN  41           2HB      ASN  41   4.192  -9.849 -11.991
  327    HB3  ASN  41           3HB      ASN  41   2.683  -9.733 -11.099
  328   HD21  ASN  41          1HD2      ASN  41   0.760  -9.190 -12.244
  329   HD22  ASN  41          2HD2      ASN  41   0.623  -9.513 -13.939
  330    H    ASP  42           H        ASP  42   5.270  -6.126 -10.715
  331    HA   ASP  42           HA       ASP  42   4.841  -6.720  -7.850
  332    HB2  ASP  42           2HB      ASP  42   6.950  -7.815  -8.526
  333    HB3  ASP  42           3HB      ASP  42   7.542  -6.303  -9.213
  334    H    LEU  43           H        LEU  43   4.807  -4.986  -6.558
  335    HA   LEU  43           HA       LEU  43   5.404  -2.265  -7.526
  336    HB2  LEU  43           2HB      LEU  43   3.061  -2.405  -7.959
  337    HB3  LEU  43           3HB      LEU  43   2.765  -3.363  -6.521
  338    HG   LEU  43           HG       LEU  43   3.165  -1.325  -5.102
  339   HD11  LEU  43          1HD1      LEU  43   3.307   0.192  -7.717
  340   HD12  LEU  43          2HD1      LEU  43   4.612  -0.027  -6.551
  341   HD13  LEU  43          3HD1      LEU  43   3.188   0.911  -6.107
  342   HD21  LEU  43          3HD2      LEU  43   0.901  -2.007  -5.718
  343   HD22  LEU  43          1HD2      LEU  43   0.976  -1.001  -7.168
  344   HD23  LEU  43          2HD2      LEU  43   1.026  -0.256  -5.566
  345    H    GLU  44           H        GLU  44   6.735  -1.343  -6.002
  346    HA   GLU  44           HA       GLU  44   6.178  -1.953  -3.147
  347    HB2  GLU  44           2HB      GLU  44   8.457  -2.655  -3.795
  348    HB3  GLU  44           3HB      GLU  44   8.830  -1.003  -4.290
  349    HG2  GLU  44           2HG      GLU  44   8.543  -0.205  -1.985
  350    HG3  GLU  44           3HG      GLU  44   8.025  -1.809  -1.467
  351    H    ILE  45           H        ILE  45   5.054  -0.452  -2.280
  352    HA   ILE  45           HA       ILE  45   5.201   2.398  -2.977
  353    HB   ILE  45           HB       ILE  45   3.413   0.933  -0.967
  354   HG12  ILE  45          2HG1      ILE  45   2.741   1.819  -3.811
  355   HG13  ILE  45          3HG1      ILE  45   3.068   0.162  -3.322
  356   HG21  ILE  45          1HG2      ILE  45   3.604   3.327  -0.439
  357   HG22  ILE  45          2HG2      ILE  45   1.981   2.946  -1.013
  358   HG23  ILE  45          3HG2      ILE  45   3.132   3.743  -2.088
  359   HD11  ILE  45          3HD1      ILE  45   0.733   1.857  -2.442
  360   HD12  ILE  45          1HD1      ILE  45   1.078   0.218  -1.877
  361   HD13  ILE  45          2HD1      ILE  45   0.713   0.506  -3.576
  362    H    ARG  46           H        ARG  46   6.004   3.926  -1.537
  363    HA   ARG  46           HA       ARG  46   7.084   3.096   1.091
  364    HB2  ARG  46           2HB      ARG  46   8.265   5.131  -0.860
  365    HB3  ARG  46           3HB      ARG  46   8.843   4.850   0.781
  366    HG2  ARG  46           2HG      ARG  46   9.318   2.444   0.063
  367    HG3  ARG  46           3HG      ARG  46   9.022   2.971  -1.600
  368    HD2  ARG  46           2HD      ARG  46  11.443   2.985  -1.019
  369    HD3  ARG  46           3HD      ARG  46  10.851   4.598  -1.429
  370    HE   ARG  46           HE       ARG  46  10.598   4.415   1.306
  371   HH11  ARG  46          1HH1      ARG  46  13.332   4.172  -0.897
  372   HH12  ARG  46          2HH1      ARG  46  14.463   4.768   0.271
  373   HH21  ARG  46          1HH2      ARG  46  12.075   5.209   2.789
  374   HH22  ARG  46          2HH2      ARG  46  13.749   5.357   2.357
  375    H    ILE  47           H        ILE  47   5.956   4.076   2.662
  376    HA   ILE  47           HA       ILE  47   4.779   6.761   2.179
  377    HB   ILE  47           HB       ILE  47   3.762   4.639   4.129
  378   HG12  ILE  47          2HG1      ILE  47   2.685   5.553   1.414
  379   HG13  ILE  47          3HG1      ILE  47   3.362   3.973   1.782
  380   HG21  ILE  47          1HG2      ILE  47   2.582   7.346   3.369
  381   HG22  ILE  47          2HG2      ILE  47   3.328   6.946   4.918
  382   HG23  ILE  47          3HG2      ILE  47   1.822   6.160   4.439
  383   HD11  ILE  47          3HD1      ILE  47   0.976   3.839   1.611
  384   HD12  ILE  47          1HD1      ILE  47   0.766   5.097   2.829
  385   HD13  ILE  47          2HD1      ILE  47   1.456   3.536   3.278
  386    H    THR  48           H        THR  48   5.472   8.360   3.374
  387    HA   THR  48           HA       THR  48   7.317   7.919   5.656
  388    HB   THR  48           HB       THR  48   7.542   9.997   3.416
  389    HG1  THR  48           HG1      THR  48   8.787   7.469   3.789
  390   HG21  THR  48          3HG2      THR  48   9.548   9.271   5.587
  391   HG22  THR  48          1HG2      THR  48   8.599  10.761   5.525
  392   HG23  THR  48          2HG2      THR  48   9.807  10.432   4.282
  393    H    GLY  49           H        GLY  49   7.370   9.697   7.222
  394    HA2  GLY  49           2HA      GLY  49   6.800  11.731   8.171
  395    HA3  GLY  49           3HA      GLY  49   5.640  12.019   6.889
  396    H    VAL  50           H        VAL  50   4.392   9.329   7.438
  397    HA   VAL  50           HA       VAL  50   2.483  10.129   9.408
  398    HB   VAL  50           HB       VAL  50   1.445   7.875   9.012
  399   HG11  VAL  50          1HG1      VAL  50   0.819   8.244   6.644
  400   HG12  VAL  50          2HG1      VAL  50   2.166   9.372   6.459
  401   HG13  VAL  50          3HG1      VAL  50   0.833   9.758   7.551
  402   HG21  VAL  50          3HG2      VAL  50   2.359   6.355   7.284
  403   HG22  VAL  50          1HG2      VAL  50   3.498   6.546   8.620
  404   HG23  VAL  50          2HG2      VAL  50   3.774   7.399   7.100
  405    HA   PRO  51           HA       PRO  51   4.608   8.475  13.069
  406    HB2  PRO  51           2HB      PRO  51   1.936   8.304  14.385
  407    HB3  PRO  51           3HB      PRO  51   3.329   9.317  14.808
  408    HG2  PRO  51           2HG      PRO  51   1.081  10.350  13.735
  409    HG3  PRO  51           3HG      PRO  51   2.691  11.032  13.433
  410    HD2  PRO  51           2HD      PRO  51   1.018   9.301  11.626
  411    HD3  PRO  51           3HD      PRO  51   2.046  10.695  11.226
  412    H    GLU  52           H        GLU  52   4.419   6.623  14.611
  413    HA   GLU  52           HA       GLU  52   4.343   4.140  13.371
  414    HB2  GLU  52           2HB      GLU  52   5.470   4.581  15.545
  415    HB3  GLU  52           3HB      GLU  52   3.900   4.728  16.328
  416    HG2  GLU  52           2HG      GLU  52   3.487   2.292  15.513
  417    HG3  GLU  52           3HG      GLU  52   5.221   2.241  15.216
  418    H    GLN  53           H        GLN  53   1.826   5.647  15.414
  419    HA   GLN  53           HA       GLN  53  -0.020   3.540  15.478
  420    HB2  GLN  53           2HB      GLN  53  -1.694   5.253  16.129
  421    HB3  GLN  53           3HB      GLN  53  -0.188   5.423  17.022
  422    HG2  GLN  53           2HG      GLN  53   0.441   7.379  15.821
  423    HG3  GLN  53           3HG      GLN  53  -0.761   7.109  14.565
  424   HE21  GLN  53          1HE2      GLN  53  -2.950   7.570  15.016
  425   HE22  GLN  53          2HE2      GLN  53  -3.397   8.630  16.306
  426    H    VAL  54           H        VAL  54   0.417   6.131  13.105
  427    HA   VAL  54           HA       VAL  54  -1.947   5.477  11.587
  428    HB   VAL  54           HB       VAL  54   0.390   7.329  10.939
  429   HG11  VAL  54          1HG1      VAL  54  -1.096   8.322   9.216
  430   HG12  VAL  54          2HG1      VAL  54  -2.297   7.070   9.543
  431   HG13  VAL  54          3HG1      VAL  54  -0.726   6.633   8.867
  432   HG21  VAL  54          3HG2      VAL  54  -1.171   9.161  11.562
  433   HG22  VAL  54          1HG2      VAL  54  -0.891   8.066  12.922
  434   HG23  VAL  54          2HG2      VAL  54  -2.396   7.967  12.002
  435    H    ARG  55           H        ARG  55   1.518   4.693  11.427
  436    HA   ARG  55           HA       ARG  55   1.586   3.426   8.901
  437    HB2  ARG  55           2HB      ARG  55   3.235   2.829  11.396
  438    HB3  ARG  55           3HB      ARG  55   3.570   2.153   9.801
  439    HG2  ARG  55           2HG      ARG  55   3.896   4.481   8.941
  440    HG3  ARG  55           3HG      ARG  55   3.700   5.080  10.590
  441    HD2  ARG  55           2HD      ARG  55   5.668   3.684  11.276
  442    HD3  ARG  55           3HD      ARG  55   5.885   3.211   9.589
  443    HE   ARG  55           HE       ARG  55   6.744   5.613  10.827
  444   HH11  ARG  55          1HH1      ARG  55   5.517   4.487   7.715
  445   HH12  ARG  55          2HH1      ARG  55   6.288   5.758   6.828
  446   HH21  ARG  55          1HH2      ARG  55   7.755   7.222   9.655
  447   HH22  ARG  55          2HH2      ARG  55   7.561   7.309   7.938
  448    H    LYS  56           H        LYS  56   0.686   2.242  12.135
  449    HA   LYS  56           HA       LYS  56   0.190  -0.453  11.552
  450    HB2  LYS  56           2HB      LYS  56  -1.354   1.329  13.480
  451    HB3  LYS  56           3HB      LYS  56  -1.349  -0.433  13.491
  452    HG2  LYS  56           2HG      LYS  56   1.015   1.378  14.077
  453    HG3  LYS  56           3HG      LYS  56   0.069   0.473  15.262
  454    HD2  LYS  56           2HD      LYS  56   0.827  -1.658  14.205
  455    HD3  LYS  56           3HD      LYS  56   1.812  -0.729  13.066
  456    HE2  LYS  56           2HE      LYS  56   3.166  -1.608  14.944
  457    HE3  LYS  56           3HE      LYS  56   3.157   0.156  14.931
  458    HZ1  LYS  56           3HZ      LYS  56   2.855  -0.807  17.156
  459    HZ2  LYS  56           1HZ      LYS  56   1.412  -1.527  16.652
  460    HZ3  LYS  56           2HZ      LYS  56   1.547   0.155  16.698
  461    H    GLU  57           H        GLU  57  -1.908   2.414  11.247
  462    HA   GLU  57           HA       GLU  57  -4.268   1.138  10.366
  463    HB2  GLU  57           2HB      GLU  57  -3.276   3.973   9.835
  464    HB3  GLU  57           3HB      GLU  57  -4.926   3.421   9.538
  465    HG2  GLU  57           2HG      GLU  57  -5.301   3.051  11.900
  466    HG3  GLU  57           3HG      GLU  57  -3.601   3.352  12.272
  467    H    LEU  58           H        LEU  58  -1.466   2.419   8.558
  468    HA   LEU  58           HA       LEU  58  -2.460   1.854   5.953
  469    HB2  LEU  58           2HB      LEU  58   0.285   2.473   7.041
  470    HB3  LEU  58           3HB      LEU  58   0.154   1.851   5.413
  471    HG   LEU  58           HG       LEU  58   0.312   4.196   5.175
  472   HD11  LEU  58          1HD1      LEU  58  -2.627   3.527   4.891
  473   HD12  LEU  58          2HD1      LEU  58  -1.352   3.231   3.705
  474   HD13  LEU  58          3HD1      LEU  58  -1.781   4.882   4.133
  475   HD21  LEU  58          3HD2      LEU  58  -1.079   5.851   6.311
  476   HD22  LEU  58          1HD2      LEU  58  -0.142   4.890   7.456
  477   HD23  LEU  58          2HD2      LEU  58  -1.864   4.569   7.241
  478    H    ALA  59           H        ALA  59  -0.804  -0.158   8.356
  479    HA   ALA  59           HA       ALA  59  -0.248  -2.374   6.664
  480    HB1  ALA  59           3HB      ALA  59  -0.002  -3.660   8.745
  481    HB2  ALA  59           1HB      ALA  59  -0.757  -2.352   9.659
  482    HB3  ALA  59           2HB      ALA  59   0.805  -2.095   8.878
  483    H    LYS  60           H        LYS  60  -3.067  -1.513   8.688
  484    HA   LYS  60           HA       LYS  60  -4.613  -3.829   8.120
  485    HB2  LYS  60           2HB      LYS  60  -5.322  -1.081   9.191
  486    HB3  LYS  60           3HB      LYS  60  -6.600  -2.207   8.772
  487    HG2  LYS  60           2HG      LYS  60  -6.201  -2.303  11.152
  488    HG3  LYS  60           3HG      LYS  60  -5.715  -3.834  10.425
  489    HD2  LYS  60           2HD      LYS  60  -3.374  -3.264  10.624
  490    HD3  LYS  60           3HD      LYS  60  -3.761  -1.608  11.085
  491    HE2  LYS  60           2HE      LYS  60  -3.041  -2.907  13.030
  492    HE3  LYS  60           3HE      LYS  60  -4.725  -2.412  13.204
  493    HZ1  LYS  60           3HZ      LYS  60  -3.896  -5.085  12.223
  494    HZ2  LYS  60           1HZ      LYS  60  -5.450  -4.591  12.658
  495    HZ3  LYS  60           2HZ      LYS  60  -4.253  -4.750  13.838
  496    H    GLU  61           H        GLU  61  -4.209  -0.722   6.442
  497    HA   GLU  61           HA       GLU  61  -6.249  -1.115   4.493
  498    HB2  GLU  61           2HB      GLU  61  -3.745   0.618   4.376
  499    HB3  GLU  61           3HB      GLU  61  -5.029   0.649   3.167
  500    HG2  GLU  61           2HG      GLU  61  -5.232   1.470   6.079
  501    HG3  GLU  61           3HG      GLU  61  -5.321   2.520   4.668
  502    H    ALA  62           H        ALA  62  -2.774  -1.830   4.574
  503    HA   ALA  62           HA       ALA  62  -2.360  -2.826   2.015
  504    HB1  ALA  62           3HB      ALA  62  -0.559  -2.359   3.625
  505    HB2  ALA  62           1HB      ALA  62  -0.429  -4.008   3.009
  506    HB3  ALA  62           2HB      ALA  62  -1.078  -3.720   4.621
  507    H    GLU  63           H        GLU  63  -3.359  -4.577   4.951
  508    HA   GLU  63           HA       GLU  63  -3.577  -7.162   3.862
  509    HB2  GLU  63           2HB      GLU  63  -4.916  -5.927   6.300
  510    HB3  GLU  63           3HB      GLU  63  -4.894  -7.657   5.945
  511    HG2  GLU  63           2HG      GLU  63  -2.478  -7.735   6.186
  512    HG3  GLU  63           3HG      GLU  63  -2.395  -5.983   6.368
  513    H    ARG  64           H        ARG  64  -6.105  -4.635   4.362
  514    HA   ARG  64           HA       ARG  64  -8.290  -6.324   3.641
  515    HB2  ARG  64           2HB      ARG  64  -9.699  -4.339   3.683
  516    HB3  ARG  64           3HB      ARG  64  -8.586  -4.284   5.046
  517    HG2  ARG  64           2HG      ARG  64  -7.176  -2.667   3.846
  518    HG3  ARG  64           3HG      ARG  64  -8.264  -2.723   2.460
  519    HD2  ARG  64           2HD      ARG  64  -9.086  -1.815   5.237
  520    HD3  ARG  64           3HD      ARG  64  -8.547  -0.727   3.958
  521    HE   ARG  64           HE       ARG  64 -10.853  -2.479   3.442
  522   HH11  ARG  64          1HH1      ARG  64  -9.649   0.795   4.022
  523   HH12  ARG  64          2HH1      ARG  64 -11.121   1.551   3.492
  524   HH21  ARG  64          1HH2      ARG  64 -12.766  -1.463   2.757
  525   HH22  ARG  64          2HH2      ARG  64 -12.888   0.266   2.775
  526    H    LEU  65           H        LEU  65  -6.156  -4.215   1.799
  527    HA   LEU  65           HA       LEU  65  -7.666  -4.382  -0.665
  528    HB2  LEU  65           2HB      LEU  65  -4.841  -3.391  -0.140
  529    HB3  LEU  65           3HB      LEU  65  -5.715  -3.196  -1.654
  530    HG   LEU  65           HG       LEU  65  -6.501  -1.950   1.013
  531   HD11  LEU  65          1HD1      LEU  65  -5.839   0.173   0.032
  532   HD12  LEU  65          2HD1      LEU  65  -5.299  -0.652  -1.435
  533   HD13  LEU  65          3HD1      LEU  65  -4.484  -0.954   0.105
  534   HD21  LEU  65          3HD2      LEU  65  -8.491  -2.400  -0.340
  535   HD22  LEU  65          1HD2      LEU  65  -7.772  -1.560  -1.717
  536   HD23  LEU  65          2HD2      LEU  65  -8.177  -0.670  -0.246
  537    H    ALA  66           H        ALA  66  -4.981  -6.095   0.842
  538    HA   ALA  66           HA       ALA  66  -3.984  -7.521  -1.364
  539    HB1  ALA  66           3HB      ALA  66  -3.052  -9.096   0.280
  540    HB2  ALA  66           1HB      ALA  66  -4.104  -8.430   1.535
  541    HB3  ALA  66           2HB      ALA  66  -2.839  -7.429   0.820
  542    H    LYS  67           H        LYS  67  -6.490  -8.429   1.008
  543    HA   LYS  67           HA       LYS  67  -7.134 -10.916  -0.256
  544    HB2  LYS  67           2HB      LYS  67  -8.965 -11.048   1.375
  545    HB3  LYS  67           3HB      LYS  67  -7.453 -10.592   2.152
  546    HG2  LYS  67           2HG      LYS  67  -8.203  -8.229   2.224
  547    HG3  LYS  67           3HG      LYS  67  -9.725  -8.690   1.456
  548    HD2  LYS  67           2HD      LYS  67  -8.735  -9.611   4.189
  549    HD3  LYS  67           3HD      LYS  67 -10.003  -8.421   3.888
  550    HE2  LYS  67           2HE      LYS  67 -11.400 -10.176   2.834
  551    HE3  LYS  67           3HE      LYS  67 -10.128 -11.367   3.125
  552    HZ1  LYS  67           3HZ      LYS  67 -10.370 -10.884   5.525
  553    HZ2  LYS  67           1HZ      LYS  67 -11.756 -11.559   4.831
  554    HZ3  LYS  67           2HZ      LYS  67 -11.704  -9.906   5.175
  555    H    GLU  68           H        GLU  68  -8.355  -7.616  -0.520
  556    HA   GLU  68           HA       GLU  68 -10.866  -8.178  -1.743
  557    HB2  GLU  68           2HB      GLU  68 -10.386  -6.062  -0.559
  558    HB3  GLU  68           3HB      GLU  68  -9.174  -5.639  -1.761
  559    HG2  GLU  68           2HG      GLU  68 -11.229  -4.374  -2.138
  560    HG3  GLU  68           3HG      GLU  68 -10.922  -5.468  -3.489
  561    H    PHE  69           H        PHE  69  -7.725  -7.141  -3.069
  562    HA   PHE  69           HA       PHE  69  -8.635  -7.433  -5.834
  563    HB2  PHE  69           2HB      PHE  69  -6.003  -6.448  -4.662
  564    HB3  PHE  69           3HB      PHE  69  -6.386  -6.461  -6.375
  565    HD1  PHE  69           HD1      PHE  69  -8.529  -5.135  -7.116
  566    HD2  PHE  69           HD2      PHE  69  -6.525  -4.499  -3.395
  567    HE1  PHE  69           HE1      PHE  69  -9.559  -2.913  -6.915
  568    HE2  PHE  69           HE2      PHE  69  -7.562  -2.290  -3.212
  569    HZ   PHE  69           HZ       PHE  69  -9.081  -1.489  -4.968
  570    H    ASN  70           H        ASN  70  -7.589  -9.575  -3.607
  571    HA   ASN  70           HA       ASN  70  -6.740 -11.653  -3.555
  572    HB2  ASN  70           2HB      ASN  70  -8.530 -11.954  -5.327
  573    HB3  ASN  70           3HB      ASN  70  -7.279 -11.754  -6.549
  574   HD21  ASN  70          1HD2      ASN  70  -7.657 -13.854  -7.377
  575   HD22  ASN  70          2HD2      ASN  70  -7.166 -15.281  -6.535
  576    H    ILE  71           H        ILE  71  -4.902  -9.624  -3.710
  577    HA   ILE  71           HA       ILE  71  -2.562 -10.781  -5.119
  578    HB   ILE  71           HB       ILE  71  -1.563  -8.474  -4.974
  579   HG12  ILE  71          2HG1      ILE  71  -4.319  -7.691  -3.897
  580   HG13  ILE  71          3HG1      ILE  71  -2.775  -7.533  -3.069
  581   HG21  ILE  71          1HG2      ILE  71  -2.865  -7.463  -6.796
  582   HG22  ILE  71          2HG2      ILE  71  -4.216  -8.546  -6.455
  583   HG23  ILE  71          3HG2      ILE  71  -2.686  -9.200  -7.042
  584   HD11  ILE  71          3HD1      ILE  71  -2.091  -5.837  -4.715
  585   HD12  ILE  71          1HD1      ILE  71  -3.546  -5.389  -3.827
  586   HD13  ILE  71          2HD1      ILE  71  -3.674  -5.968  -5.488
  587    H    THR  72           H        THR  72  -0.507 -10.431  -3.908
  588    HA   THR  72           HA       THR  72  -0.809 -10.932  -1.017
  589    HB   THR  72           HB       THR  72   1.753 -11.450  -1.222
  590    HG1  THR  72           HG1      THR  72   1.032 -11.499  -3.980
  591   HG21  THR  72          3HG2      THR  72   1.343 -13.747  -2.048
  592   HG22  THR  72          1HG2      THR  72  -0.236 -13.248  -2.654
  593   HG23  THR  72          2HG2      THR  72   0.087 -13.235  -0.918
  594    H    VAL  73           H        VAL  73   0.555  -9.793   0.499
  595    HA   VAL  73           HA       VAL  73   1.849  -7.323  -0.407
  596    HB   VAL  73           HB       VAL  73  -0.581  -6.797   0.223
  597   HG11  VAL  73          1HG1      VAL  73  -1.194  -6.630   2.613
  598   HG12  VAL  73          2HG1      VAL  73   0.343  -7.370   3.068
  599   HG13  VAL  73          3HG1      VAL  73  -0.848  -8.302   2.157
  600   HG21  VAL  73          3HG2      VAL  73   1.172  -5.059   0.139
  601   HG22  VAL  73          1HG2      VAL  73   1.556  -5.357   1.838
  602   HG23  VAL  73          2HG2      VAL  73  -0.025  -4.710   1.385
  603    H    THR  74           H        THR  74   3.328  -6.489   1.033
  604    HA   THR  74           HA       THR  74   3.786  -7.729   3.635
  605    HB   THR  74           HB       THR  74   5.415  -8.906   2.258
  606    HG1  THR  74           HG1      THR  74   6.940  -6.871   3.505
  607   HG21  THR  74          3HG2      THR  74   6.418  -6.193   1.315
  608   HG22  THR  74          1HG2      THR  74   5.551  -7.374   0.329
  609   HG23  THR  74          2HG2      THR  74   7.159  -7.753   0.949
  610    H    TYR  75           H        TYR  75   4.605  -6.242   5.120
  611    HA   TYR  75           HA       TYR  75   5.069  -3.468   4.295
  612    HB2  TYR  75           2HB      TYR  75   3.469  -2.764   6.241
  613    HB3  TYR  75           3HB      TYR  75   2.758  -3.241   4.708
  614    HD1  TYR  75           HD1      TYR  75   3.369  -4.391   8.224
  615    HD2  TYR  75           HD2      TYR  75   1.293  -5.162   4.556
  616    HE1  TYR  75           HE1      TYR  75   1.988  -6.086   9.354
  617    HE2  TYR  75           HE2      TYR  75  -0.083  -6.846   5.690
  618    HH   TYR  75           HH       TYR  75  -0.231  -7.173   9.052
  619    H    THR  76           H        THR  76   6.471  -2.406   5.585
  620    HA   THR  76           HA       THR  76   7.849  -3.972   7.701
  621    HB   THR  76           HB       THR  76   8.846  -1.765   5.830
  622    HG1  THR  76           HG1      THR  76  10.273  -3.727   5.286
  623   HG21  THR  76          3HG2      THR  76  10.056  -1.580   7.966
  624   HG22  THR  76          1HG2      THR  76  11.121  -2.222   6.712
  625   HG23  THR  76          2HG2      THR  76  10.428  -3.304   7.922
  626    H    ILE  77           H        ILE  77   7.413  -3.219   9.757
  627    HA   ILE  77           HA       ILE  77   7.309  -0.330  10.309
  628    HB   ILE  77           HB       ILE  77   5.199  -0.719  11.793
  629   HG12  ILE  77          2HG1      ILE  77   4.878  -3.123   9.931
  630   HG13  ILE  77          3HG1      ILE  77   5.093  -3.176  11.676
  631   HG21  ILE  77          1HG2      ILE  77   3.635  -0.168  10.001
  632   HG22  ILE  77          2HG2      ILE  77   4.806  -0.692   8.792
  633   HG23  ILE  77          3HG2      ILE  77   5.154   0.710   9.806
  634   HD11  ILE  77          3HD1      ILE  77   2.792  -3.592  11.069
  635   HD12  ILE  77          1HD1      ILE  77   2.693  -2.046  10.223
  636   HD13  ILE  77          2HD1      ILE  77   2.917  -2.087  11.976
  637    H    ARG  78           H        ARG  78   7.860   0.204  12.368
  638    HA   ARG  78           HA       ARG  78   8.665  -1.932  14.240
  639    HB2  ARG  78           2HB      ARG  78   9.304   1.052  14.207
  640    HB3  ARG  78           3HB      ARG  78   9.858  -0.071  15.446
  641    HG2  ARG  78           2HG      ARG  78  10.600  -0.213  12.495
  642    HG3  ARG  78           3HG      ARG  78  11.603   0.487  13.765
  643    HD2  ARG  78           2HD      ARG  78  12.471  -1.697  13.335
  644    HD3  ARG  78           3HD      ARG  78  11.615  -1.804  14.875
  645    HE   ARG  78           HE       ARG  78  10.012  -2.548  12.590
  646   HH11  ARG  78          1HH1      ARG  78  12.327  -3.833  14.916
  647   HH12  ARG  78          2HH1      ARG  78  11.788  -5.470  14.711
  648   HH21  ARG  78          1HH2      ARG  78   9.319  -4.674  12.362
  649   HH22  ARG  78          2HH2      ARG  78  10.085  -5.947  13.265
  650    H    GLY  79           H        GLY  79   7.946  -1.851  16.422
  651    HA2  GLY  79           2HA      GLY  79   5.705  -0.113  17.149
  652    HA3  GLY  79           3HA      GLY  79   5.351  -1.833  16.994
  653    H    SER  80           H        SER  80   7.839  -2.812  18.015
  654    HA   SER  80           HA       SER  80   7.272  -2.847  20.802
  655    HB2  SER  80           2HB      SER  80   8.310  -4.773  19.571
  656    HB3  SER  80           3HB      SER  80   9.788  -3.837  19.373
  657    HG   SER  80           HG       SER  80   9.311  -3.744  21.924
  658    H    LEU  81           H        LEU  81  10.227  -1.711  19.103
  659    HA   LEU  81           HA       LEU  81  11.754  -0.122  19.470
  660    HB2  LEU  81           2HB      LEU  81   9.163   1.340  19.982
  661    HB3  LEU  81           3HB      LEU  81  10.695   2.198  19.943
  662    HG   LEU  81           HG       LEU  81   9.638   0.555  17.595
  663   HD11  LEU  81          1HD1      LEU  81   9.462   3.551  18.002
  664   HD12  LEU  81          2HD1      LEU  81   8.110   2.421  18.060
  665   HD13  LEU  81          3HD1      LEU  81   8.987   2.664  16.550
  666   HD21  LEU  81          3HD2      LEU  81  11.316   1.788  16.288
  667   HD22  LEU  81          1HD2      LEU  81  12.076   0.866  17.583
  668   HD23  LEU  81          2HD2      LEU  81  11.869   2.612  17.750
  669    H    GLU  82           H        GLU  82   9.621   0.976  22.091
  670    HA   GLU  82           HA       GLU  82  12.029   1.372  23.767
  671    HB2  GLU  82           2HB      GLU  82   9.312   2.758  23.944
  672    HB3  GLU  82           3HB      GLU  82  10.770   3.186  24.838
  673    HG2  GLU  82           2HG      GLU  82  10.322   3.444  21.845
  674    HG3  GLU  82           3HG      GLU  82  10.422   4.760  23.012
  675    H    HIS  83           H        HIS  83   9.178  -0.514  23.604
  676    HA   HIS  83           HA       HIS  83   9.551  -1.353  26.433
  677    HB2  HIS  83           2HB      HIS  83   7.218  -2.123  26.453
  678    HB3  HIS  83           3HB      HIS  83   7.302  -0.412  26.090
  679    HD1  HIS  83           HD1      HIS  83   6.802   0.236  23.518
  680    HD2  HIS  83           HD2      HIS  83   5.802  -3.630  24.645
  681    HE1  HIS  83           HE1      HIS  83   5.217  -0.594  21.766
  682    HE2  HIS  83           HE2      HIS  83   4.768  -2.992  22.385
  683    H    HIS  84           H        HIS  84  11.309  -2.628  25.802
  684    HA   HIS  84           HA       HIS  84  10.506  -5.364  25.493
  685    HB2  HIS  84           2HB      HIS  84  10.833  -4.660  23.062
  686    HB3  HIS  84           3HB      HIS  84  12.522  -4.316  23.432
  687    HD1  HIS  84           HD1      HIS  84  10.066  -7.162  23.160
  688    HD2  HIS  84           HD2      HIS  84  14.177  -6.594  23.427
  689    HE1  HIS  84           HE1      HIS  84  11.089  -9.407  22.731
  690    HE2  HIS  84           HE2      HIS  84  13.567  -9.029  22.835
  691    H    HIS  85           H        HIS  85  11.193  -4.828  27.672
  692    HA   HIS  85           HA       HIS  85  13.886  -5.765  28.151
  693    HB2  HIS  85           2HB      HIS  85  14.550  -3.936  29.668
  694    HB3  HIS  85           3HB      HIS  85  14.262  -3.309  28.060
  695    HD1  HIS  85           HD1      HIS  85  13.645  -2.489  31.453
  696    HD2  HIS  85           HD2      HIS  85  11.427  -2.116  27.964
  697    HE1  HIS  85           HE1      HIS  85  11.880  -0.790  31.961
  698    HE2  HIS  85           HE2      HIS  85  10.727  -0.409  29.762
  699    H    HIS  86           H        HIS  86  12.444  -7.535  28.679
  700    HA   HIS  86           HA       HIS  86  10.454  -7.374  30.701
  701    HB2  HIS  86           2HB      HIS  86  10.643  -9.151  28.851
  702    HB3  HIS  86           3HB      HIS  86  11.873  -9.929  29.838
  703    HD1  HIS  86           HD1      HIS  86   8.230  -9.586  29.423
  704    HD2  HIS  86           HD2      HIS  86  10.815 -11.021  32.334
  705    HE1  HIS  86           HE1      HIS  86   6.803 -10.913  30.998
  706    HE2  HIS  86           HE2      HIS  86   8.414 -11.875  32.673
  707    H    HIS  87           H        HIS  87  13.888  -7.981  30.777
  708    HA   HIS  87           HA       HIS  87  14.297  -8.976  33.361
  709    HB2  HIS  87           2HB      HIS  87  16.121  -8.869  31.741
  710    HB3  HIS  87           3HB      HIS  87  16.004  -7.117  31.644
  711    HD1  HIS  87           HD1      HIS  87  16.828  -9.756  34.283
  712    HD2  HIS  87           HD2      HIS  87  17.826  -5.854  33.240
  713    HE1  HIS  87           HE1      HIS  87  18.613  -9.048  35.903
  714    HE2  HIS  87           HE2      HIS  87  19.218  -6.702  35.236
  715    H    HIS  88           H        HIS  88  14.440  -8.048  35.392
  716    HA   HIS  88           HA       HIS  88  13.538  -5.270  35.764
  717    HB2  HIS  88           2HB      HIS  88  14.090  -7.487  37.796
  718    HB3  HIS  88           3HB      HIS  88  13.491  -5.881  38.205
  719    HD1  HIS  88           HD1      HIS  88  12.092  -8.882  38.407
  720    HD2  HIS  88           HD2      HIS  88  11.080  -5.683  35.963
  721    HE1  HIS  88           HE1      HIS  88   9.690  -9.235  37.795
  722    HE2  HIS  88           HE2      HIS  88   9.051  -7.160  36.529
  Start of MODEL   18
    1    H1   MET   1           1H       MET   1  15.008   8.675  11.023
    2    H2   MET   1           2H       MET   1  14.617   9.359   9.532
    3    H3   MET   1           3H       MET   1  16.003   8.407   9.682
    4    HA   MET   1           HA       MET   1  14.262   7.233   8.558
    5    HB2  MET   1           2HB      MET   1  14.230   5.184   9.999
    6    HB3  MET   1           3HB      MET   1  15.831   5.876   9.813
    7    HG2  MET   1           2HG      MET   1  14.064   6.102  12.259
    8    HG3  MET   1           3HG      MET   1  15.485   5.075  12.087
    9    HE1  MET   1           3HE      MET   1  18.370   7.784  11.957
   10    HE2  MET   1           1HE      MET   1  17.544   7.067  10.577
   11    HE3  MET   1           2HE      MET   1  18.010   6.056  11.946
   12    H    GLY   2           H        GLY   2  12.188   7.551   8.146
   13    HA2  GLY   2           2HA      GLY   2  10.104   7.305  10.148
   14    HA3  GLY   2           3HA      GLY   2  10.299   8.933   9.497
   15    H    GLU   3           H        GLU   3  10.290   5.607   8.230
   16    HA   GLU   3           HA       GLU   3   8.245   6.261   6.228
   17    HB2  GLU   3           2HB      GLU   3  10.436   6.845   5.197
   18    HB3  GLU   3           3HB      GLU   3  11.041   5.226   5.527
   19    HG2  GLU   3           2HG      GLU   3   9.338   4.296   3.973
   20    HG3  GLU   3           3HG      GLU   3   8.775   5.931   3.622
   21    H    MET   4           H        MET   4   7.116   4.501   5.541
   22    HA   MET   4           HA       MET   4   7.658   1.804   6.667
   23    HB2  MET   4           2HB      MET   4   5.574   2.755   7.593
   24    HB3  MET   4           3HB      MET   4   5.009   3.186   5.983
   25    HG2  MET   4           2HG      MET   4   4.823   0.797   5.408
   26    HG3  MET   4           3HG      MET   4   5.400   0.363   7.019
   27    HE1  MET   4           3HE      MET   4   1.683  -0.696   7.313
   28    HE2  MET   4           1HE      MET   4   3.360  -1.158   7.595
   29    HE3  MET   4           2HE      MET   4   2.774  -0.922   5.945
   30    H    ASP   5           H        ASP   5   7.513   0.014   5.129
   31    HA   ASP   5           HA       ASP   5   7.235   0.758   2.291
   32    HB2  ASP   5           2HB      ASP   5   8.583  -1.682   3.562
   33    HB3  ASP   5           3HB      ASP   5   8.488  -1.351   1.837
   34    H    ILE   6           H        ILE   6   5.463  -0.056   1.314
   35    HA   ILE   6           HA       ILE   6   4.173  -2.540   2.267
   36    HB   ILE   6           HB       ILE   6   2.701  -0.142   1.032
   37   HG12  ILE   6          2HG1      ILE   6   2.591  -1.045   3.945
   38   HG13  ILE   6          3HG1      ILE   6   3.477   0.361   3.370
   39   HG21  ILE   6          1HG2      ILE   6   1.666  -2.314   0.508
   40   HG22  ILE   6          2HG2      ILE   6   0.639  -1.387   1.601
   41   HG23  ILE   6          3HG2      ILE   6   1.610  -2.722   2.225
   42   HD11  ILE   6          3HD1      ILE   6   1.421   1.061   4.331
   43   HD12  ILE   6          1HD1      ILE   6   0.490  -0.032   3.309
   44   HD13  ILE   6          2HD1      ILE   6   1.344   1.340   2.595
   45    H    ARG   7           H        ARG   7   4.819  -3.935   0.677
   46    HA   ARG   7           HA       ARG   7   4.704  -3.065  -2.149
   47    HB2  ARG   7           2HB      ARG   7   6.932  -3.921  -1.334
   48    HB3  ARG   7           3HB      ARG   7   6.189  -5.493  -1.036
   49    HG2  ARG   7           2HG      ARG   7   5.586  -5.607  -3.484
   50    HG3  ARG   7           3HG      ARG   7   6.459  -4.093  -3.728
   51    HD2  ARG   7           2HD      ARG   7   7.659  -6.689  -2.730
   52    HD3  ARG   7           3HD      ARG   7   7.802  -6.060  -4.369
   53    HE   ARG   7           HE       ARG   7   8.961  -4.075  -3.222
   54   HH11  ARG   7          1HH1      ARG   7   9.194  -7.391  -2.034
   55   HH12  ARG   7          2HH1      ARG   7  10.759  -7.144  -1.321
   56   HH21  ARG   7          1HH2      ARG   7  11.025  -3.787  -2.286
   57   HH22  ARG   7          2HH2      ARG   7  11.791  -5.112  -1.466
   58    H    PHE   8           H        PHE   8   3.311  -4.020  -3.484
   59    HA   PHE   8           HA       PHE   8   1.670  -6.329  -2.604
   60    HB2  PHE   8           2HB      PHE   8   1.059  -4.062  -4.564
   61    HB3  PHE   8           3HB      PHE   8   0.079  -5.517  -4.449
   62    HD1  PHE   8           HD1      PHE   8   0.974  -2.347  -2.784
   63    HD2  PHE   8           HD2      PHE   8  -1.399  -5.904  -2.534
   64    HE1  PHE   8           HE1      PHE   8  -0.398  -1.325  -1.023
   65    HE2  PHE   8           HE2      PHE   8  -2.767  -4.865  -0.774
   66    HZ   PHE   8           HZ       PHE   8  -2.268  -2.572  -0.018
   67    H    ARG   9           H        ARG   9   1.508  -8.035  -4.069
   68    HA   ARG   9           HA       ARG   9   3.048  -7.983  -6.574
   69    HB2  ARG   9           2HB      ARG   9   4.293  -9.108  -4.492
   70    HB3  ARG   9           3HB      ARG   9   3.173 -10.429  -4.739
   71    HG2  ARG   9           2HG      ARG   9   5.273  -9.429  -6.701
   72    HG3  ARG   9           3HG      ARG   9   5.308 -10.938  -5.798
   73    HD2  ARG   9           2HD      ARG   9   3.307 -11.710  -7.079
   74    HD3  ARG   9           3HD      ARG   9   3.353 -10.218  -8.014
   75    HE   ARG   9           HE       ARG   9   4.779 -12.563  -8.539
   76   HH11  ARG   9          1HH1      ARG   9   5.473  -9.091  -8.518
   77   HH12  ARG   9          2HH1      ARG   9   6.718  -9.242  -9.710
   78   HH21  ARG   9          1HH2      ARG   9   6.326 -12.678 -10.123
   79   HH22  ARG   9          2HH2      ARG   9   7.197 -11.264 -10.617
   80    H    GLY  10           H        GLY  10   1.728  -8.681  -8.145
   81    HA2  GLY  10           2HA      GLY  10  -0.128 -10.869  -7.814
   82    HA3  GLY  10           3HA      GLY  10  -0.920  -9.307  -8.038
   83    H    ASP  11           H        ASP  11  -0.400 -11.879  -9.697
   84    HA   ASP  11           HA       ASP  11   1.129 -11.194 -11.979
   85    HB2  ASP  11           2HB      ASP  11   0.451 -13.534 -11.293
   86    HB3  ASP  11           3HB      ASP  11  -1.175 -13.190 -11.873
   87    H    ASP  12           H        ASP  12  -2.007 -10.261 -10.983
   88    HA   ASP  12           HA       ASP  12  -2.692  -9.083 -13.596
   89    HB2  ASP  12           2HB      ASP  12  -4.477 -10.395 -12.353
   90    HB3  ASP  12           3HB      ASP  12  -4.376  -9.229 -11.040
   91    H    LEU  13           H        LEU  13  -1.399  -7.307 -13.757
   92    HA   LEU  13           HA       LEU  13  -0.393  -5.720 -11.659
   93    HB2  LEU  13           2HB      LEU  13   0.668  -5.848 -13.883
   94    HB3  LEU  13           3HB      LEU  13  -0.714  -5.050 -14.609
   95    HG   LEU  13           HG       LEU  13  -0.171  -2.964 -13.335
   96   HD11  LEU  13          1HD1      LEU  13   2.293  -4.451 -12.379
   97   HD12  LEU  13          2HD1      LEU  13   0.944  -3.885 -11.389
   98   HD13  LEU  13          3HD1      LEU  13   1.992  -2.720 -12.191
   99   HD21  LEU  13          3HD2      LEU  13   0.667  -3.211 -15.621
  100   HD22  LEU  13          1HD2      LEU  13   2.139  -3.982 -15.019
  101   HD23  LEU  13          2HD2      LEU  13   1.797  -2.292 -14.630
  102    H    GLU  14           H        GLU  14  -3.440  -5.662 -13.270
  103    HA   GLU  14           HA       GLU  14  -4.151  -2.926 -12.905
  104    HB2  GLU  14           2HB      GLU  14  -5.876  -5.388 -13.401
  105    HB3  GLU  14           3HB      GLU  14  -6.509  -3.745 -13.355
  106    HG2  GLU  14           2HG      GLU  14  -6.210  -4.490 -15.659
  107    HG3  GLU  14           3HG      GLU  14  -5.140  -3.137 -15.300
  108    H    ALA  15           H        ALA  15  -4.771  -5.913 -11.076
  109    HA   ALA  15           HA       ALA  15  -6.433  -4.897  -9.053
  110    HB1  ALA  15           3HB      ALA  15  -5.742  -6.936  -7.807
  111    HB2  ALA  15           1HB      ALA  15  -4.456  -7.208  -8.989
  112    HB3  ALA  15           2HB      ALA  15  -6.147  -7.294  -9.485
  113    H    LEU  16           H        LEU  16  -2.936  -4.962  -9.424
  114    HA   LEU  16           HA       LEU  16  -2.181  -3.997  -6.857
  115    HB2  LEU  16           2HB      LEU  16  -0.680  -3.719  -9.491
  116    HB3  LEU  16           3HB      LEU  16   0.014  -3.560  -7.882
  117    HG   LEU  16           HG       LEU  16  -1.115  -6.121  -9.082
  118   HD11  LEU  16          1HD1      LEU  16   0.985  -5.456 -10.124
  119   HD12  LEU  16          2HD1      LEU  16   1.209  -6.890  -9.126
  120   HD13  LEU  16          3HD1      LEU  16   1.756  -5.314  -8.541
  121   HD21  LEU  16          3HD2      LEU  16  -1.449  -6.059  -6.655
  122   HD22  LEU  16          1HD2      LEU  16   0.266  -5.708  -6.414
  123   HD23  LEU  16          2HD2      LEU  16  -0.238  -7.252  -7.105
  124    H    GLU  17           H        GLU  17  -3.084  -2.435  -9.904
  125    HA   GLU  17           HA       GLU  17  -2.338   0.244  -9.200
  126    HB2  GLU  17           2HB      GLU  17  -4.268  -0.770 -11.338
  127    HB3  GLU  17           3HB      GLU  17  -3.746   0.908 -11.178
  128    HG2  GLU  17           2HG      GLU  17  -1.448   0.305 -11.676
  129    HG3  GLU  17           3HG      GLU  17  -1.857  -1.410 -11.691
  130    H    LYS  18           H        LYS  18  -5.324  -1.642  -8.849
  131    HA   LYS  18           HA       LYS  18  -6.987   0.514  -7.962
  132    HB2  LYS  18           2HB      LYS  18  -7.235  -2.506  -7.724
  133    HB3  LYS  18           3HB      LYS  18  -8.348  -1.452  -6.870
  134    HG2  LYS  18           2HG      LYS  18  -9.430  -2.159  -8.878
  135    HG3  LYS  18           3HG      LYS  18  -9.029  -0.451  -9.064
  136    HD2  LYS  18           2HD      LYS  18  -7.114  -1.029 -10.477
  137    HD3  LYS  18           3HD      LYS  18  -7.413  -2.749 -10.221
  138    HE2  LYS  18           2HE      LYS  18  -8.222  -2.063 -12.417
  139    HE3  LYS  18           3HE      LYS  18  -9.581  -2.539 -11.399
  140    HZ1  LYS  18           3HZ      LYS  18 -10.014  -0.514 -12.674
  141    HZ2  LYS  18           1HZ      LYS  18  -8.725   0.260 -11.898
  142    HZ3  LYS  18           2HZ      LYS  18 -10.077  -0.223 -11.009
  143    H    ALA  19           H        ALA  19  -5.010  -1.954  -6.280
  144    HA   ALA  19           HA       ALA  19  -5.393  -1.102  -3.620
  145    HB1  ALA  19           3HB      ALA  19  -4.358  -3.256  -4.200
  146    HB2  ALA  19           1HB      ALA  19  -3.316  -2.327  -3.121
  147    HB3  ALA  19           2HB      ALA  19  -2.945  -2.418  -4.847
  148    H    LEU  20           H        LEU  20  -2.932  -0.210  -6.006
  149    HA   LEU  20           HA       LEU  20  -1.289   1.563  -4.678
  150    HB2  LEU  20           2HB      LEU  20  -0.930   0.714  -6.967
  151    HB3  LEU  20           3HB      LEU  20  -2.280   1.631  -7.569
  152    HG   LEU  20           HG       LEU  20   0.145   2.439  -8.077
  153   HD11  LEU  20          1HD1      LEU  20  -0.466   4.787  -8.142
  154   HD12  LEU  20          2HD1      LEU  20  -1.847   4.474  -7.089
  155   HD13  LEU  20          3HD1      LEU  20  -1.788   3.759  -8.699
  156   HD21  LEU  20          3HD2      LEU  20   1.018   2.304  -5.788
  157   HD22  LEU  20          1HD2      LEU  20  -0.095   3.575  -5.280
  158   HD23  LEU  20          2HD2      LEU  20   1.180   3.929  -6.450
  159    H    LYS  21           H        LYS  21  -4.251   2.264  -6.465
  160    HA   LYS  21           HA       LYS  21  -4.345   5.020  -6.268
  161    HB2  LYS  21           2HB      LYS  21  -5.734   3.698  -7.799
  162    HB3  LYS  21           3HB      LYS  21  -6.598   2.978  -6.448
  163    HG2  LYS  21           2HG      LYS  21  -7.619   5.159  -5.915
  164    HG3  LYS  21           3HG      LYS  21  -6.686   5.917  -7.209
  165    HD2  LYS  21           2HD      LYS  21  -9.033   5.468  -7.888
  166    HD3  LYS  21           3HD      LYS  21  -7.868   4.613  -8.902
  167    HE2  LYS  21           2HE      LYS  21  -9.789   3.180  -8.354
  168    HE3  LYS  21           3HE      LYS  21  -8.312   2.525  -7.649
  169    HZ1  LYS  21           3HZ      LYS  21 -10.149   2.429  -6.105
  170    HZ2  LYS  21           1HZ      LYS  21 -10.389   4.090  -6.223
  171    HZ3  LYS  21           2HZ      LYS  21  -8.976   3.493  -5.518
  172    H    GLU  22           H        GLU  22  -5.501   2.510  -4.084
  173    HA   GLU  22           HA       GLU  22  -6.851   4.284  -2.266
  174    HB2  GLU  22           2HB      GLU  22  -6.160   1.330  -2.078
  175    HB3  GLU  22           3HB      GLU  22  -7.137   2.198  -0.899
  176    HG2  GLU  22           2HG      GLU  22  -7.823   1.821  -3.822
  177    HG3  GLU  22           3HG      GLU  22  -8.523   0.925  -2.478
  178    H    MET  23           H        MET  23  -3.682   2.554  -2.237
  179    HA   MET  23           HA       MET  23  -2.940   3.225   0.397
  180    HB2  MET  23           2HB      MET  23  -1.217   2.661  -2.050
  181    HB3  MET  23           3HB      MET  23  -0.583   2.797  -0.417
  182    HG2  MET  23           2HG      MET  23  -2.750   0.790  -0.881
  183    HG3  MET  23           3HG      MET  23  -1.152   0.447  -1.521
  184    HE1  MET  23           3HE      MET  23  -2.448   2.105   1.899
  185    HE2  MET  23           1HE      MET  23  -2.172   0.740   2.980
  186    HE3  MET  23           2HE      MET  23  -3.378   0.619   1.697
  187    H    ILE  24           H        ILE  24  -2.406   4.941  -2.683
  188    HA   ILE  24           HA       ILE  24  -0.947   7.138  -1.630
  189    HB   ILE  24           HB       ILE  24  -2.674   6.957  -4.155
  190   HG12  ILE  24          2HG1      ILE  24   0.332   6.645  -3.691
  191   HG13  ILE  24          3HG1      ILE  24  -0.783   5.432  -4.303
  192   HG21  ILE  24          1HG2      ILE  24  -0.698   9.154  -3.430
  193   HG22  ILE  24          2HG2      ILE  24  -2.451   9.321  -3.444
  194   HG23  ILE  24          3HG2      ILE  24  -1.584   9.018  -4.949
  195   HD11  ILE  24          3HD1      ILE  24   0.125   7.925  -5.737
  196   HD12  ILE  24          1HD1      ILE  24  -1.074   6.781  -6.348
  197   HD13  ILE  24          2HD1      ILE  24   0.588   6.260  -6.083
  198    H    ARG  25           H        ARG  25  -4.396   6.617  -2.277
  199    HA   ARG  25           HA       ARG  25  -5.554   9.000  -1.484
  200    HB2  ARG  25           2HB      ARG  25  -6.761   7.174  -2.604
  201    HB3  ARG  25           3HB      ARG  25  -6.553   6.137  -1.203
  202    HG2  ARG  25           2HG      ARG  25  -8.040   7.652   0.106
  203    HG3  ARG  25           3HG      ARG  25  -8.285   8.625  -1.347
  204    HD2  ARG  25           2HD      ARG  25  -9.256   6.646  -2.498
  205    HD3  ARG  25           3HD      ARG  25  -9.027   5.688  -1.029
  206    HE   ARG  25           HE       ARG  25 -10.567   8.013  -0.480
  207   HH11  ARG  25          1HH1      ARG  25 -10.870   4.841  -2.019
  208   HH12  ARG  25          2HH1      ARG  25 -12.584   4.740  -1.731
  209   HH21  ARG  25          1HH2      ARG  25 -12.791   7.859  -0.112
  210   HH22  ARG  25          2HH2      ARG  25 -13.671   6.459  -0.644
  211    H    GLN  26           H        GLN  26  -4.653   6.194   0.513
  212    HA   GLN  26           HA       GLN  26  -5.653   7.182   2.996
  213    HB2  GLN  26           2HB      GLN  26  -3.610   4.995   2.410
  214    HB3  GLN  26           3HB      GLN  26  -4.259   5.335   4.010
  215    HG2  GLN  26           2HG      GLN  26  -5.853   4.390   1.613
  216    HG3  GLN  26           3HG      GLN  26  -5.364   3.403   2.985
  217   HE21  GLN  26          1HE2      GLN  26  -8.043   4.048   1.907
  218   HE22  GLN  26          2HE2      GLN  26  -8.932   4.699   3.234
  219    H    ALA  27           H        ALA  27  -2.396   7.037   1.558
  220    HA   ALA  27           HA       ALA  27  -0.935   8.149   3.693
  221    HB1  ALA  27           3HB      ALA  27  -0.308   8.220   0.720
  222    HB2  ALA  27           1HB      ALA  27   0.088   6.911   1.832
  223    HB3  ALA  27           2HB      ALA  27   0.847   8.491   2.031
  224    H    ARG  28           H        ARG  28  -2.836   9.672   1.171
  225    HA   ARG  28           HA       ARG  28  -1.818  12.347   1.623
  226    HB2  ARG  28           2HB      ARG  28  -4.145  11.366  -0.084
  227    HB3  ARG  28           3HB      ARG  28  -3.636  13.050   0.015
  228    HG2  ARG  28           2HG      ARG  28  -1.344  12.280  -0.809
  229    HG3  ARG  28           3HG      ARG  28  -2.078  10.714  -1.134
  230    HD2  ARG  28           2HD      ARG  28  -2.964  13.354  -2.352
  231    HD3  ARG  28           3HD      ARG  28  -1.968  12.138  -3.156
  232    HE   ARG  28           HE       ARG  28  -4.690  11.459  -2.219
  233   HH11  ARG  28          1HH1      ARG  28  -2.440  11.842  -4.923
  234   HH12  ARG  28          2HH1      ARG  28  -3.510  11.079  -6.061
  235   HH21  ARG  28          1HH2      ARG  28  -6.046  10.442  -3.721
  236   HH22  ARG  28          2HH2      ARG  28  -5.549  10.289  -5.378
  237    H    LYS  29           H        LYS  29  -4.805  10.529   2.535
  238    HA   LYS  29           HA       LYS  29  -6.075  12.788   3.771
  239    HB2  LYS  29           2HB      LYS  29  -7.668  11.215   4.771
  240    HB3  LYS  29           3HB      LYS  29  -7.409  10.825   3.077
  241    HG2  LYS  29           2HG      LYS  29  -6.014   8.943   3.654
  242    HG3  LYS  29           3HG      LYS  29  -6.039   9.374   5.361
  243    HD2  LYS  29           2HD      LYS  29  -8.503   8.552   3.770
  244    HD3  LYS  29           3HD      LYS  29  -7.533   7.445   4.740
  245    HE2  LYS  29           2HE      LYS  29  -8.043   8.827   6.761
  246    HE3  LYS  29           3HE      LYS  29  -9.094   9.839   5.765
  247    HZ1  LYS  29           3HZ      LYS  29 -10.384   7.801   5.244
  248    HZ2  LYS  29           1HZ      LYS  29 -10.416   8.210   6.881
  249    HZ3  LYS  29           2HZ      LYS  29  -9.438   6.947   6.348
  250    H    PHE  30           H        PHE  30  -3.777  10.385   4.939
  251    HA   PHE  30           HA       PHE  30  -3.806  11.319   7.693
  252    HB2  PHE  30           2HB      PHE  30  -1.833   9.501   6.229
  253    HB3  PHE  30           3HB      PHE  30  -1.805   9.824   7.960
  254    HD1  PHE  30           HD1      PHE  30  -4.542   9.554   8.867
  255    HD2  PHE  30           HD2      PHE  30  -2.474   7.280   5.890
  256    HE1  PHE  30           HE1      PHE  30  -6.032   7.637   9.280
  257    HE2  PHE  30           HE2      PHE  30  -3.983   5.373   6.303
  258    HZ   PHE  30           HZ       PHE  30  -5.757   5.551   7.998
  259    H    ALA  31           H        ALA  31  -2.417  12.332   4.778
  260    HA   ALA  31           HA       ALA  31  -1.208  14.085   4.137
  261    HB1  ALA  31           3HB      ALA  31  -2.499  15.377   5.784
  262    HB2  ALA  31           1HB      ALA  31  -0.855  15.997   5.610
  263    HB3  ALA  31           2HB      ALA  31  -1.290  15.025   7.019
  264    H    GLY  32           H        GLY  32   0.351  12.444   3.695
  265    HA2  GLY  32           2HA      GLY  32   2.974  13.175   4.840
  266    HA3  GLY  32           3HA      GLY  32   2.528  11.469   4.705
  267    H    THR  33           H        THR  33   4.409  11.304   3.272
  268    HA   THR  33           HA       THR  33   3.855  12.146   0.483
  269    HB   THR  33           HB       THR  33   6.521  11.341   1.762
  270    HG1  THR  33           HG1      THR  33   5.770  13.413   2.393
  271   HG21  THR  33          3HG2      THR  33   5.992  12.434  -1.033
  272   HG22  THR  33          1HG2      THR  33   6.448  10.768  -0.663
  273   HG23  THR  33          2HG2      THR  33   7.577  12.086  -0.338
  274    H    VAL  34           H        VAL  34   4.014  10.475  -1.154
  275    HA   VAL  34           HA       VAL  34   4.293   7.697  -0.255
  276    HB   VAL  34           HB       VAL  34   1.942   8.017   0.034
  277   HG11  VAL  34          1HG1      VAL  34   1.730   9.141  -2.770
  278   HG12  VAL  34          2HG1      VAL  34   1.603  10.061  -1.270
  279   HG13  VAL  34          3HG1      VAL  34   0.386   8.844  -1.662
  280   HG21  VAL  34          3HG2      VAL  34   0.961   6.385  -1.524
  281   HG22  VAL  34          1HG2      VAL  34   2.563   5.874  -0.987
  282   HG23  VAL  34          2HG2      VAL  34   2.350   6.560  -2.600
  283    H    THR  35           H        THR  35   5.984   7.194  -1.437
  284    HA   THR  35           HA       THR  35   6.196   7.687  -4.313
  285    HB   THR  35           HB       THR  35   8.073   6.242  -2.362
  286    HG1  THR  35           HG1      THR  35   8.378   8.247  -1.738
  287   HG21  THR  35          3HG2      THR  35   9.818   6.524  -4.054
  288   HG22  THR  35          1HG2      THR  35   8.676   7.304  -5.148
  289   HG23  THR  35          2HG2      THR  35   8.480   5.597  -4.740
  290    H    TYR  36           H        TYR  36   6.336   5.879  -5.822
  291    HA   TYR  36           HA       TYR  36   5.811   3.180  -4.856
  292    HB2  TYR  36           2HB      TYR  36   3.834   2.790  -6.224
  293    HB3  TYR  36           3HB      TYR  36   3.528   4.108  -5.112
  294    HD1  TYR  36           HD2      TYR  36   3.470   6.501  -6.018
  295    HD2  TYR  36           HD1      TYR  36   3.606   3.093  -8.612
  296    HE1  TYR  36           HE2      TYR  36   2.671   7.880  -7.891
  297    HE2  TYR  36           HE1      TYR  36   2.799   4.480 -10.470
  298    HH   TYR  36           HH       TYR  36   1.637   6.518 -10.872
  299    H    THR  37           H        THR  37   6.534   1.607  -6.199
  300    HA   THR  37           HA       THR  37   7.806   2.373  -8.774
  301    HB   THR  37           HB       THR  37   8.838   0.376  -6.695
  302    HG1  THR  37           HG1      THR  37   9.127   3.024  -6.867
  303   HG21  THR  37          3HG2      THR  37   9.446  -0.337  -8.996
  304   HG22  THR  37          1HG2      THR  37  10.868   0.226  -8.113
  305   HG23  THR  37          2HG2      THR  37  10.114   1.265  -9.323
  306    H    LEU  38           H        LEU  38   6.499   1.481 -10.313
  307    HA   LEU  38           HA       LEU  38   5.337  -1.184  -9.986
  308    HB2  LEU  38           2HB      LEU  38   5.209   0.893 -12.214
  309    HB3  LEU  38           3HB      LEU  38   4.537  -0.719 -12.410
  310    HG   LEU  38           HG       LEU  38   3.647   1.271 -10.278
  311   HD11  LEU  38          1HD1      LEU  38   3.001   2.055 -12.506
  312   HD12  LEU  38          2HD1      LEU  38   1.595   1.535 -11.584
  313   HD13  LEU  38          3HD1      LEU  38   2.245   0.497 -12.858
  314   HD21  LEU  38          3HD2      LEU  38   1.795  -0.280  -9.877
  315   HD22  LEU  38          1HD2      LEU  38   3.350  -1.056  -9.572
  316   HD23  LEU  38          2HD2      LEU  38   2.461  -1.411 -11.058
  317    H    ASP  39           H        ASP  39   6.783  -2.769 -10.152
  318    HA   ASP  39           HA       ASP  39   8.621  -2.913 -12.464
  319    HB2  ASP  39           2HB      ASP  39   9.889  -2.837 -10.345
  320    HB3  ASP  39           3HB      ASP  39   8.924  -4.149  -9.678
  321    H    GLY  40           H        GLY  40   7.077  -3.818 -13.798
  322    HA2  GLY  40           2HA      GLY  40   6.075  -5.517 -14.918
  323    HA3  GLY  40           3HA      GLY  40   6.908  -6.636 -13.852
  324    H    ASN  41           H        ASN  41   5.881  -7.225 -11.867
  325    HA   ASN  41           HA       ASN  41   2.984  -6.736 -11.616
  326    HB2  ASN  41           2HB      ASN  41   4.341  -9.458 -11.730
  327    HB3  ASN  41           3HB      ASN  41   2.719  -9.230 -11.083
  328   HD21  ASN  41          1HD2      ASN  41   1.087  -8.398 -12.517
  329   HD22  ASN  41          2HD2      ASN  41   1.181  -8.734 -14.211
  330    H    ASP  42           H        ASP  42   5.477  -5.867 -10.138
  331    HA   ASP  42           HA       ASP  42   4.133  -6.209  -7.549
  332    HB2  ASP  42           2HB      ASP  42   6.295  -6.292  -6.297
  333    HB3  ASP  42           3HB      ASP  42   6.006  -7.718  -7.284
  334    H    LEU  43           H        LEU  43   4.525  -4.521  -6.090
  335    HA   LEU  43           HA       LEU  43   5.140  -1.902  -7.285
  336    HB2  LEU  43           2HB      LEU  43   2.829  -2.245  -7.796
  337    HB3  LEU  43           3HB      LEU  43   2.505  -2.995  -6.243
  338    HG   LEU  43           HG       LEU  43   2.775  -0.747  -5.147
  339   HD11  LEU  43          1HD1      LEU  43   4.183   0.369  -6.798
  340   HD12  LEU  43          2HD1      LEU  43   2.719   1.294  -6.474
  341   HD13  LEU  43          3HD1      LEU  43   2.856   0.353  -7.960
  342   HD21  LEU  43          3HD2      LEU  43   0.581   0.064  -5.808
  343   HD22  LEU  43          1HD2      LEU  43   0.584  -1.695  -5.694
  344   HD23  LEU  43          2HD2      LEU  43   0.632  -0.912  -7.278
  345    H    GLU  44           H        GLU  44   6.770  -1.368  -5.839
  346    HA   GLU  44           HA       GLU  44   6.378  -1.710  -2.956
  347    HB2  GLU  44           2HB      GLU  44   8.601  -2.230  -3.896
  348    HB3  GLU  44           3HB      GLU  44   8.752  -0.584  -4.513
  349    HG2  GLU  44           2HG      GLU  44   8.660   0.267  -2.159
  350    HG3  GLU  44           3HG      GLU  44   8.611  -1.397  -1.580
  351    H    ILE  45           H        ILE  45   4.975  -0.271  -2.222
  352    HA   ILE  45           HA       ILE  45   5.091   2.600  -2.864
  353    HB   ILE  45           HB       ILE  45   3.149   0.976  -1.134
  354   HG12  ILE  45          2HG1      ILE  45   2.732   2.145  -3.923
  355   HG13  ILE  45          3HG1      ILE  45   3.074   0.453  -3.589
  356   HG21  ILE  45          1HG2      ILE  45   1.708   2.985  -1.119
  357   HG22  ILE  45          2HG2      ILE  45   2.949   3.885  -1.991
  358   HG23  ILE  45          3HG2      ILE  45   3.268   3.307  -0.356
  359   HD11  ILE  45          3HD1      ILE  45   0.982   0.291  -2.332
  360   HD12  ILE  45          1HD1      ILE  45   0.745   0.768  -4.012
  361   HD13  ILE  45          2HD1      ILE  45   0.627   1.975  -2.734
  362    H    ARG  46           H        ARG  46   6.306   3.900  -1.541
  363    HA   ARG  46           HA       ARG  46   6.909   3.046   1.239
  364    HB2  ARG  46           2HB      ARG  46   8.582   4.747  -0.670
  365    HB3  ARG  46           3HB      ARG  46   8.989   4.441   1.019
  366    HG2  ARG  46           2HG      ARG  46   9.127   2.000   0.510
  367    HG3  ARG  46           3HG      ARG  46   8.797   2.363  -1.187
  368    HD2  ARG  46           2HD      ARG  46  11.198   3.312   0.414
  369    HD3  ARG  46           3HD      ARG  46  11.200   2.041  -0.812
  370    HE   ARG  46           HE       ARG  46  10.450   3.884  -2.389
  371   HH11  ARG  46          1HH1      ARG  46  12.522   4.560   0.379
  372   HH12  ARG  46          2HH1      ARG  46  13.267   5.942  -0.361
  373   HH21  ARG  46          1HH2      ARG  46  11.425   5.695  -3.346
  374   HH22  ARG  46          2HH2      ARG  46  12.637   6.586  -2.486
  375    H    ILE  47           H        ILE  47   5.797   4.200   2.644
  376    HA   ILE  47           HA       ILE  47   4.806   6.905   1.946
  377    HB   ILE  47           HB       ILE  47   3.734   4.957   4.052
  378   HG12  ILE  47          2HG1      ILE  47   2.618   5.686   1.294
  379   HG13  ILE  47          3HG1      ILE  47   3.380   4.158   1.706
  380   HG21  ILE  47          1HG2      ILE  47   2.609   7.616   3.081
  381   HG22  ILE  47          2HG2      ILE  47   3.328   7.315   4.665
  382   HG23  ILE  47          3HG2      ILE  47   1.815   6.523   4.219
  383   HD11  ILE  47          3HD1      ILE  47   1.551   3.675   3.258
  384   HD12  ILE  47          1HD1      ILE  47   0.998   3.922   1.604
  385   HD13  ILE  47          2HD1      ILE  47   0.773   5.194   2.804
  386    H    THR  48           H        THR  48   5.733   8.573   2.947
  387    HA   THR  48           HA       THR  48   7.540   8.138   5.249
  388    HB   THR  48           HB       THR  48   7.668  10.314   3.096
  389    HG1  THR  48           HG1      THR  48   9.284   7.966   3.293
  390   HG21  THR  48          3HG2      THR  48   8.816  10.953   5.195
  391   HG22  THR  48          1HG2      THR  48   9.973  10.684   3.886
  392   HG23  THR  48          2HG2      THR  48   9.755   9.460   5.138
  393    H    GLY  49           H        GLY  49   7.588   9.779   6.882
  394    HA2  GLY  49           2HA      GLY  49   7.033  11.674   8.058
  395    HA3  GLY  49           3HA      GLY  49   6.067  12.215   6.695
  396    H    VAL  50           H        VAL  50   5.333   9.068   7.846
  397    HA   VAL  50           HA       VAL  50   2.961  10.063   9.314
  398    HB   VAL  50           HB       VAL  50   1.911   7.828   8.818
  399   HG11  VAL  50          1HG1      VAL  50   1.359   9.762   7.419
  400   HG12  VAL  50          2HG1      VAL  50   1.372   8.297   6.436
  401   HG13  VAL  50          3HG1      VAL  50   2.731   9.425   6.359
  402   HG21  VAL  50          3HG2      VAL  50   4.290   7.382   6.972
  403   HG22  VAL  50          1HG2      VAL  50   2.849   6.358   7.064
  404   HG23  VAL  50          2HG2      VAL  50   3.941   6.479   8.446
  405    HA   PRO  51           HA       PRO  51   5.007   8.358  12.995
  406    HB2  PRO  51           2HB      PRO  51   2.906   8.577  14.774
  407    HB3  PRO  51           3HB      PRO  51   3.846   9.982  14.223
  408    HG2  PRO  51           2HG      PRO  51   1.190   8.991  13.238
  409    HG3  PRO  51           3HG      PRO  51   1.695  10.655  13.609
  410    HD2  PRO  51           2HD      PRO  51   1.614   9.717  11.061
  411    HD3  PRO  51           3HD      PRO  51   2.830  10.906  11.582
  412    H    GLU  52           H        GLU  52   4.461   6.649  14.741
  413    HA   GLU  52           HA       GLU  52   4.362   4.185  13.412
  414    HB2  GLU  52           2HB      GLU  52   5.591   4.626  15.564
  415    HB3  GLU  52           3HB      GLU  52   4.048   4.672  16.413
  416    HG2  GLU  52           2HG      GLU  52   5.064   2.507  16.773
  417    HG3  GLU  52           3HG      GLU  52   3.652   2.296  15.740
  418    H    GLN  53           H        GLN  53   1.910   5.765  15.448
  419    HA   GLN  53           HA       GLN  53  -0.058   3.816  15.542
  420    HB2  GLN  53           2HB      GLN  53  -1.679   5.725  15.860
  421    HB3  GLN  53           3HB      GLN  53  -0.263   5.801  16.903
  422    HG2  GLN  53           2HG      GLN  53   0.743   7.528  15.519
  423    HG3  GLN  53           3HG      GLN  53  -0.554   7.391  14.335
  424   HE21  GLN  53          1HE2      GLN  53  -2.564   8.338  14.785
  425   HE22  GLN  53          2HE2      GLN  53  -2.788   9.464  16.075
  426    H    VAL  54           H        VAL  54   0.554   6.213  13.011
  427    HA   VAL  54           HA       VAL  54  -1.771   5.614  11.429
  428    HB   VAL  54           HB       VAL  54   0.742   7.262  10.870
  429   HG11  VAL  54          1HG1      VAL  54  -1.796   7.120   9.204
  430   HG12  VAL  54          2HG1      VAL  54  -0.196   6.548   8.723
  431   HG13  VAL  54          3HG1      VAL  54  -0.481   8.272   8.972
  432   HG21  VAL  54          3HG2      VAL  54  -0.708   9.208  11.283
  433   HG22  VAL  54          1HG2      VAL  54  -0.685   8.138  12.684
  434   HG23  VAL  54          2HG2      VAL  54  -2.078   8.140  11.599
  435    H    ARG  55           H        ARG  55   1.700   4.900  11.231
  436    HA   ARG  55           HA       ARG  55   2.002   3.489   8.896
  437    HB2  ARG  55           2HB      ARG  55   3.303   3.296  11.625
  438    HB3  ARG  55           3HB      ARG  55   3.752   2.128  10.396
  439    HG2  ARG  55           2HG      ARG  55   4.720   3.770   9.003
  440    HG3  ARG  55           3HG      ARG  55   3.917   5.096   9.848
  441    HD2  ARG  55           2HD      ARG  55   6.404   4.815  10.300
  442    HD3  ARG  55           3HD      ARG  55   5.363   4.929  11.714
  443    HE   ARG  55           HE       ARG  55   5.563   2.322  11.613
  444   HH11  ARG  55          1HH1      ARG  55   8.177   4.633  11.054
  445   HH12  ARG  55          2HH1      ARG  55   9.406   3.542  11.615
  446   HH21  ARG  55          1HH2      ARG  55   7.168   0.967  12.433
  447   HH22  ARG  55          2HH2      ARG  55   8.834   1.461  12.400
  448    H    LYS  56           H        LYS  56   1.018   2.192  12.061
  449    HA   LYS  56           HA       LYS  56   0.670  -0.487  11.205
  450    HB2  LYS  56           2HB      LYS  56  -0.490   0.901  13.657
  451    HB3  LYS  56           3HB      LYS  56  -0.394  -0.842  13.412
  452    HG2  LYS  56           2HG      LYS  56   2.104  -0.660  13.323
  453    HG3  LYS  56           3HG      LYS  56   1.961   1.062  13.664
  454    HD2  LYS  56           2HD      LYS  56   2.477  -0.004  15.750
  455    HD3  LYS  56           3HD      LYS  56   0.771   0.442  15.827
  456    HE2  LYS  56           2HE      LYS  56   0.146  -1.887  15.261
  457    HE3  LYS  56           3HE      LYS  56   1.854  -2.321  15.182
  458    HZ1  LYS  56           3HZ      LYS  56   0.416  -1.366  17.607
  459    HZ2  LYS  56           1HZ      LYS  56   2.063  -1.752  17.525
  460    HZ3  LYS  56           2HZ      LYS  56   0.901  -2.954  17.289
  461    H    GLU  57           H        GLU  57  -1.544   2.299  11.189
  462    HA   GLU  57           HA       GLU  57  -3.923   0.810  10.605
  463    HB2  GLU  57           2HB      GLU  57  -3.274   3.726   9.972
  464    HB3  GLU  57           3HB      GLU  57  -4.869   2.994   9.820
  465    HG2  GLU  57           2HG      GLU  57  -3.300   3.329  12.389
  466    HG3  GLU  57           3HG      GLU  57  -4.670   4.309  11.879
  467    H    LEU  58           H        LEU  58  -1.395   2.322   8.598
  468    HA   LEU  58           HA       LEU  58  -2.437   1.708   6.050
  469    HB2  LEU  58           2HB      LEU  58   0.328   2.326   7.074
  470    HB3  LEU  58           3HB      LEU  58   0.183   1.662   5.467
  471    HG   LEU  58           HG       LEU  58   0.338   3.982   5.145
  472   HD11  LEU  58          1HD1      LEU  58  -2.623   3.362   4.949
  473   HD12  LEU  58          2HD1      LEU  58  -1.386   3.005   3.740
  474   HD13  LEU  58          3HD1      LEU  58  -1.770   4.677   4.131
  475   HD21  LEU  58          3HD2      LEU  58  -1.764   4.454   7.270
  476   HD22  LEU  58          1HD2      LEU  58  -0.993   5.694   6.275
  477   HD23  LEU  58          2HD2      LEU  58  -0.033   4.757   7.415
  478    H    ALA  59           H        ALA  59  -0.749  -0.279   8.401
  479    HA   ALA  59           HA       ALA  59  -0.148  -2.496   6.774
  480    HB1  ALA  59           3HB      ALA  59  -0.016  -3.774   8.863
  481    HB2  ALA  59           1HB      ALA  59  -0.813  -2.459   9.737
  482    HB3  ALA  59           2HB      ALA  59   0.784  -2.212   9.032
  483    H    LYS  60           H        LYS  60  -3.090  -1.772   8.751
  484    HA   LYS  60           HA       LYS  60  -4.482  -4.145   7.905
  485    HB2  LYS  60           2HB      LYS  60  -5.403  -1.674   9.390
  486    HB3  LYS  60           3HB      LYS  60  -6.585  -2.814   8.770
  487    HG2  LYS  60           2HG      LYS  60  -6.319  -3.515  10.977
  488    HG3  LYS  60           3HG      LYS  60  -5.271  -4.623  10.094
  489    HD2  LYS  60           2HD      LYS  60  -4.173  -3.894  12.135
  490    HD3  LYS  60           3HD      LYS  60  -3.307  -3.228  10.745
  491    HE2  LYS  60           2HE      LYS  60  -3.593  -1.590  12.599
  492    HE3  LYS  60           3HE      LYS  60  -4.331  -1.047  11.096
  493    HZ1  LYS  60           3HZ      LYS  60  -6.490  -1.719  11.984
  494    HZ2  LYS  60           1HZ      LYS  60  -5.731  -0.591  12.989
  495    HZ3  LYS  60           2HZ      LYS  60  -5.759  -2.222  13.422
  496    H    GLU  61           H        GLU  61  -4.150  -0.922   6.558
  497    HA   GLU  61           HA       GLU  61  -6.281  -1.129   4.668
  498    HB2  GLU  61           2HB      GLU  61  -3.773   0.599   4.687
  499    HB3  GLU  61           3HB      GLU  61  -5.029   0.722   3.457
  500    HG2  GLU  61           2HG      GLU  61  -5.335   1.274   6.418
  501    HG3  GLU  61           3HG      GLU  61  -5.334   2.465   5.115
  502    H    ALA  62           H        ALA  62  -2.802  -1.837   4.566
  503    HA   ALA  62           HA       ALA  62  -2.525  -2.776   1.960
  504    HB1  ALA  62           3HB      ALA  62  -0.643  -2.380   3.498
  505    HB2  ALA  62           1HB      ALA  62  -0.566  -4.004   2.825
  506    HB3  ALA  62           2HB      ALA  62  -1.134  -3.764   4.479
  507    H    GLU  63           H        GLU  63  -3.561  -4.480   4.900
  508    HA   GLU  63           HA       GLU  63  -3.795  -7.089   3.838
  509    HB2  GLU  63           2HB      GLU  63  -5.126  -5.827   6.272
  510    HB3  GLU  63           3HB      GLU  63  -5.095  -7.559   5.931
  511    HG2  GLU  63           2HG      GLU  63  -2.611  -7.513   6.057
  512    HG3  GLU  63           3HG      GLU  63  -2.676  -5.805   6.456
  513    H    ARG  64           H        ARG  64  -6.261  -4.495   4.247
  514    HA   ARG  64           HA       ARG  64  -8.454  -6.162   3.456
  515    HB2  ARG  64           2HB      ARG  64  -9.820  -4.096   3.319
  516    HB3  ARG  64           3HB      ARG  64  -8.938  -4.210   4.836
  517    HG2  ARG  64           2HG      ARG  64  -7.359  -2.547   4.143
  518    HG3  ARG  64           3HG      ARG  64  -7.986  -2.538   2.496
  519    HD2  ARG  64           2HD      ARG  64  -9.671  -1.719   4.886
  520    HD3  ARG  64           3HD      ARG  64  -8.649  -0.584   4.005
  521    HE   ARG  64           HE       ARG  64 -10.762  -2.123   2.623
  522   HH11  ARG  64          1HH1      ARG  64  -9.368   1.013   3.478
  523   HH12  ARG  64          2HH1      ARG  64 -10.423   1.891   2.419
  524   HH21  ARG  64          1HH2      ARG  64 -12.098  -0.943   1.216
  525   HH22  ARG  64          2HH2      ARG  64 -11.966   0.786   1.140
  526    H    LEU  65           H        LEU  65  -6.217  -4.058   1.707
  527    HA   LEU  65           HA       LEU  65  -7.620  -4.203  -0.816
  528    HB2  LEU  65           2HB      LEU  65  -4.741  -3.419  -0.207
  529    HB3  LEU  65           3HB      LEU  65  -5.551  -3.176  -1.750
  530    HG   LEU  65           HG       LEU  65  -6.348  -1.855   0.875
  531   HD11  LEU  65          1HD1      LEU  65  -4.226  -0.983   0.071
  532   HD12  LEU  65          2HD1      LEU  65  -5.494   0.227  -0.094
  533   HD13  LEU  65          3HD1      LEU  65  -4.927  -0.653  -1.517
  534   HD21  LEU  65          3HD2      LEU  65  -7.478  -1.411  -1.907
  535   HD22  LEU  65          1HD2      LEU  65  -7.876  -0.472  -0.467
  536   HD23  LEU  65          2HD2      LEU  65  -8.303  -2.178  -0.547
  537    H    ALA  66           H        ALA  66  -5.095  -6.048   0.787
  538    HA   ALA  66           HA       ALA  66  -4.242  -7.686  -1.341
  539    HB1  ALA  66           3HB      ALA  66  -3.045  -7.524   0.808
  540    HB2  ALA  66           1HB      ALA  66  -3.391  -9.203   0.392
  541    HB3  ALA  66           2HB      ALA  66  -4.362  -8.375   1.616
  542    H    LYS  67           H        LYS  67  -6.822  -8.166   1.079
  543    HA   LYS  67           HA       LYS  67  -7.661 -10.704  -0.006
  544    HB2  LYS  67           2HB      LYS  67  -9.322 -10.716   1.749
  545    HB3  LYS  67           3HB      LYS  67  -7.812 -10.127   2.429
  546    HG2  LYS  67           2HG      LYS  67  -8.699  -7.784   2.198
  547    HG3  LYS  67           3HG      LYS  67 -10.242  -8.461   1.689
  548    HD2  LYS  67           2HD      LYS  67  -8.930  -8.957   4.396
  549    HD3  LYS  67           3HD      LYS  67 -10.188  -7.765   4.090
  550    HE2  LYS  67           2HE      LYS  67 -11.251  -9.664   5.083
  551    HE3  LYS  67           3HE      LYS  67 -11.704  -9.667   3.380
  552    HZ1  LYS  67           3HZ      LYS  67 -10.177 -11.430   2.960
  553    HZ2  LYS  67           1HZ      LYS  67 -11.092 -11.869   4.308
  554    HZ3  LYS  67           2HZ      LYS  67  -9.506 -11.319   4.509
  555    H    GLU  68           H        GLU  68  -8.484  -7.378  -0.564
  556    HA   GLU  68           HA       GLU  68 -11.114  -7.734  -1.626
  557    HB2  GLU  68           2HB      GLU  68 -10.192  -5.562  -0.738
  558    HB3  GLU  68           3HB      GLU  68  -9.130  -5.468  -2.137
  559    HG2  GLU  68           2HG      GLU  68 -10.995  -4.012  -2.511
  560    HG3  GLU  68           3HG      GLU  68 -11.161  -5.383  -3.603
  561    H    PHE  69           H        PHE  69  -7.933  -7.172  -3.135
  562    HA   PHE  69           HA       PHE  69  -9.026  -7.667  -5.822
  563    HB2  PHE  69           2HB      PHE  69  -6.289  -6.557  -5.041
  564    HB3  PHE  69           3HB      PHE  69  -7.030  -6.519  -6.639
  565    HD1  PHE  69           HD1      PHE  69  -9.604  -5.454  -6.476
  566    HD2  PHE  69           HD2      PHE  69  -6.272  -4.457  -3.983
  567    HE1  PHE  69           HE1      PHE  69 -10.645  -3.295  -5.923
  568    HE2  PHE  69           HE2      PHE  69  -7.326  -2.305  -3.440
  569    HZ   PHE  69           HZ       PHE  69  -9.508  -1.723  -4.406
  570    H    ASN  70           H        ASN  70  -7.722  -9.512  -3.484
  571    HA   ASN  70           HA       ASN  70  -6.696 -11.487  -3.274
  572    HB2  ASN  70           2HB      ASN  70  -8.610 -12.081  -4.869
  573    HB3  ASN  70           3HB      ASN  70  -7.438 -12.045  -6.181
  574   HD21  ASN  70          1HD2      ASN  70  -5.831 -13.703  -6.257
  575   HD22  ASN  70          2HD2      ASN  70  -5.993 -15.170  -5.357
  576    H    ILE  71           H        ILE  71  -4.891  -9.810  -3.331
  577    HA   ILE  71           HA       ILE  71  -2.682 -10.755  -5.059
  578    HB   ILE  71           HB       ILE  71  -1.779  -8.359  -5.000
  579   HG12  ILE  71          2HG1      ILE  71  -4.615  -7.726  -4.034
  580   HG13  ILE  71          3HG1      ILE  71  -3.122  -7.443  -3.150
  581   HG21  ILE  71          1HG2      ILE  71  -2.781  -9.286  -7.040
  582   HG22  ILE  71          2HG2      ILE  71  -3.152  -7.568  -6.891
  583   HG23  ILE  71          3HG2      ILE  71  -4.383  -8.772  -6.506
  584   HD11  ILE  71          3HD1      ILE  71  -2.472  -5.761  -4.818
  585   HD12  ILE  71          1HD1      ILE  71  -3.996  -5.379  -4.019
  586   HD13  ILE  71          2HD1      ILE  71  -4.003  -6.020  -5.660
  587    H    THR  72           H        THR  72  -0.631 -10.747  -4.030
  588    HA   THR  72           HA       THR  72  -0.765 -11.202  -1.163
  589    HB   THR  72           HB       THR  72   1.662 -11.954  -1.545
  590    HG1  THR  72           HG1      THR  72   1.637 -10.648  -3.664
  591   HG21  THR  72          3HG2      THR  72  -0.436 -13.336  -3.268
  592   HG22  THR  72          1HG2      THR  72  -0.220 -13.583  -1.531
  593   HG23  THR  72          2HG2      THR  72   1.052 -14.060  -2.654
  594    H    VAL  73           H        VAL  73   0.113  -9.844   0.385
  595    HA   VAL  73           HA       VAL  73   1.712  -7.519  -0.539
  596    HB   VAL  73           HB       VAL  73  -0.643  -6.836   0.086
  597   HG11  VAL  73          1HG1      VAL  73  -1.333  -6.727   2.437
  598   HG12  VAL  73          2HG1      VAL  73   0.128  -7.593   2.921
  599   HG13  VAL  73          3HG1      VAL  73  -1.084  -8.400   1.923
  600   HG21  VAL  73          3HG2      VAL  73  -0.003  -4.847   1.340
  601   HG22  VAL  73          1HG2      VAL  73   1.251  -5.235   0.162
  602   HG23  VAL  73          2HG2      VAL  73   1.496  -5.616   1.869
  603    H    THR  74           H        THR  74   3.356  -6.883   0.771
  604    HA   THR  74           HA       THR  74   3.830  -8.180   3.362
  605    HB   THR  74           HB       THR  74   5.252  -9.373   1.716
  606    HG1  THR  74           HG1      THR  74   7.385  -8.445   2.719
  607   HG21  THR  74          3HG2      THR  74   7.054  -8.265   0.469
  608   HG22  THR  74          1HG2      THR  74   6.543  -6.690   1.076
  609   HG23  THR  74          2HG2      THR  74   5.490  -7.600  -0.012
  610    H    TYR  75           H        TYR  75   4.468  -6.671   4.886
  611    HA   TYR  75           HA       TYR  75   5.208  -3.960   4.000
  612    HB2  TYR  75           2HB      TYR  75   3.584  -2.992   5.739
  613    HB3  TYR  75           3HB      TYR  75   2.873  -3.615   4.258
  614    HD1  TYR  75           HD1      TYR  75   3.395  -4.385   7.890
  615    HD2  TYR  75           HD2      TYR  75   1.236  -5.384   4.329
  616    HE1  TYR  75           HE1      TYR  75   1.858  -5.783   9.204
  617    HE2  TYR  75           HE2      TYR  75  -0.290  -6.780   5.653
  618    HH   TYR  75           HH       TYR  75  -0.570  -6.633   8.931
  619    H    THR  76           H        THR  76   6.508  -2.828   5.383
  620    HA   THR  76           HA       THR  76   7.688  -4.339   7.629
  621    HB   THR  76           HB       THR  76   9.040  -2.152   5.976
  622    HG1  THR  76           HG1      THR  76   8.553  -3.837   4.569
  623   HG21  THR  76          3HG2      THR  76  10.222  -4.358   7.727
  624   HG22  THR  76          1HG2      THR  76  10.117  -2.648   8.171
  625   HG23  THR  76          2HG2      THR  76  11.139  -3.151   6.827
  626    H    ILE  77           H        ILE  77   7.149  -3.513   9.538
  627    HA   ILE  77           HA       ILE  77   7.609  -0.692  10.114
  628    HB   ILE  77           HB       ILE  77   5.557  -0.795  11.785
  629   HG12  ILE  77          2HG1      ILE  77   4.620  -2.815   9.690
  630   HG13  ILE  77          3HG1      ILE  77   4.910  -3.146  11.392
  631   HG21  ILE  77          1HG2      ILE  77   5.740   0.844   9.990
  632   HG22  ILE  77          2HG2      ILE  77   4.075   0.282  10.150
  633   HG23  ILE  77          3HG2      ILE  77   5.085  -0.318   8.833
  634   HD11  ILE  77          3HD1      ILE  77   2.547  -2.986  10.933
  635   HD12  ILE  77          1HD1      ILE  77   2.743  -1.357  10.280
  636   HD13  ILE  77          2HD1      ILE  77   3.047  -1.670  11.993
  637    H    ARG  78           H        ARG  78   9.062  -0.701  11.663
  638    HA   ARG  78           HA       ARG  78   9.231  -2.987  13.548
  639    HB2  ARG  78           2HB      ARG  78  11.460  -1.183  12.517
  640    HB3  ARG  78           3HB      ARG  78  11.661  -2.504  13.666
  641    HG2  ARG  78           2HG      ARG  78  10.977  -4.128  11.945
  642    HG3  ARG  78           3HG      ARG  78  10.722  -2.813  10.793
  643    HD2  ARG  78           2HD      ARG  78  13.103  -2.247  10.900
  644    HD3  ARG  78           3HD      ARG  78  13.362  -3.524  12.093
  645    HE   ARG  78           HE       ARG  78  12.248  -4.345   9.521
  646   HH11  ARG  78          1HH1      ARG  78  15.148  -4.094  11.517
  647   HH12  ARG  78          2HH1      ARG  78  16.037  -5.241  10.560
  648   HH21  ARG  78          1HH2      ARG  78  13.447  -5.854   8.291
  649   HH22  ARG  78          2HH2      ARG  78  15.079  -6.229   8.750
  650    H    GLY  79           H        GLY  79   8.155  -2.284  15.252
  651    HA2  GLY  79           2HA      GLY  79   8.313   0.429  16.310
  652    HA3  GLY  79           3HA      GLY  79   7.351  -0.902  16.942
  653    H    SER  80           H        SER  80  10.725   0.139  16.545
  654    HA   SER  80           HA       SER  80  12.637  -0.150  17.704
  655    HB2  SER  80           2HB      SER  80  10.769  -0.298  20.110
  656    HB3  SER  80           3HB      SER  80  12.504   0.020  20.180
  657    HG   SER  80           HG       SER  80  10.413   1.674  19.390
  658    H    LEU  81           H        LEU  81  11.486  -2.468  16.520
  659    HA   LEU  81           HA       LEU  81  11.449  -4.700  18.368
  660    HB2  LEU  81           2HB      LEU  81  11.209  -4.686  15.334
  661    HB3  LEU  81           3HB      LEU  81  10.869  -6.057  16.376
  662    HG   LEU  81           HG       LEU  81   9.275  -3.473  16.213
  663   HD11  LEU  81          1HD1      LEU  81   8.513  -6.285  15.374
  664   HD12  LEU  81          2HD1      LEU  81   8.904  -4.937  14.301
  665   HD13  LEU  81          3HD1      LEU  81   7.475  -4.857  15.324
  666   HD21  LEU  81          3HD2      LEU  81   7.678  -4.480  17.768
  667   HD22  LEU  81          1HD2      LEU  81   9.255  -4.257  18.520
  668   HD23  LEU  81          2HD2      LEU  81   8.747  -5.867  17.999
  669    H    GLU  82           H        GLU  82  14.077  -3.225  17.606
  670    HA   GLU  82           HA       GLU  82  15.620  -5.288  16.231
  671    HB2  GLU  82           2HB      GLU  82  16.696  -2.656  17.352
  672    HB3  GLU  82           3HB      GLU  82  17.390  -3.647  16.076
  673    HG2  GLU  82           2HG      GLU  82  14.887  -1.945  15.914
  674    HG3  GLU  82           3HG      GLU  82  16.422  -1.657  15.103
  675    H    HIS  83           H        HIS  83  15.038  -6.724  18.075
  676    HA   HIS  83           HA       HIS  83  15.364  -7.833  20.032
  677    HB2  HIS  83           2HB      HIS  83  17.598  -8.883  20.167
  678    HB3  HIS  83           3HB      HIS  83  17.024  -8.803  18.506
  679    HD1  HIS  83           HD1      HIS  83  19.767  -7.696  20.733
  680    HD2  HIS  83           HD2      HIS  83  18.522  -6.987  16.832
  681    HE1  HIS  83           HE1      HIS  83  21.683  -6.543  19.603
  682    HE2  HIS  83           HE2      HIS  83  20.906  -6.114  17.255
  683    H    HIS  84           H        HIS  84  14.797  -5.451  20.923
  684    HA   HIS  84           HA       HIS  84  16.799  -4.053  22.360
  685    HB2  HIS  84           2HB      HIS  84  14.964  -2.730  23.377
  686    HB3  HIS  84           3HB      HIS  84  14.777  -2.881  21.636
  687    HD1  HIS  84           HD1      HIS  84  13.158  -3.790  24.877
  688    HD2  HIS  84           HD2      HIS  84  12.472  -4.341  20.824
  689    HE1  HIS  84           HE1      HIS  84  10.813  -4.659  24.698
  690    HE2  HIS  84           HE2      HIS  84  10.449  -5.037  22.251
  691    H    HIS  85           H        HIS  85  17.932  -5.311  23.678
  692    HA   HIS  85           HA       HIS  85  17.063  -5.927  26.315
  693    HB2  HIS  85           2HB      HIS  85  16.051  -7.880  25.064
  694    HB3  HIS  85           3HB      HIS  85  17.652  -8.329  24.503
  695    HD1  HIS  85           HD1      HIS  85  17.994 -10.517  25.672
  696    HD2  HIS  85           HD2      HIS  85  16.626  -7.585  28.274
  697    HE1  HIS  85           HE1      HIS  85  18.020 -11.569  27.948
  698    HE2  HIS  85           HE2      HIS  85  17.463  -9.694  29.511
  699    H    HIS  86           H        HIS  86  18.860  -4.318  26.207
  700    HA   HIS  86           HA       HIS  86  21.509  -5.221  25.395
  701    HB2  HIS  86           2HB      HIS  86  22.237  -2.901  25.985
  702    HB3  HIS  86           3HB      HIS  86  20.902  -2.936  24.848
  703    HD1  HIS  86           HD1      HIS  86  18.757  -1.740  25.512
  704    HD2  HIS  86           HD2      HIS  86  21.510  -1.921  28.624
  705    HE1  HIS  86           HE1      HIS  86  17.890  -0.182  27.279
  706    HE2  HIS  86           HE2      HIS  86  19.488  -0.432  29.195
  707    H    HIS  87           H        HIS  87  20.102  -6.431  27.748
  708    HA   HIS  87           HA       HIS  87  22.596  -6.836  29.203
  709    HB2  HIS  87           2HB      HIS  87  21.625  -6.742  31.398
  710    HB3  HIS  87           3HB      HIS  87  21.053  -5.282  30.600
  711    HD1  HIS  87           HD1      HIS  87  19.885  -8.186  32.461
  712    HD2  HIS  87           HD2      HIS  87  18.214  -5.548  29.719
  713    HE1  HIS  87           HE1      HIS  87  17.406  -8.436  32.703
  714    HE2  HIS  87           HE2      HIS  87  16.426  -6.691  31.195
  715    H    HIS  88           H        HIS  88  22.634  -9.055  30.139
  716    HA   HIS  88           HA       HIS  88  20.977 -10.926  28.594
  717    HB2  HIS  88           2HB      HIS  88  23.290 -11.450  30.520
  718    HB3  HIS  88           3HB      HIS  88  22.466 -12.688  29.580
  719    HD1  HIS  88           HD1      HIS  88  23.456 -13.199  27.353
  720    HD2  HIS  88           HD2      HIS  88  24.671  -9.482  28.767
  721    HE1  HIS  88           HE1      HIS  88  25.185 -12.384  25.725
  722    HE2  HIS  88           HE2      HIS  88  25.783 -10.075  26.517
  Start of MODEL   19
    1    H1   MET   1           1H       MET   1  12.090  11.093   9.471
    2    H2   MET   1           2H       MET   1  12.915  10.330  10.730
    3    H3   MET   1           3H       MET   1  12.275  11.883  10.955
    4    HA   MET   1           HA       MET   1  10.899  10.274  12.046
    5    HB2  MET   1           2HB      MET   1   9.860  12.280  10.968
    6    HB3  MET   1           3HB      MET   1   9.581  11.345   9.507
    7    HG2  MET   1           2HG      MET   1   8.026   9.889  10.709
    8    HG3  MET   1           3HG      MET   1   8.365  10.742  12.219
    9    HE1  MET   1           3HE      MET   1   4.762  11.991  11.594
   10    HE2  MET   1           1HE      MET   1   5.900  11.319  12.758
   11    HE3  MET   1           2HE      MET   1   5.394  10.363  11.361
   12    H    GLY   2           H        GLY   2   9.596   8.371  11.939
   13    HA2  GLY   2           2HA      GLY   2  10.695   6.205  10.514
   14    HA3  GLY   2           3HA      GLY   2   9.212   6.183  11.449
   15    H    GLU   3           H        GLU   3   9.730   4.778   9.033
   16    HA   GLU   3           HA       GLU   3   7.739   5.929   7.169
   17    HB2  GLU   3           2HB      GLU   3   9.098   5.430   5.257
   18    HB3  GLU   3           3HB      GLU   3  10.121   6.322   6.365
   19    HG2  GLU   3           2HG      GLU   3  10.190   3.314   5.935
   20    HG3  GLU   3           3HG      GLU   3  11.316   4.472   5.235
   21    H    MET   4           H        MET   4   6.672   4.369   5.883
   22    HA   MET   4           HA       MET   4   6.888   1.555   6.740
   23    HB2  MET   4           2HB      MET   4   4.772   2.553   7.532
   24    HB3  MET   4           3HB      MET   4   4.383   3.075   5.893
   25    HG2  MET   4           2HG      MET   4   4.159   0.784   5.151
   26    HG3  MET   4           3HG      MET   4   4.780   0.183   6.692
   27    HE1  MET   4           3HE      MET   4   1.165  -1.011   7.065
   28    HE2  MET   4           1HE      MET   4   2.870  -1.414   7.246
   29    HE3  MET   4           2HE      MET   4   2.198  -1.101   5.643
   30    H    ASP   5           H        ASP   5   7.045   0.032   5.107
   31    HA   ASP   5           HA       ASP   5   6.976   0.939   2.309
   32    HB2  ASP   5           2HB      ASP   5   9.212   0.228   2.728
   33    HB3  ASP   5           3HB      ASP   5   8.703  -1.033   3.838
   34    H    ILE   6           H        ILE   6   5.130   0.223   1.386
   35    HA   ILE   6           HA       ILE   6   3.914  -2.331   2.290
   36    HB   ILE   6           HB       ILE   6   2.499  -0.024   0.860
   37   HG12  ILE   6          2HG1      ILE   6   2.396  -0.716   3.835
   38   HG13  ILE   6          3HG1      ILE   6   3.234   0.671   3.149
   39   HG21  ILE   6          1HG2      ILE   6   1.388  -2.507   2.218
   40   HG22  ILE   6          2HG2      ILE   6   1.474  -2.227   0.478
   41   HG23  ILE   6          3HG2      ILE   6   0.423  -1.225   1.479
   42   HD11  ILE   6          3HD1      ILE   6   0.253   0.199   3.126
   43   HD12  ILE   6          1HD1      ILE   6   1.082   1.565   2.373
   44   HD13  ILE   6          2HD1      ILE   6   1.147   1.348   4.119
   45    H    ARG   7           H        ARG   7   4.650  -3.819   0.850
   46    HA   ARG   7           HA       ARG   7   4.869  -3.090  -2.007
   47    HB2  ARG   7           2HB      ARG   7   7.025  -3.663  -0.789
   48    HB3  ARG   7           3HB      ARG   7   6.397  -5.289  -0.537
   49    HG2  ARG   7           2HG      ARG   7   6.415  -5.741  -2.923
   50    HG3  ARG   7           3HG      ARG   7   6.787  -4.055  -3.288
   51    HD2  ARG   7           2HD      ARG   7   8.990  -4.333  -2.117
   52    HD3  ARG   7           3HD      ARG   7   8.611  -6.045  -1.890
   53    HE   ARG   7           HE       ARG   7   8.353  -5.483  -4.614
   54   HH11  ARG   7          1HH1      ARG   7  10.943  -5.552  -2.263
   55   HH12  ARG   7          2HH1      ARG   7  12.157  -5.956  -3.423
   56   HH21  ARG   7          1HH2      ARG   7   9.945  -6.038  -6.124
   57   HH22  ARG   7          2HH2      ARG   7  11.592  -6.232  -5.619
   58    H    PHE   8           H        PHE   8   3.451  -4.021  -3.295
   59    HA   PHE   8           HA       PHE   8   1.888  -6.376  -2.428
   60    HB2  PHE   8           2HB      PHE   8   1.288  -4.198  -4.487
   61    HB3  PHE   8           3HB      PHE   8   0.337  -5.669  -4.356
   62    HD1  PHE   8           HD2      PHE   8  -1.161  -6.040  -2.426
   63    HD2  PHE   8           HD1      PHE   8   1.046  -2.392  -2.842
   64    HE1  PHE   8           HE2      PHE   8  -2.634  -4.958  -0.783
   65    HE2  PHE   8           HE1      PHE   8  -0.438  -1.322  -1.207
   66    HZ   PHE   8           HZ       PHE   8  -2.275  -2.596  -0.171
   67    H    ARG   9           H        ARG   9   1.626  -8.058  -3.980
   68    HA   ARG   9           HA       ARG   9   3.109  -8.016  -6.464
   69    HB2  ARG   9           2HB      ARG   9   4.726  -8.806  -4.591
   70    HB3  ARG   9           3HB      ARG   9   3.727 -10.245  -4.455
   71    HG2  ARG   9           2HG      ARG   9   5.044  -9.418  -7.065
   72    HG3  ARG   9           3HG      ARG   9   5.872 -10.416  -5.872
   73    HD2  ARG   9           2HD      ARG   9   4.319 -12.209  -6.150
   74    HD3  ARG   9           3HD      ARG   9   3.183 -11.200  -7.045
   75    HE   ARG   9           HE       ARG   9   5.606 -11.298  -8.464
   76   HH11  ARG   9          1HH1      ARG   9   2.947 -13.444  -7.591
   77   HH12  ARG   9          2HH1      ARG   9   3.142 -14.446  -8.993
   78   HH21  ARG   9          1HH2      ARG   9   5.824 -12.636 -10.309
   79   HH22  ARG   9          2HH2      ARG   9   4.758 -13.989 -10.523
   80    H    GLY  10           H        GLY  10   1.825  -8.904  -7.922
   81    HA2  GLY  10           2HA      GLY  10   0.255 -11.289  -7.447
   82    HA3  GLY  10           3HA      GLY  10  -0.711  -9.828  -7.676
   83    H    ASP  11           H        ASP  11  -0.689 -12.116  -9.401
   84    HA   ASP  11           HA       ASP  11   1.058 -11.835 -11.639
   85    HB2  ASP  11           2HB      ASP  11   0.021 -13.979 -10.978
   86    HB3  ASP  11           3HB      ASP  11  -1.571 -13.342 -11.358
   87    H    ASP  12           H        ASP  12  -1.677 -10.043 -10.761
   88    HA   ASP  12           HA       ASP  12  -2.035  -9.003 -13.504
   89    HB2  ASP  12           2HB      ASP  12  -4.100  -9.994 -12.676
   90    HB3  ASP  12           3HB      ASP  12  -4.005  -9.054 -11.191
   91    H    LEU  13           H        LEU  13  -1.145  -7.107 -13.818
   92    HA   LEU  13           HA       LEU  13  -0.082  -5.369 -11.861
   93    HB2  LEU  13           2HB      LEU  13   0.784  -5.721 -14.167
   94    HB3  LEU  13           3HB      LEU  13  -0.612  -4.893 -14.814
   95    HG   LEU  13           HG       LEU  13   1.290  -3.401 -12.962
   96   HD11  LEU  13          1HD1      LEU  13   2.593  -2.664 -14.921
   97   HD12  LEU  13          2HD1      LEU  13   1.688  -3.781 -15.946
   98   HD13  LEU  13          3HD1      LEU  13   2.735  -4.403 -14.667
   99   HD21  LEU  13          3HD2      LEU  13  -0.467  -2.485 -15.271
  100   HD22  LEU  13          1HD2      LEU  13   0.572  -1.436 -14.298
  101   HD23  LEU  13          2HD2      LEU  13  -0.800  -2.251 -13.555
  102    H    GLU  14           H        GLU  14  -3.248  -5.505 -13.411
  103    HA   GLU  14           HA       GLU  14  -4.014  -2.779 -13.050
  104    HB2  GLU  14           2HB      GLU  14  -5.893  -5.172 -13.138
  105    HB3  GLU  14           3HB      GLU  14  -6.327  -3.489 -13.419
  106    HG2  GLU  14           2HG      GLU  14  -4.639  -5.271 -15.187
  107    HG3  GLU  14           3HG      GLU  14  -6.267  -4.686 -15.505
  108    H    ALA  15           H        ALA  15  -4.544  -5.721 -11.127
  109    HA   ALA  15           HA       ALA  15  -6.136  -4.631  -9.073
  110    HB1  ALA  15           3HB      ALA  15  -5.550  -6.714  -7.870
  111    HB2  ALA  15           1HB      ALA  15  -4.309  -7.055  -9.077
  112    HB3  ALA  15           2HB      ALA  15  -6.013  -7.023  -9.544
  113    H    LEU  16           H        LEU  16  -2.637  -4.835  -9.538
  114    HA   LEU  16           HA       LEU  16  -1.764  -4.012  -6.982
  115    HB2  LEU  16           2HB      LEU  16  -0.440  -3.559  -9.686
  116    HB3  LEU  16           3HB      LEU  16   0.354  -3.361  -8.133
  117    HG   LEU  16           HG       LEU  16  -0.639  -5.980  -9.328
  118   HD11  LEU  16          1HD1      LEU  16   1.722  -6.593  -9.441
  119   HD12  LEU  16          2HD1      LEU  16   2.180  -5.006  -8.815
  120   HD13  LEU  16          3HD1      LEU  16   1.393  -5.143 -10.391
  121   HD21  LEU  16          3HD2      LEU  16   0.745  -5.526  -6.663
  122   HD22  LEU  16          1HD2      LEU  16   0.383  -7.098  -7.387
  123   HD23  LEU  16          2HD2      LEU  16  -0.930  -6.033  -6.895
  124    H    GLU  17           H        GLU  17  -2.604  -2.181  -9.940
  125    HA   GLU  17           HA       GLU  17  -1.883   0.395  -8.952
  126    HB2  GLU  17           2HB      GLU  17  -3.698  -0.394 -11.257
  127    HB3  GLU  17           3HB      GLU  17  -3.204   1.263 -10.911
  128    HG2  GLU  17           2HG      GLU  17  -0.821   0.590 -11.235
  129    HG3  GLU  17           3HG      GLU  17  -1.366  -1.028 -11.686
  130    H    LYS  18           H        LYS  18  -4.940  -1.417  -8.888
  131    HA   LYS  18           HA       LYS  18  -6.559   0.756  -7.983
  132    HB2  LYS  18           2HB      LYS  18  -6.943  -2.234  -8.084
  133    HB3  LYS  18           3HB      LYS  18  -8.024  -1.289  -7.073
  134    HG2  LYS  18           2HG      LYS  18  -9.161  -1.527  -9.108
  135    HG3  LYS  18           3HG      LYS  18  -8.541   0.121  -9.122
  136    HD2  LYS  18           2HD      LYS  18  -6.677  -0.624 -10.614
  137    HD3  LYS  18           3HD      LYS  18  -7.339  -2.259 -10.586
  138    HE2  LYS  18           2HE      LYS  18  -8.722   0.204 -11.698
  139    HE3  LYS  18           3HE      LYS  18  -7.984  -1.094 -12.640
  140    HZ1  LYS  18           3HZ      LYS  18  -9.595  -2.635 -11.703
  141    HZ2  LYS  18           1HZ      LYS  18 -10.371  -1.365 -12.505
  142    HZ3  LYS  18           2HZ      LYS  18 -10.314  -1.390 -10.814
  143    H    ALA  19           H        ALA  19  -4.865  -1.895  -6.295
  144    HA   ALA  19           HA       ALA  19  -5.408  -1.153  -3.641
  145    HB1  ALA  19           3HB      ALA  19  -4.388  -3.307  -4.252
  146    HB2  ALA  19           1HB      ALA  19  -3.407  -2.456  -3.051
  147    HB3  ALA  19           2HB      ALA  19  -2.911  -2.478  -4.746
  148    H    LEU  20           H        LEU  20  -2.803  -0.189  -5.829
  149    HA   LEU  20           HA       LEU  20  -1.257   1.499  -4.286
  150    HB2  LEU  20           2HB      LEU  20  -0.618   0.807  -6.532
  151    HB3  LEU  20           3HB      LEU  20  -1.991   1.640  -7.225
  152    HG   LEU  20           HG       LEU  20  -0.986   3.834  -6.627
  153   HD11  LEU  20          1HD1      LEU  20   1.318   3.986  -5.831
  154   HD12  LEU  20          2HD1      LEU  20   1.385   2.230  -5.646
  155   HD13  LEU  20          3HD1      LEU  20   0.280   3.187  -4.653
  156   HD21  LEU  20          3HD2      LEU  20   0.873   2.059  -8.234
  157   HD22  LEU  20          1HD2      LEU  20   0.825   3.825  -8.273
  158   HD23  LEU  20          2HD2      LEU  20  -0.557   2.895  -8.846
  159    H    LYS  21           H        LYS  21  -4.142   2.345  -6.229
  160    HA   LYS  21           HA       LYS  21  -4.112   5.126  -5.806
  161    HB2  LYS  21           2HB      LYS  21  -5.316   4.060  -7.639
  162    HB3  LYS  21           3HB      LYS  21  -6.375   3.224  -6.522
  163    HG2  LYS  21           2HG      LYS  21  -6.417   6.217  -6.381
  164    HG3  LYS  21           3HG      LYS  21  -7.056   5.504  -7.858
  165    HD2  LYS  21           2HD      LYS  21  -8.031   4.937  -5.022
  166    HD3  LYS  21           3HD      LYS  21  -8.859   5.918  -6.232
  167    HE2  LYS  21           2HE      LYS  21  -9.053   3.871  -7.675
  168    HE3  LYS  21           3HE      LYS  21  -8.348   2.925  -6.364
  169    HZ1  LYS  21           3HZ      LYS  21 -10.919   4.398  -6.339
  170    HZ2  LYS  21           1HZ      LYS  21 -10.227   3.697  -4.964
  171    HZ3  LYS  21           2HZ      LYS  21 -10.692   2.725  -6.264
  172    H    GLU  22           H        GLU  22  -5.644   2.499  -4.020
  173    HA   GLU  22           HA       GLU  22  -7.060   4.066  -2.127
  174    HB2  GLU  22           2HB      GLU  22  -5.970   1.241  -1.880
  175    HB3  GLU  22           3HB      GLU  22  -7.163   1.959  -0.803
  176    HG2  GLU  22           2HG      GLU  22  -7.602   1.555  -3.778
  177    HG3  GLU  22           3HG      GLU  22  -8.071   0.381  -2.553
  178    H    MET  23           H        MET  23  -3.830   2.513  -2.023
  179    HA   MET  23           HA       MET  23  -3.083   3.255   0.597
  180    HB2  MET  23           2HB      MET  23  -1.365   2.656  -1.838
  181    HB3  MET  23           3HB      MET  23  -0.739   2.773  -0.199
  182    HG2  MET  23           2HG      MET  23  -2.913   0.781  -0.743
  183    HG3  MET  23           3HG      MET  23  -1.294   0.434  -1.325
  184    HE1  MET  23           3HE      MET  23  -2.441   0.759   3.146
  185    HE2  MET  23           1HE      MET  23  -3.620   0.736   1.834
  186    HE3  MET  23           2HE      MET  23  -2.586   2.148   2.070
  187    H    ILE  24           H        ILE  24  -2.709   4.925  -2.497
  188    HA   ILE  24           HA       ILE  24  -1.051   7.057  -1.629
  189    HB   ILE  24           HB       ILE  24  -2.960   6.836  -4.000
  190   HG12  ILE  24          2HG1      ILE  24   0.089   6.733  -3.853
  191   HG13  ILE  24          3HG1      ILE  24  -0.978   5.367  -4.145
  192   HG21  ILE  24          1HG2      ILE  24  -2.794   9.215  -3.425
  193   HG22  ILE  24          2HG2      ILE  24  -1.944   8.891  -4.934
  194   HG23  ILE  24          3HG2      ILE  24  -1.032   9.116  -3.441
  195   HD11  ILE  24          3HD1      ILE  24  -1.661   6.372  -6.288
  196   HD12  ILE  24          1HD1      ILE  24   0.076   6.081  -6.197
  197   HD13  ILE  24          2HD1      ILE  24  -0.552   7.716  -6.001
  198    H    ARG  25           H        ARG  25  -4.598   6.688  -1.973
  199    HA   ARG  25           HA       ARG  25  -5.419   9.228  -1.131
  200    HB2  ARG  25           2HB      ARG  25  -6.962   7.623  -2.191
  201    HB3  ARG  25           3HB      ARG  25  -6.846   6.557  -0.792
  202    HG2  ARG  25           2HG      ARG  25  -7.913   8.307   0.620
  203    HG3  ARG  25           3HG      ARG  25  -8.033   9.360  -0.791
  204    HD2  ARG  25           2HD      ARG  25  -9.506   7.701  -1.886
  205    HD3  ARG  25           3HD      ARG  25  -9.403   6.675  -0.451
  206    HE   ARG  25           HE       ARG  25 -10.384   8.689   0.751
  207   HH11  ARG  25          1HH1      ARG  25 -11.178   7.957  -2.597
  208   HH12  ARG  25          2HH1      ARG  25 -12.735   8.722  -2.515
  209   HH21  ARG  25          1HH2      ARG  25 -12.428   9.658   0.855
  210   HH22  ARG  25          2HH2      ARG  25 -13.438   9.683  -0.555
  211    H    GLN  26           H        GLN  26  -4.747   6.273   0.741
  212    HA   GLN  26           HA       GLN  26  -5.480   7.236   3.285
  213    HB2  GLN  26           2HB      GLN  26  -3.425   5.102   2.581
  214    HB3  GLN  26           3HB      GLN  26  -4.076   5.387   4.192
  215    HG2  GLN  26           2HG      GLN  26  -5.624   4.422   1.770
  216    HG3  GLN  26           3HG      GLN  26  -5.153   3.459   3.167
  217   HE21  GLN  26          1HE2      GLN  26  -7.828   4.058   2.023
  218   HE22  GLN  26          2HE2      GLN  26  -8.746   4.710   3.331
  219    H    ALA  27           H        ALA  27  -2.300   7.110   1.666
  220    HA   ALA  27           HA       ALA  27  -0.718   8.275   3.661
  221    HB1  ALA  27           3HB      ALA  27   0.898   8.697   1.854
  222    HB2  ALA  27           1HB      ALA  27  -0.356   8.400   0.650
  223    HB3  ALA  27           2HB      ALA  27   0.185   7.090   1.705
  224    H    ARG  28           H        ARG  28  -2.718   9.782   1.155
  225    HA   ARG  28           HA       ARG  28  -1.693  12.449   1.531
  226    HB2  ARG  28           2HB      ARG  28  -4.116  11.447  -0.020
  227    HB3  ARG  28           3HB      ARG  28  -3.547  13.116  -0.032
  228    HG2  ARG  28           2HG      ARG  28  -1.374  12.343  -0.996
  229    HG3  ARG  28           3HG      ARG  28  -2.013  10.696  -1.057
  230    HD2  ARG  28           2HD      ARG  28  -3.139  13.101  -2.529
  231    HD3  ARG  28           3HD      ARG  28  -2.179  11.808  -3.250
  232    HE   ARG  28           HE       ARG  28  -4.143  10.336  -2.373
  233   HH11  ARG  28          1HH1      ARG  28  -4.475  13.556  -3.763
  234   HH12  ARG  28          2HH1      ARG  28  -6.068  13.263  -4.377
  235   HH21  ARG  28          1HH2      ARG  28  -6.237   9.964  -3.219
  236   HH22  ARG  28          2HH2      ARG  28  -7.061  11.230  -4.067
  237    H    LYS  29           H        LYS  29  -4.610  10.678   2.615
  238    HA   LYS  29           HA       LYS  29  -5.904  12.987   3.752
  239    HB2  LYS  29           2HB      LYS  29  -7.539  11.443   4.698
  240    HB3  LYS  29           3HB      LYS  29  -7.203  10.982   3.034
  241    HG2  LYS  29           2HG      LYS  29  -5.812   9.134   3.767
  242    HG3  LYS  29           3HG      LYS  29  -5.964   9.624   5.453
  243    HD2  LYS  29           2HD      LYS  29  -8.277   8.708   3.698
  244    HD3  LYS  29           3HD      LYS  29  -7.406   7.674   4.831
  245    HE2  LYS  29           2HE      LYS  29  -8.122   9.141   6.702
  246    HE3  LYS  29           3HE      LYS  29  -9.020  10.147   5.564
  247    HZ1  LYS  29           3HZ      LYS  29  -9.539   7.271   6.103
  248    HZ2  LYS  29           1HZ      LYS  29 -10.404   8.255   5.029
  249    HZ3  LYS  29           2HZ      LYS  29 -10.454   8.569   6.687
  250    H    PHE  30           H        PHE  30  -3.593  10.623   4.883
  251    HA   PHE  30           HA       PHE  30  -3.673  11.524   7.666
  252    HB2  PHE  30           2HB      PHE  30  -1.826   9.525   6.282
  253    HB3  PHE  30           3HB      PHE  30  -1.848   9.845   8.013
  254    HD1  PHE  30           HD1      PHE  30  -4.887   9.926   8.410
  255    HD2  PHE  30           HD2      PHE  30  -2.377   7.199   6.271
  256    HE1  PHE  30           HE1      PHE  30  -6.527   8.129   8.742
  257    HE2  PHE  30           HE2      PHE  30  -4.028   5.413   6.607
  258    HZ   PHE  30           HZ       PHE  30  -6.101   5.872   7.850
  259    H    ALA  31           H        ALA  31  -2.528  12.916   4.962
  260    HA   ALA  31           HA       ALA  31  -0.994  14.435   4.375
  261    HB1  ALA  31           3HB      ALA  31  -2.042  15.693   6.210
  262    HB2  ALA  31           1HB      ALA  31  -0.334  16.106   6.043
  263    HB3  ALA  31           2HB      ALA  31  -0.864  15.037   7.345
  264    H    GLY  32           H        GLY  32   0.227  12.508   3.802
  265    HA2  GLY  32           2HA      GLY  32   2.958  12.542   4.940
  266    HA3  GLY  32           3HA      GLY  32   2.107  11.010   4.737
  267    H    THR  33           H        THR  33   4.420  11.220   3.443
  268    HA   THR  33           HA       THR  33   3.984  12.181   0.698
  269    HB   THR  33           HB       THR  33   6.551  11.364   2.156
  270    HG1  THR  33           HG1      THR  33   5.209  13.788   1.732
  271   HG21  THR  33          3HG2      THR  33   6.743  10.993  -0.298
  272   HG22  THR  33          1HG2      THR  33   7.754  12.342   0.230
  273   HG23  THR  33          2HG2      THR  33   6.221  12.654  -0.583
  274    H    VAL  34           H        VAL  34   4.107  10.683  -1.019
  275    HA   VAL  34           HA       VAL  34   4.405   7.839  -0.418
  276    HB   VAL  34           HB       VAL  34   1.992   8.256  -0.229
  277   HG11  VAL  34          1HG1      VAL  34   2.066   9.403  -3.041
  278   HG12  VAL  34          2HG1      VAL  34   1.771  10.307  -1.555
  279   HG13  VAL  34          3HG1      VAL  34   0.607   9.093  -2.092
  280   HG21  VAL  34          3HG2      VAL  34   2.669   6.106  -1.197
  281   HG22  VAL  34          1HG2      VAL  34   2.625   6.800  -2.820
  282   HG23  VAL  34          2HG2      VAL  34   1.134   6.639  -1.887
  283    H    THR  35           H        THR  35   5.504   6.824  -1.934
  284    HA   THR  35           HA       THR  35   5.694   7.796  -4.710
  285    HB   THR  35           HB       THR  35   8.078   6.902  -2.998
  286    HG1  THR  35           HG1      THR  35   7.056   9.425  -3.724
  287   HG21  THR  35          3HG2      THR  35   8.043   7.963  -5.852
  288   HG22  THR  35          1HG2      THR  35   8.398   6.297  -5.379
  289   HG23  THR  35          2HG2      THR  35   9.488   7.602  -4.909
  290    H    TYR  36           H        TYR  36   6.275   5.924  -6.184
  291    HA   TYR  36           HA       TYR  36   5.922   3.247  -5.062
  292    HB2  TYR  36           2HB      TYR  36   3.947   2.737  -6.494
  293    HB3  TYR  36           3HB      TYR  36   3.604   3.966  -5.288
  294    HD1  TYR  36           HD2      TYR  36   3.219   6.339  -5.967
  295    HD2  TYR  36           HD1      TYR  36   3.900   3.287  -8.902
  296    HE1  TYR  36           HE2      TYR  36   2.391   7.842  -7.726
  297    HE2  TYR  36           HE1      TYR  36   3.075   4.796 -10.655
  298    HH   TYR  36           HH       TYR  36   2.657   8.123 -10.179
  299    H    THR  37           H        THR  37   6.494   1.598  -6.438
  300    HA   THR  37           HA       THR  37   7.620   2.289  -9.092
  301    HB   THR  37           HB       THR  37   8.666   0.157  -7.167
  302    HG1  THR  37           HG1      THR  37  10.371   1.580  -6.784
  303   HG21  THR  37          3HG2      THR  37   9.105  -0.384  -9.548
  304   HG22  THR  37          1HG2      THR  37  10.602   0.019  -8.702
  305   HG23  THR  37          2HG2      THR  37   9.847   1.201  -9.773
  306    H    LEU  38           H        LEU  38   6.111   1.490 -10.516
  307    HA   LEU  38           HA       LEU  38   4.866  -1.142 -10.129
  308    HB2  LEU  38           2HB      LEU  38   4.592   0.978 -12.296
  309    HB3  LEU  38           3HB      LEU  38   3.799  -0.587 -12.395
  310    HG   LEU  38           HG       LEU  38   3.299   1.439 -10.170
  311   HD11  LEU  38          1HD1      LEU  38   1.603   0.835 -12.602
  312   HD12  LEU  38          2HD1      LEU  38   2.499   2.325 -12.290
  313   HD13  LEU  38          3HD1      LEU  38   1.150   1.878 -11.249
  314   HD21  LEU  38          3HD2      LEU  38   1.835  -1.132 -10.867
  315   HD22  LEU  38          1HD2      LEU  38   1.373   0.024  -9.610
  316   HD23  LEU  38          2HD2      LEU  38   2.881  -0.872  -9.465
  317    H    ASP  39           H        ASP  39   6.039  -2.854 -10.673
  318    HA   ASP  39           HA       ASP  39   7.689  -2.887 -13.120
  319    HB2  ASP  39           2HB      ASP  39   9.225  -2.514 -11.194
  320    HB3  ASP  39           3HB      ASP  39   8.560  -3.924 -10.376
  321    H    GLY  40           H        GLY  40   6.024  -3.989 -14.103
  322    HA2  GLY  40           2HA      GLY  40   4.868  -5.769 -14.901
  323    HA3  GLY  40           3HA      GLY  40   6.097  -6.767 -14.151
  324    H    ASN  41           H        ASN  41   5.555  -7.962 -12.398
  325    HA   ASN  41           HA       ASN  41   2.751  -7.912 -11.452
  326    HB2  ASN  41           2HB      ASN  41   4.839 -10.131 -11.570
  327    HB3  ASN  41           3HB      ASN  41   3.311 -10.313 -10.713
  328   HD21  ASN  41          1HD2      ASN  41   1.733  -8.810 -12.670
  329   HD22  ASN  41          2HD2      ASN  41   1.595  -9.839 -14.043
  330    H    ASP  42           H        ASP  42   4.983  -6.193 -10.475
  331    HA   ASP  42           HA       ASP  42   4.689  -6.747  -7.600
  332    HB2  ASP  42           2HB      ASP  42   6.815  -7.827  -8.173
  333    HB3  ASP  42           3HB      ASP  42   7.371  -6.377  -9.006
  334    H    LEU  43           H        LEU  43   4.567  -4.942  -6.404
  335    HA   LEU  43           HA       LEU  43   5.121  -2.272  -7.522
  336    HB2  LEU  43           2HB      LEU  43   2.760  -2.508  -7.805
  337    HB3  LEU  43           3HB      LEU  43   2.572  -3.328  -6.265
  338    HG   LEU  43           HG       LEU  43   2.986  -1.185  -5.059
  339   HD11  LEU  43          1HD1      LEU  43   4.408  -0.013  -6.649
  340   HD12  LEU  43          2HD1      LEU  43   3.007   0.965  -6.223
  341   HD13  LEU  43          3HD1      LEU  43   3.063   0.136  -7.779
  342   HD21  LEU  43          3HD2      LEU  43   0.771  -1.025  -7.106
  343   HD22  LEU  43          1HD2      LEU  43   0.855  -0.129  -5.586
  344   HD23  LEU  43          2HD2      LEU  43   0.713  -1.884  -5.564
  345    H    GLU  44           H        GLU  44   6.533  -1.273  -6.170
  346    HA   GLU  44           HA       GLU  44   6.458  -1.844  -3.258
  347    HB2  GLU  44           2HB      GLU  44   8.642  -2.248  -4.319
  348    HB3  GLU  44           3HB      GLU  44   8.660  -0.606  -4.958
  349    HG2  GLU  44           2HG      GLU  44   8.660   0.260  -2.593
  350    HG3  GLU  44           3HG      GLU  44   8.772  -1.405  -2.026
  351    H    ILE  45           H        ILE  45   5.096  -0.430  -2.296
  352    HA   ILE  45           HA       ILE  45   5.043   2.430  -3.041
  353    HB   ILE  45           HB       ILE  45   3.285   0.974  -1.011
  354   HG12  ILE  45          2HG1      ILE  45   2.608   1.649  -3.908
  355   HG13  ILE  45          3HG1      ILE  45   3.004   0.040  -3.317
  356   HG21  ILE  45          1HG2      ILE  45   1.781   2.931  -1.219
  357   HG22  ILE  45          2HG2      ILE  45   2.922   3.689  -2.331
  358   HG23  ILE  45          3HG2      ILE  45   3.383   3.410  -0.651
  359   HD11  ILE  45          3HD1      ILE  45   0.626   0.293  -3.606
  360   HD12  ILE  45          1HD1      ILE  45   0.599   1.679  -2.516
  361   HD13  ILE  45          2HD1      ILE  45   1.006   0.074  -1.899
  362    H    ARG  46           H        ARG  46   6.198   3.835  -1.854
  363    HA   ARG  46           HA       ARG  46   7.275   3.092   0.796
  364    HB2  ARG  46           2HB      ARG  46   8.518   4.938  -1.302
  365    HB3  ARG  46           3HB      ARG  46   9.269   4.396   0.201
  366    HG2  ARG  46           2HG      ARG  46   9.406   2.112  -0.616
  367    HG3  ARG  46           3HG      ARG  46   8.453   2.515  -2.043
  368    HD2  ARG  46           2HD      ARG  46  10.670   2.390  -2.811
  369    HD3  ARG  46           3HD      ARG  46  10.338   4.113  -2.670
  370    HE   ARG  46           HE       ARG  46  11.570   3.996  -0.493
  371   HH11  ARG  46          1HH1      ARG  46  12.256   1.642  -3.026
  372   HH12  ARG  46          2HH1      ARG  46  13.879   1.360  -2.491
  373   HH21  ARG  46          1HH2      ARG  46  13.723   3.612   0.187
  374   HH22  ARG  46          2HH2      ARG  46  14.709   2.474  -0.674
  375    H    ILE  47           H        ILE  47   6.016   4.128   2.233
  376    HA   ILE  47           HA       ILE  47   5.109   6.921   1.762
  377    HB   ILE  47           HB       ILE  47   3.888   4.818   3.624
  378   HG12  ILE  47          2HG1      ILE  47   2.807   5.893   0.976
  379   HG13  ILE  47          3HG1      ILE  47   3.503   4.296   1.211
  380   HG21  ILE  47          1HG2      ILE  47   2.040   6.435   3.956
  381   HG22  ILE  47          2HG2      ILE  47   2.888   7.614   2.953
  382   HG23  ILE  47          3HG2      ILE  47   3.582   7.106   4.494
  383   HD11  ILE  47          3HD1      ILE  47   0.944   5.320   2.455
  384   HD12  ILE  47          1HD1      ILE  47   1.660   3.728   2.737
  385   HD13  ILE  47          2HD1      ILE  47   1.098   4.170   1.126
  386    H    THR  48           H        THR  48   6.117   8.418   3.011
  387    HA   THR  48           HA       THR  48   7.176   7.668   5.692
  388    HB   THR  48           HB       THR  48   8.521   9.694   3.842
  389    HG1  THR  48           HG1      THR  48   8.673   6.933   3.815
  390   HG21  THR  48          3HG2      THR  48   9.071   9.913   6.263
  391   HG22  THR  48          1HG2      THR  48  10.477   9.408   5.319
  392   HG23  THR  48          2HG2      THR  48   9.591   8.228   6.285
  393    H    GLY  49           H        GLY  49   7.184   9.480   7.236
  394    HA2  GLY  49           2HA      GLY  49   6.556  11.578   8.061
  395    HA3  GLY  49           3HA      GLY  49   5.765  11.947   6.537
  396    H    VAL  50           H        VAL  50   4.803   8.910   7.526
  397    HA   VAL  50           HA       VAL  50   2.489   9.882   9.080
  398    HB   VAL  50           HB       VAL  50   1.535   7.555   8.701
  399   HG11  VAL  50          1HG1      VAL  50   0.811   9.434   7.292
  400   HG12  VAL  50          2HG1      VAL  50   0.855   7.939   6.354
  401   HG13  VAL  50          3HG1      VAL  50   2.144   9.131   6.173
  402   HG21  VAL  50          3HG2      VAL  50   3.838   7.220   6.730
  403   HG22  VAL  50          1HG2      VAL  50   2.476   6.112   6.926
  404   HG23  VAL  50          2HG2      VAL  50   3.639   6.322   8.235
  405    HA   PRO  51           HA       PRO  51   4.802   8.411  12.667
  406    HB2  PRO  51           2HB      PRO  51   2.867   8.671  14.609
  407    HB3  PRO  51           3HB      PRO  51   3.685  10.070  13.883
  408    HG2  PRO  51           2HG      PRO  51   0.979   8.937  13.247
  409    HG3  PRO  51           3HG      PRO  51   1.470  10.639  13.422
  410    HD2  PRO  51           2HD      PRO  51   1.174   9.422  10.980
  411    HD3  PRO  51           3HD      PRO  51   2.319  10.753  11.251
  412    H    GLU  52           H        GLU  52   4.644   6.685  14.386
  413    HA   GLU  52           HA       GLU  52   4.359   4.235  13.085
  414    HB2  GLU  52           2HB      GLU  52   5.969   4.599  14.871
  415    HB3  GLU  52           3HB      GLU  52   4.676   4.799  16.050
  416    HG2  GLU  52           2HG      GLU  52   4.062   2.470  15.905
  417    HG3  GLU  52           3HG      GLU  52   5.105   2.215  14.505
  418    H    GLN  53           H        GLN  53   2.197   5.771  15.414
  419    HA   GLN  53           HA       GLN  53   0.312   3.766  15.819
  420    HB2  GLN  53           2HB      GLN  53  -1.275   5.662  16.309
  421    HB3  GLN  53           3HB      GLN  53   0.261   5.766  17.159
  422    HG2  GLN  53           2HG      GLN  53   1.052   7.526  15.731
  423    HG3  GLN  53           3HG      GLN  53  -0.269   7.302  14.590
  424   HE21  GLN  53          1HE2      GLN  53  -2.334   8.088  15.134
  425   HE22  GLN  53          2HE2      GLN  53  -2.564   9.256  16.380
  426    H    VAL  54           H        VAL  54   0.557   6.116  13.187
  427    HA   VAL  54           HA       VAL  54  -1.887   5.328  11.873
  428    HB   VAL  54           HB       VAL  54   0.343   7.264  11.119
  429   HG11  VAL  54          1HG1      VAL  54  -1.140   8.122   9.336
  430   HG12  VAL  54          2HG1      VAL  54  -2.281   6.816   9.665
  431   HG13  VAL  54          3HG1      VAL  54  -0.672   6.447   9.042
  432   HG21  VAL  54          3HG2      VAL  54  -2.495   7.776  12.087
  433   HG22  VAL  54          1HG2      VAL  54  -1.338   9.023  11.608
  434   HG23  VAL  54          2HG2      VAL  54  -1.018   8.020  13.025
  435    H    ARG  55           H        ARG  55   1.585   4.608  11.549
  436    HA   ARG  55           HA       ARG  55   1.568   3.396   8.996
  437    HB2  ARG  55           2HB      ARG  55   3.332   2.718  11.383
  438    HB3  ARG  55           3HB      ARG  55   3.616   2.191   9.727
  439    HG2  ARG  55           2HG      ARG  55   3.831   4.630   9.088
  440    HG3  ARG  55           3HG      ARG  55   3.787   5.014  10.813
  441    HD2  ARG  55           2HD      ARG  55   5.858   3.344   9.346
  442    HD3  ARG  55           3HD      ARG  55   6.106   4.913  10.117
  443    HE   ARG  55           HE       ARG  55   5.254   3.277  12.148
  444   HH11  ARG  55          1HH1      ARG  55   7.922   3.133   9.893
  445   HH12  ARG  55          2HH1      ARG  55   8.956   2.264  10.967
  446   HH21  ARG  55          1HH2      ARG  55   6.616   2.119  13.569
  447   HH22  ARG  55          2HH2      ARG  55   8.210   1.686  13.061
  448    H    LYS  56           H        LYS  56   0.841   2.145  12.229
  449    HA   LYS  56           HA       LYS  56   0.421  -0.565  11.593
  450    HB2  LYS  56           2HB      LYS  56  -0.854   1.155  13.748
  451    HB3  LYS  56           3HB      LYS  56  -0.985  -0.604  13.678
  452    HG2  LYS  56           2HG      LYS  56   1.469  -0.796  13.920
  453    HG3  LYS  56           3HG      LYS  56   1.597   0.966  13.989
  454    HD2  LYS  56           2HD      LYS  56   0.193   0.960  16.058
  455    HD3  LYS  56           3HD      LYS  56   0.134  -0.805  15.994
  456    HE2  LYS  56           2HE      LYS  56   2.573  -0.905  16.294
  457    HE3  LYS  56           3HE      LYS  56   2.657   0.858  16.306
  458    HZ1  LYS  56           3HZ      LYS  56   1.303  -0.869  18.306
  459    HZ2  LYS  56           1HZ      LYS  56   1.223   0.820  18.289
  460    HZ3  LYS  56           2HZ      LYS  56   2.705   0.049  18.534
  461    H    GLU  57           H        GLU  57  -1.739   2.260  11.355
  462    HA   GLU  57           HA       GLU  57  -4.131   0.867  10.684
  463    HB2  GLU  57           2HB      GLU  57  -3.328   3.716   9.952
  464    HB3  GLU  57           3HB      GLU  57  -4.961   3.056   9.869
  465    HG2  GLU  57           2HG      GLU  57  -4.897   2.701  12.341
  466    HG3  GLU  57           3HG      GLU  57  -3.313   3.476  12.389
  467    H    LEU  58           H        LEU  58  -1.528   2.315   8.710
  468    HA   LEU  58           HA       LEU  58  -2.528   1.751   6.146
  469    HB2  LEU  58           2HB      LEU  58   0.238   2.225   7.241
  470    HB3  LEU  58           3HB      LEU  58   0.101   1.614   5.610
  471    HG   LEU  58           HG       LEU  58   0.429   3.972   5.484
  472   HD11  LEU  58          1HD1      LEU  58  -1.514   4.737   4.237
  473   HD12  LEU  58          2HD1      LEU  58  -2.476   3.398   4.870
  474   HD13  LEU  58          3HD1      LEU  58  -1.089   3.077   3.824
  475   HD21  LEU  58          3HD2      LEU  58  -1.943   4.364   7.320
  476   HD22  LEU  58          1HD2      LEU  58  -1.034   5.644   6.507
  477   HD23  LEU  58          2HD2      LEU  58  -0.246   4.636   7.717
  478    H    ALA  59           H        ALA  59  -0.924  -0.331   8.504
  479    HA   ALA  59           HA       ALA  59  -0.378  -2.541   6.840
  480    HB1  ALA  59           3HB      ALA  59   0.600  -2.234   9.073
  481    HB2  ALA  59           1HB      ALA  59  -0.193  -3.806   8.923
  482    HB3  ALA  59           2HB      ALA  59  -0.982  -2.497   9.806
  483    H    LYS  60           H        LYS  60  -3.261  -1.739   8.830
  484    HA   LYS  60           HA       LYS  60  -4.710  -4.119   8.125
  485    HB2  LYS  60           2HB      LYS  60  -5.587  -1.508   9.404
  486    HB3  LYS  60           3HB      LYS  60  -6.756  -2.748   8.980
  487    HG2  LYS  60           2HG      LYS  60  -6.299  -3.013  11.298
  488    HG3  LYS  60           3HG      LYS  60  -5.478  -4.347  10.484
  489    HD2  LYS  60           2HD      LYS  60  -3.338  -3.112  10.640
  490    HD3  LYS  60           3HD      LYS  60  -4.166  -1.771  11.433
  491    HE2  LYS  60           2HE      LYS  60  -3.003  -3.115  13.086
  492    HE3  LYS  60           3HE      LYS  60  -4.744  -3.291  13.318
  493    HZ1  LYS  60           3HZ      LYS  60  -2.979  -5.229  11.916
  494    HZ2  LYS  60           1HZ      LYS  60  -4.645  -5.403  12.140
  495    HZ3  LYS  60           2HZ      LYS  60  -3.609  -5.416  13.471
  496    H    GLU  61           H        GLU  61  -4.346  -0.938   6.671
  497    HA   GLU  61           HA       GLU  61  -6.461  -1.163   4.768
  498    HB2  GLU  61           2HB      GLU  61  -3.961   0.571   4.754
  499    HB3  GLU  61           3HB      GLU  61  -5.286   0.731   3.605
  500    HG2  GLU  61           2HG      GLU  61  -5.425   1.203   6.599
  501    HG3  GLU  61           3HG      GLU  61  -5.440   2.439   5.343
  502    H    ALA  62           H        ALA  62  -2.952  -1.798   4.680
  503    HA   ALA  62           HA       ALA  62  -2.619  -2.685   2.071
  504    HB1  ALA  62           3HB      ALA  62  -0.771  -2.254   3.645
  505    HB2  ALA  62           1HB      ALA  62  -0.628  -3.856   2.914
  506    HB3  ALA  62           2HB      ALA  62  -1.217  -3.689   4.568
  507    H    GLU  63           H        GLU  63  -3.564  -4.518   4.959
  508    HA   GLU  63           HA       GLU  63  -3.786  -7.086   3.837
  509    HB2  GLU  63           2HB      GLU  63  -5.126  -5.871   6.274
  510    HB3  GLU  63           3HB      GLU  63  -5.181  -7.591   5.887
  511    HG2  GLU  63           2HG      GLU  63  -2.746  -7.762   6.128
  512    HG3  GLU  63           3HG      GLU  63  -2.632  -6.024   6.431
  513    H    ARG  64           H        ARG  64  -6.265  -4.501   4.264
  514    HA   ARG  64           HA       ARG  64  -8.453  -6.185   3.477
  515    HB2  ARG  64           2HB      ARG  64  -9.860  -4.202   3.496
  516    HB3  ARG  64           3HB      ARG  64  -8.818  -4.201   4.913
  517    HG2  ARG  64           2HG      ARG  64  -7.341  -2.564   3.835
  518    HG3  ARG  64           3HG      ARG  64  -8.373  -2.549   2.408
  519    HD2  ARG  64           2HD      ARG  64  -9.361  -1.782   5.169
  520    HD3  ARG  64           3HD      ARG  64  -8.637  -0.622   4.057
  521    HE   ARG  64           HE       ARG  64 -11.051  -2.177   3.338
  522   HH11  ARG  64          1HH1      ARG  64  -9.414   0.943   3.619
  523   HH12  ARG  64          2HH1      ARG  64 -10.709   1.818   2.860
  524   HH21  ARG  64          1HH2      ARG  64 -12.742  -0.993   2.388
  525   HH22  ARG  64          2HH2      ARG  64 -12.586   0.717   2.169
  526    H    LEU  65           H        LEU  65  -6.179  -4.155   1.728
  527    HA   LEU  65           HA       LEU  65  -7.617  -4.232  -0.785
  528    HB2  LEU  65           2HB      LEU  65  -4.715  -3.523  -0.213
  529    HB3  LEU  65           3HB      LEU  65  -5.574  -3.201  -1.718
  530    HG   LEU  65           HG       LEU  65  -6.236  -1.978   0.986
  531   HD11  LEU  65          1HD1      LEU  65  -4.153  -1.111   0.108
  532   HD12  LEU  65          2HD1      LEU  65  -5.416   0.115   0.071
  533   HD13  LEU  65          3HD1      LEU  65  -4.941  -0.703  -1.420
  534   HD21  LEU  65          3HD2      LEU  65  -8.262  -2.239  -0.336
  535   HD22  LEU  65          1HD2      LEU  65  -7.499  -1.440  -1.715
  536   HD23  LEU  65          2HD2      LEU  65  -7.813  -0.541  -0.228
  537    H    ALA  66           H        ALA  66  -5.002  -6.059   0.726
  538    HA   ALA  66           HA       ALA  66  -4.190  -7.663  -1.424
  539    HB1  ALA  66           3HB      ALA  66  -2.963  -7.479   0.696
  540    HB2  ALA  66           1HB      ALA  66  -3.291  -9.169   0.301
  541    HB3  ALA  66           2HB      ALA  66  -4.253  -8.344   1.531
  542    H    LYS  67           H        LYS  67  -6.669  -8.265   1.079
  543    HA   LYS  67           HA       LYS  67  -7.525 -10.784  -0.006
  544    HB2  LYS  67           2HB      LYS  67  -9.293 -10.695   1.697
  545    HB3  LYS  67           3HB      LYS  67  -7.736 -10.278   2.406
  546    HG2  LYS  67           2HG      LYS  67  -8.323  -7.888   2.332
  547    HG3  LYS  67           3HG      LYS  67  -9.873  -8.272   1.588
  548    HD2  LYS  67           2HD      LYS  67  -8.994  -9.148   4.372
  549    HD3  LYS  67           3HD      LYS  67 -10.058  -7.786   4.023
  550    HE2  LYS  67           2HE      LYS  67 -11.684  -9.377   2.980
  551    HE3  LYS  67           3HE      LYS  67 -10.639 -10.716   3.456
  552    HZ1  LYS  67           3HZ      LYS  67 -12.418 -10.411   5.032
  553    HZ2  LYS  67           1HZ      LYS  67 -11.972  -8.799   5.297
  554    HZ3  LYS  67           2HZ      LYS  67 -10.941 -10.053   5.768
  555    H    GLU  68           H        GLU  68  -8.351  -7.447  -0.659
  556    HA   GLU  68           HA       GLU  68 -11.012  -7.908  -1.661
  557    HB2  GLU  68           2HB      GLU  68 -10.246  -5.718  -0.722
  558    HB3  GLU  68           3HB      GLU  68  -9.151  -5.529  -2.086
  559    HG2  GLU  68           2HG      GLU  68 -11.152  -4.167  -2.406
  560    HG3  GLU  68           3HG      GLU  68 -11.081  -5.434  -3.630
  561    H    PHE  69           H        PHE  69  -7.901  -7.122  -3.200
  562    HA   PHE  69           HA       PHE  69  -8.979  -7.569  -5.887
  563    HB2  PHE  69           2HB      PHE  69  -6.233  -6.538  -5.041
  564    HB3  PHE  69           3HB      PHE  69  -6.897  -6.508  -6.674
  565    HD1  PHE  69           HD1      PHE  69  -9.249  -5.246  -6.896
  566    HD2  PHE  69           HD2      PHE  69  -6.416  -4.551  -3.758
  567    HE1  PHE  69           HE1      PHE  69 -10.263  -3.055  -6.442
  568    HE2  PHE  69           HE2      PHE  69  -7.442  -2.367  -3.318
  569    HZ   PHE  69           HZ       PHE  69  -9.368  -1.616  -4.652
  570    H    ASN  70           H        ASN  70  -7.701  -9.512  -3.590
  571    HA   ASN  70           HA       ASN  70  -6.833 -11.572  -3.471
  572    HB2  ASN  70           2HB      ASN  70  -8.701 -12.031  -5.104
  573    HB3  ASN  70           3HB      ASN  70  -7.567 -11.796  -6.426
  574   HD21  ASN  70          1HD2      ASN  70  -6.103 -13.449  -6.917
  575   HD22  ASN  70          2HD2      ASN  70  -6.189 -15.025  -6.212
  576    H    ILE  71           H        ILE  71  -5.048  -9.608  -3.648
  577    HA   ILE  71           HA       ILE  71  -2.747 -10.788  -5.124
  578    HB   ILE  71           HB       ILE  71  -1.717  -8.469  -5.053
  579   HG12  ILE  71          2HG1      ILE  71  -4.523  -7.606  -4.181
  580   HG13  ILE  71          3HG1      ILE  71  -3.045  -7.459  -3.240
  581   HG21  ILE  71          1HG2      ILE  71  -4.295  -8.680  -6.642
  582   HG22  ILE  71          2HG2      ILE  71  -2.720  -9.321  -7.116
  583   HG23  ILE  71          3HG2      ILE  71  -2.956  -7.579  -6.985
  584   HD11  ILE  71          3HD1      ILE  71  -3.689  -5.325  -4.125
  585   HD12  ILE  71          1HD1      ILE  71  -3.700  -5.953  -5.773
  586   HD13  ILE  71          2HD1      ILE  71  -2.181  -5.841  -4.876
  587    H    THR  72           H        THR  72  -0.719 -10.625  -4.049
  588    HA   THR  72           HA       THR  72  -0.958 -11.104  -1.185
  589    HB   THR  72           HB       THR  72   1.584 -11.304  -2.857
  590    HG1  THR  72           HG1      THR  72  -0.369 -13.341  -2.429
  591   HG21  THR  72          3HG2      THR  72   0.670 -12.791  -0.379
  592   HG22  THR  72          1HG2      THR  72   1.862 -11.488  -0.398
  593   HG23  THR  72          2HG2      THR  72   2.209 -13.018  -1.210
  594    H    VAL  73           H        VAL  73   0.266  -9.934   0.372
  595    HA   VAL  73           HA       VAL  73   1.680  -7.499  -0.494
  596    HB   VAL  73           HB       VAL  73  -0.689  -6.893   0.174
  597   HG11  VAL  73          1HG1      VAL  73   0.137  -7.740   2.971
  598   HG12  VAL  73          2HG1      VAL  73  -1.060  -8.549   1.959
  599   HG13  VAL  73          3HG1      VAL  73  -1.362  -6.909   2.541
  600   HG21  VAL  73          3HG2      VAL  73   1.486  -5.703   1.936
  601   HG22  VAL  73          1HG2      VAL  73  -0.081  -4.961   1.595
  602   HG23  VAL  73          2HG2      VAL  73   1.083  -5.199   0.293
  603    H    THR  74           H        THR  74   3.302  -6.855   0.846
  604    HA   THR  74           HA       THR  74   3.775  -8.147   3.426
  605    HB   THR  74           HB       THR  74   5.175  -9.441   1.849
  606    HG1  THR  74           HG1      THR  74   6.081  -9.156   3.854
  607   HG21  THR  74          3HG2      THR  74   7.044  -8.417   0.588
  608   HG22  THR  74          1HG2      THR  74   6.525  -6.812   1.114
  609   HG23  THR  74          2HG2      THR  74   5.495  -7.765   0.047
  610    H    TYR  75           H        TYR  75   4.453  -6.632   4.915
  611    HA   TYR  75           HA       TYR  75   5.044  -3.902   3.970
  612    HB2  TYR  75           2HB      TYR  75   3.478  -2.946   5.638
  613    HB3  TYR  75           3HB      TYR  75   2.651  -3.903   4.422
  614    HD1  TYR  75           HD1      TYR  75   3.618  -3.762   8.015
  615    HD2  TYR  75           HD2      TYR  75   1.418  -5.944   5.054
  616    HE1  TYR  75           HE1      TYR  75   2.490  -5.039   9.787
  617    HE2  TYR  75           HE2      TYR  75   0.298  -7.212   6.831
  618    HH   TYR  75           HH       TYR  75   0.718  -7.872   9.169
  619    H    THR  76           H        THR  76   6.368  -2.695   5.274
  620    HA   THR  76           HA       THR  76   7.640  -4.043   7.579
  621    HB   THR  76           HB       THR  76   8.882  -1.995   5.685
  622    HG1  THR  76           HG1      THR  76   8.548  -3.892   4.528
  623   HG21  THR  76          3HG2      THR  76   9.959  -2.053   7.922
  624   HG22  THR  76          1HG2      THR  76  11.034  -2.716   6.686
  625   HG23  THR  76          2HG2      THR  76  10.167  -3.800   7.774
  626    H    ILE  77           H        ILE  77   7.154  -3.026   9.464
  627    HA   ILE  77           HA       ILE  77   7.286  -0.078   9.604
  628    HB   ILE  77           HB       ILE  77   5.499  -0.230  11.485
  629   HG12  ILE  77          2HG1      ILE  77   4.928  -2.924  10.148
  630   HG13  ILE  77          3HG1      ILE  77   5.416  -2.674  11.819
  631   HG21  ILE  77          1HG2      ILE  77   3.614  -0.016   9.932
  632   HG22  ILE  77          2HG2      ILE  77   4.570  -0.762   8.648
  633   HG23  ILE  77          3HG2      ILE  77   5.045   0.805   9.306
  634   HD11  ILE  77          3HD1      ILE  77   2.778  -1.864  10.582
  635   HD12  ILE  77          1HD1      ILE  77   3.269  -1.534  12.250
  636   HD13  ILE  77          2HD1      ILE  77   3.076  -3.195  11.698
  637    H    ARG  78           H        ARG  78   9.082   0.287  10.715
  638    HA   ARG  78           HA       ARG  78   9.728  -1.200  13.164
  639    HB2  ARG  78           2HB      ARG  78  11.771  -0.819  10.918
  640    HB3  ARG  78           3HB      ARG  78  12.086  -1.521  12.504
  641    HG2  ARG  78           2HG      ARG  78  10.422  -3.365  11.881
  642    HG3  ARG  78           3HG      ARG  78  10.444  -2.712  10.241
  643    HD2  ARG  78           2HD      ARG  78  11.999  -4.556  10.338
  644    HD3  ARG  78           3HD      ARG  78  12.933  -3.059  10.212
  645    HE   ARG  78           HE       ARG  78  12.457  -4.095  12.901
  646   HH11  ARG  78          1HH1      ARG  78  14.762  -3.882  10.243
  647   HH12  ARG  78          2HH1      ARG  78  16.124  -4.274  11.245
  648   HH21  ARG  78          1HH2      ARG  78  14.252  -4.565  14.191
  649   HH22  ARG  78          2HH2      ARG  78  15.830  -4.660  13.480
  650    H    GLY  79           H        GLY  79  11.714  -0.184  14.172
  651    HA2  GLY  79           2HA      GLY  79  12.607   2.323  14.232
  652    HA3  GLY  79           3HA      GLY  79  10.925   2.576  14.711
  653    H    SER  80           H        SER  80  10.939  -0.200  15.898
  654    HA   SER  80           HA       SER  80  12.142   0.291  18.482
  655    HB2  SER  80           2HB      SER  80  10.721  -2.196  17.398
  656    HB3  SER  80           3HB      SER  80  11.106  -1.868  19.093
  657    HG   SER  80           HG       SER  80   8.954  -1.358  18.573
  658    H    LEU  81           H        LEU  81  14.138   0.348  16.550
  659    HA   LEU  81           HA       LEU  81  15.626  -2.056  16.284
  660    HB2  LEU  81           2HB      LEU  81  16.659   0.810  16.387
  661    HB3  LEU  81           3HB      LEU  81  17.534  -0.571  15.741
  662    HG   LEU  81           HG       LEU  81  14.986   0.620  14.550
  663   HD11  LEU  81          1HD1      LEU  81  16.392   1.377  12.695
  664   HD12  LEU  81          2HD1      LEU  81  17.834   0.798  13.535
  665   HD13  LEU  81          3HD1      LEU  81  16.879   2.116  14.220
  666   HD21  LEU  81          3HD2      LEU  81  16.740  -1.620  13.494
  667   HD22  LEU  81          1HD2      LEU  81  15.370  -0.889  12.649
  668   HD23  LEU  81          2HD2      LEU  81  15.105  -1.787  14.140
  669    H    GLU  82           H        GLU  82  15.999   0.717  18.495
  670    HA   GLU  82           HA       GLU  82  16.561   0.964  20.645
  671    HB2  GLU  82           2HB      GLU  82  15.495  -1.875  20.927
  672    HB3  GLU  82           3HB      GLU  82  15.734  -0.738  22.249
  673    HG2  GLU  82           2HG      GLU  82  13.765  -0.433  19.958
  674    HG3  GLU  82           3HG      GLU  82  13.371  -0.868  21.615
  675    H    HIS  83           H        HIS  83  18.783   1.180  20.305
  676    HA   HIS  83           HA       HIS  83  20.486  -1.107  21.128
  677    HB2  HIS  83           2HB      HIS  83  21.187   1.501  19.697
  678    HB3  HIS  83           3HB      HIS  83  22.382   0.344  20.262
  679    HD1  HIS  83           HD1      HIS  83  23.033  -1.442  18.647
  680    HD2  HIS  83           HD2      HIS  83  19.407   0.317  17.621
  681    HE1  HIS  83           HE1      HIS  83  22.406  -2.410  16.418
  682    HE2  HIS  83           HE2      HIS  83  20.254  -1.280  15.795
  683    H    HIS  84           H        HIS  84  19.659  -0.837  23.298
  684    HA   HIS  84           HA       HIS  84  21.206   1.004  24.934
  685    HB2  HIS  84           2HB      HIS  84  19.299   2.123  25.994
  686    HB3  HIS  84           3HB      HIS  84  19.242   2.411  24.260
  687    HD1  HIS  84           HD1      HIS  84  17.402   0.744  27.043
  688    HD2  HIS  84           HD2      HIS  84  17.035   1.198  22.940
  689    HE1  HIS  84           HE1      HIS  84  15.078  -0.006  26.488
  690    HE2  HIS  84           HE2      HIS  84  14.833   0.438  24.025
  691    H    HIS  85           H        HIS  85  20.645  -1.970  24.528
  692    HA   HIS  85           HA       HIS  85  19.542  -3.013  26.949
  693    HB2  HIS  85           2HB      HIS  85  19.920  -4.327  24.801
  694    HB3  HIS  85           3HB      HIS  85  21.639  -4.324  25.147
  695    HD1  HIS  85           HD1      HIS  85  19.280  -6.698  25.045
  696    HD2  HIS  85           HD2      HIS  85  21.612  -5.436  28.240
  697    HE1  HIS  85           HE1      HIS  85  19.324  -8.614  26.653
  698    HE2  HIS  85           HE2      HIS  85  20.579  -7.756  28.651
  699    H    HIS  86           H        HIS  86  20.394  -1.752  28.578
  700    HA   HIS  86           HA       HIS  86  23.201  -1.045  28.674
  701    HB2  HIS  86           2HB      HIS  86  21.286   0.573  29.027
  702    HB3  HIS  86           3HB      HIS  86  20.896  -0.265  30.523
  703    HD1  HIS  86           HD1      HIS  86  23.490   1.963  28.962
  704    HD2  HIS  86           HD2      HIS  86  22.467   0.497  32.707
  705    HE1  HIS  86           HE1      HIS  86  24.860   3.275  30.598
  706    HE2  HIS  86           HE2      HIS  86  24.066   2.497  32.856
  707    H    HIS  87           H        HIS  87  24.696  -1.974  29.985
  708    HA   HIS  87           HA       HIS  87  24.207  -4.266  31.579
  709    HB2  HIS  87           2HB      HIS  87  26.588  -2.356  31.566
  710    HB3  HIS  87           3HB      HIS  87  26.554  -3.853  32.489
  711    HD1  HIS  87           HD1      HIS  87  27.804  -2.598  29.422
  712    HD2  HIS  87           HD2      HIS  87  26.032  -6.171  30.584
  713    HE1  HIS  87           HE1      HIS  87  28.494  -4.286  27.698
  714    HE2  HIS  87           HE2      HIS  87  27.273  -6.387  28.339
  715    H    HIS  88           H        HIS  88  23.723  -4.513  33.702
  716    HA   HIS  88           HA       HIS  88  22.791  -2.338  35.292
  717    HB2  HIS  88           2HB      HIS  88  21.785  -4.544  35.564
  718    HB3  HIS  88           3HB      HIS  88  23.338  -5.249  36.008
  719    HD1  HIS  88           HD1      HIS  88  24.160  -4.914  38.412
  720    HD2  HIS  88           HD2      HIS  88  20.555  -2.994  37.641
  721    HE1  HIS  88           HE1      HIS  88  23.274  -4.213  40.653
  722    HE2  HIS  88           HE2      HIS  88  21.134  -3.000  40.154
  Start of MODEL   20
    1    H1   MET   1           1H       MET   1   8.602   4.338  14.343
    2    H2   MET   1           2H       MET   1   8.550   5.508  15.558
    3    H3   MET   1           3H       MET   1  10.037   4.909  15.020
    4    HA   MET   1           HA       MET   1   8.122   6.443  13.368
    5    HB2  MET   1           2HB      MET   1   9.145   7.828  15.167
    6    HB3  MET   1           3HB      MET   1  10.749   7.342  14.651
    7    HG2  MET   1           2HG      MET   1  10.452   8.536  12.534
    8    HG3  MET   1           3HG      MET   1   8.804   8.969  12.991
    9    HE1  MET   1           3HE      MET   1   9.406  11.449  15.984
   10    HE2  MET   1           1HE      MET   1   9.100   9.716  16.103
   11    HE3  MET   1           2HE      MET   1   8.198  10.697  14.944
   12    H    GLY   2           H        GLY   2   8.826   6.845  11.227
   13    HA2  GLY   2           2HA      GLY   2  11.065   6.814   9.905
   14    HA3  GLY   2           3HA      GLY   2  10.961   5.085  10.213
   15    H    GLU   3           H        GLU   3  11.038   5.018   7.850
   16    HA   GLU   3           HA       GLU   3   8.566   5.669   6.420
   17    HB2  GLU   3           2HB      GLU   3  10.768   5.992   5.308
   18    HB3  GLU   3           3HB      GLU   3  11.132   4.281   5.495
   19    HG2  GLU   3           2HG      GLU   3   9.205   3.735   4.007
   20    HG3  GLU   3           3HG      GLU   3   8.916   5.461   3.776
   21    H    MET   4           H        MET   4   7.167   4.086   5.548
   22    HA   MET   4           HA       MET   4   7.480   1.287   6.484
   23    HB2  MET   4           2HB      MET   4   5.526   2.392   7.543
   24    HB3  MET   4           3HB      MET   4   4.893   2.845   5.961
   25    HG2  MET   4           2HG      MET   4   4.665   0.445   5.395
   26    HG3  MET   4           3HG      MET   4   5.245   0.026   7.011
   27    HE1  MET   4           3HE      MET   4   2.547  -1.158   5.974
   28    HE2  MET   4           1HE      MET   4   1.478  -0.867   7.345
   29    HE3  MET   4           2HE      MET   4   3.134  -1.407   7.621
   30    H    ASP   5           H        ASP   5   8.195   0.109   4.729
   31    HA   ASP   5           HA       ASP   5   7.329   0.658   2.024
   32    HB2  ASP   5           2HB      ASP   5   9.642  -0.175   2.664
   33    HB3  ASP   5           3HB      ASP   5   8.923  -1.706   3.152
   34    H    ILE   6           H        ILE   6   5.419  -0.054   1.339
   35    HA   ILE   6           HA       ILE   6   4.161  -2.520   2.398
   36    HB   ILE   6           HB       ILE   6   2.775  -0.083   1.141
   37   HG12  ILE   6          2HG1      ILE   6   2.848  -0.863   4.102
   38   HG13  ILE   6          3HG1      ILE   6   3.821   0.419   3.392
   39   HG21  ILE   6          1HG2      ILE   6   0.679  -1.143   1.943
   40   HG22  ILE   6          2HG2      ILE   6   1.596  -2.531   2.532
   41   HG23  ILE   6          3HG2      ILE   6   1.534  -2.183   0.802
   42   HD11  ILE   6          3HD1      ILE   6   1.932   1.337   4.520
   43   HD12  ILE   6          1HD1      ILE   6   0.827   0.339   3.578
   44   HD13  ILE   6          2HD1      ILE   6   1.762   1.609   2.784
   45    H    ARG   7           H        ARG   7   4.456  -4.080   0.884
   46    HA   ARG   7           HA       ARG   7   4.658  -3.335  -1.979
   47    HB2  ARG   7           2HB      ARG   7   6.791  -4.145  -0.836
   48    HB3  ARG   7           3HB      ARG   7   6.022  -5.712  -0.615
   49    HG2  ARG   7           2HG      ARG   7   5.818  -5.945  -3.083
   50    HG3  ARG   7           3HG      ARG   7   6.598  -4.371  -3.287
   51    HD2  ARG   7           2HD      ARG   7   8.581  -5.380  -1.961
   52    HD3  ARG   7           3HD      ARG   7   7.810  -6.946  -2.250
   53    HE   ARG   7           HE       ARG   7   7.920  -6.103  -4.735
   54   HH11  ARG   7          1HH1      ARG   7  10.426  -5.662  -2.295
   55   HH12  ARG   7          2HH1      ARG   7  11.717  -5.647  -3.453
   56   HH21  ARG   7          1HH2      ARG   7   9.631  -6.099  -6.237
   57   HH22  ARG   7          2HH2      ARG   7  11.267  -5.897  -5.684
   58    H    PHE   8           H        PHE   8   3.239  -4.232  -3.278
   59    HA   PHE   8           HA       PHE   8   1.580  -6.545  -2.427
   60    HB2  PHE   8           2HB      PHE   8   0.980  -4.294  -4.418
   61    HB3  PHE   8           3HB      PHE   8  -0.030  -5.722  -4.214
   62    HD1  PHE   8           HD2      PHE   8  -1.348  -6.056  -2.123
   63    HD2  PHE   8           HD1      PHE   8   0.916  -2.477  -2.760
   64    HE1  PHE   8           HE2      PHE   8  -2.603  -4.938  -0.327
   65    HE2  PHE   8           HE1      PHE   8  -0.345  -1.375  -0.952
   66    HZ   PHE   8           HZ       PHE   8  -2.103  -2.603   0.263
   67    H    ARG   9           H        ARG   9   1.135  -8.166  -4.130
   68    HA   ARG   9           HA       ARG   9   2.805  -8.061  -6.557
   69    HB2  ARG   9           2HB      ARG   9   4.111  -9.190  -4.641
   70    HB3  ARG   9           3HB      ARG   9   2.912 -10.468  -4.679
   71    HG2  ARG   9           2HG      ARG   9   3.512 -10.979  -7.019
   72    HG3  ARG   9           3HG      ARG   9   4.725  -9.694  -6.988
   73    HD2  ARG   9           2HD      ARG   9   5.904 -10.897  -5.150
   74    HD3  ARG   9           3HD      ARG   9   4.712 -12.197  -5.265
   75    HE   ARG   9           HE       ARG   9   6.187 -11.532  -7.696
   76   HH11  ARG   9          1HH1      ARG   9   5.936 -13.703  -4.935
   77   HH12  ARG   9          2HH1      ARG   9   6.912 -14.933  -5.670
   78   HH21  ARG   9          1HH2      ARG   9   7.495 -13.128  -8.619
   79   HH22  ARG   9          2HH2      ARG   9   7.800 -14.602  -7.757
   80    H    GLY  10           H        GLY  10   1.697  -8.901  -8.266
   81    HA2  GLY  10           2HA      GLY  10  -0.373 -10.942  -7.943
   82    HA3  GLY  10           3HA      GLY  10  -0.935  -9.352  -8.460
   83    H    ASP  11           H        ASP  11  -1.168 -11.743  -9.984
   84    HA   ASP  11           HA       ASP  11   0.786 -11.707 -12.121
   85    HB2  ASP  11           2HB      ASP  11  -0.473 -13.779 -11.595
   86    HB3  ASP  11           3HB      ASP  11  -1.991 -12.980 -11.974
   87    H    ASP  12           H        ASP  12  -1.956  -9.826 -11.258
   88    HA   ASP  12           HA       ASP  12  -2.108  -8.568 -13.931
   89    HB2  ASP  12           2HB      ASP  12  -4.276  -9.450 -13.186
   90    HB3  ASP  12           3HB      ASP  12  -4.141  -8.605 -11.647
   91    H    LEU  13           H        LEU  13  -0.838  -6.829 -14.004
   92    HA   LEU  13           HA       LEU  13   0.220  -5.351 -11.872
   93    HB2  LEU  13           2HB      LEU  13   1.027  -5.562 -14.288
   94    HB3  LEU  13           3HB      LEU  13  -0.156  -4.354 -14.725
   95    HG   LEU  13           HG       LEU  13   2.261  -3.561 -14.500
   96   HD11  LEU  13          1HD1      LEU  13   1.769  -1.403 -13.477
   97   HD12  LEU  13          2HD1      LEU  13   0.287  -2.052 -12.771
   98   HD13  LEU  13          3HD1      LEU  13   0.445  -1.923 -14.522
   99   HD21  LEU  13          3HD2      LEU  13   2.910  -4.820 -12.494
  100   HD22  LEU  13          1HD2      LEU  13   1.790  -3.869 -11.513
  101   HD23  LEU  13          2HD2      LEU  13   3.185  -3.095 -12.270
  102    H    GLU  14           H        GLU  14  -2.901  -5.081 -13.406
  103    HA   GLU  14           HA       GLU  14  -3.322  -2.298 -12.719
  104    HB2  GLU  14           2HB      GLU  14  -5.291  -4.374 -13.781
  105    HB3  GLU  14           3HB      GLU  14  -5.713  -2.703 -13.418
  106    HG2  GLU  14           2HG      GLU  14  -3.757  -2.106 -15.073
  107    HG3  GLU  14           3HG      GLU  14  -3.958  -3.765 -15.627
  108    H    ALA  15           H        ALA  15  -4.172  -5.441 -11.245
  109    HA   ALA  15           HA       ALA  15  -5.981  -4.487  -9.286
  110    HB1  ALA  15           3HB      ALA  15  -5.759  -6.877  -9.859
  111    HB2  ALA  15           1HB      ALA  15  -5.543  -6.621  -8.126
  112    HB3  ALA  15           2HB      ALA  15  -4.140  -6.902  -9.160
  113    H    LEU  16           H        LEU  16  -2.512  -4.686  -9.460
  114    HA   LEU  16           HA       LEU  16  -1.830  -3.901  -6.826
  115    HB2  LEU  16           2HB      LEU  16  -0.287  -3.369  -9.403
  116    HB3  LEU  16           3HB      LEU  16   0.378  -3.403  -7.776
  117    HG   LEU  16           HG       LEU  16  -0.773  -5.821  -9.238
  118   HD11  LEU  16          1HD1      LEU  16   1.323  -5.078 -10.260
  119   HD12  LEU  16          2HD1      LEU  16   1.545  -6.611  -9.424
  120   HD13  LEU  16          3HD1      LEU  16   2.128  -5.114  -8.689
  121   HD21  LEU  16          3HD2      LEU  16  -1.058  -6.013  -6.812
  122   HD22  LEU  16          1HD2      LEU  16   0.660  -5.684  -6.568
  123   HD23  LEU  16          2HD2      LEU  16   0.146  -7.153  -7.398
  124    H    GLU  17           H        GLU  17  -2.485  -2.077  -9.817
  125    HA   GLU  17           HA       GLU  17  -1.946   0.533  -8.783
  126    HB2  GLU  17           2HB      GLU  17  -3.593  -0.290 -11.214
  127    HB3  GLU  17           3HB      GLU  17  -3.057   1.349 -10.857
  128    HG2  GLU  17           2HG      GLU  17  -0.707   0.647 -11.072
  129    HG3  GLU  17           3HG      GLU  17  -1.230  -1.005 -11.398
  130    H    LYS  18           H        LYS  18  -4.844  -1.468  -8.692
  131    HA   LYS  18           HA       LYS  18  -6.611   0.683  -7.895
  132    HB2  LYS  18           2HB      LYS  18  -6.903  -2.322  -8.003
  133    HB3  LYS  18           3HB      LYS  18  -8.054  -1.389  -7.061
  134    HG2  LYS  18           2HG      LYS  18  -9.018  -1.806  -9.215
  135    HG3  LYS  18           3HG      LYS  18  -8.635  -0.087  -9.121
  136    HD2  LYS  18           2HD      LYS  18  -6.602  -0.461 -10.465
  137    HD3  LYS  18           3HD      LYS  18  -6.947  -2.194 -10.506
  138    HE2  LYS  18           2HE      LYS  18  -8.765  -0.067 -11.688
  139    HE3  LYS  18           3HE      LYS  18  -7.565  -0.970 -12.613
  140    HZ1  LYS  18           3HZ      LYS  18  -8.726  -3.022 -11.929
  141    HZ2  LYS  18           1HZ      LYS  18  -9.680  -1.998 -12.877
  142    HZ3  LYS  18           2HZ      LYS  18  -9.929  -2.078 -11.212
  143    H    ALA  19           H        ALA  19  -4.893  -1.964  -6.159
  144    HA   ALA  19           HA       ALA  19  -5.480  -1.218  -3.515
  145    HB1  ALA  19           3HB      ALA  19  -2.894  -2.413  -4.596
  146    HB2  ALA  19           1HB      ALA  19  -4.320  -3.323  -4.092
  147    HB3  ALA  19           2HB      ALA  19  -3.391  -2.410  -2.902
  148    H    LEU  20           H        LEU  20  -2.914  -0.192  -5.684
  149    HA   LEU  20           HA       LEU  20  -1.423   1.587  -4.201
  150    HB2  LEU  20           2HB      LEU  20  -0.821   0.831  -6.459
  151    HB3  LEU  20           3HB      LEU  20  -2.179   1.702  -7.144
  152    HG   LEU  20           HG       LEU  20  -1.133   3.849  -6.519
  153   HD11  LEU  20          1HD1      LEU  20   1.165   3.939  -5.675
  154   HD12  LEU  20          2HD1      LEU  20   1.188   2.183  -5.499
  155   HD13  LEU  20          3HD1      LEU  20   0.087   3.159  -4.521
  156   HD21  LEU  20          3HD2      LEU  20  -0.701   2.917  -8.749
  157   HD22  LEU  20          1HD2      LEU  20   0.709   2.046  -8.133
  158   HD23  LEU  20          2HD2      LEU  20   0.696   3.811  -8.161
  159    H    LYS  21           H        LYS  21  -4.287   2.258  -6.193
  160    HA   LYS  21           HA       LYS  21  -4.433   5.026  -6.000
  161    HB2  LYS  21           2HB      LYS  21  -5.837   3.475  -7.460
  162    HB3  LYS  21           3HB      LYS  21  -6.824   3.123  -6.048
  163    HG2  LYS  21           2HG      LYS  21  -7.309   5.633  -5.927
  164    HG3  LYS  21           3HG      LYS  21  -6.553   5.764  -7.516
  165    HD2  LYS  21           2HD      LYS  21  -9.081   4.270  -6.759
  166    HD3  LYS  21           3HD      LYS  21  -8.921   5.619  -7.880
  167    HE2  LYS  21           2HE      LYS  21  -7.934   2.775  -8.309
  168    HE3  LYS  21           3HE      LYS  21  -9.292   3.558  -9.113
  169    HZ1  LYS  21           3HZ      LYS  21  -6.421   4.258  -9.408
  170    HZ2  LYS  21           1HZ      LYS  21  -7.697   5.149 -10.072
  171    HZ3  LYS  21           2HZ      LYS  21  -7.428   3.560 -10.572
  172    H    GLU  22           H        GLU  22  -5.559   2.527  -3.827
  173    HA   GLU  22           HA       GLU  22  -6.979   4.292  -2.036
  174    HB2  GLU  22           2HB      GLU  22  -6.317   1.344  -1.728
  175    HB3  GLU  22           3HB      GLU  22  -7.476   2.258  -0.770
  176    HG2  GLU  22           2HG      GLU  22  -7.677   1.596  -3.715
  177    HG3  GLU  22           3HG      GLU  22  -8.633   0.896  -2.411
  178    H    MET  23           H        MET  23  -3.842   2.483  -1.920
  179    HA   MET  23           HA       MET  23  -3.207   3.262   0.727
  180    HB2  MET  23           2HB      MET  23  -1.301   2.481  -1.518
  181    HB3  MET  23           3HB      MET  23  -0.886   2.566   0.193
  182    HG2  MET  23           2HG      MET  23  -2.813   0.646  -1.116
  183    HG3  MET  23           3HG      MET  23  -1.240   0.263  -0.434
  184    HE1  MET  23           3HE      MET  23  -1.246   1.797   2.347
  185    HE2  MET  23           1HE      MET  23  -0.768   0.106   2.175
  186    HE3  MET  23           2HE      MET  23  -1.943   0.572   3.407
  187    H    ILE  24           H        ILE  24  -2.686   4.821  -2.380
  188    HA   ILE  24           HA       ILE  24  -1.126   7.037  -1.448
  189    HB   ILE  24           HB       ILE  24  -2.890   6.732  -3.942
  190   HG12  ILE  24          2HG1      ILE  24   0.147   6.624  -3.567
  191   HG13  ILE  24          3HG1      ILE  24  -0.900   5.275  -3.987
  192   HG21  ILE  24          1HG2      ILE  24  -1.844   8.794  -4.824
  193   HG22  ILE  24          2HG2      ILE  24  -1.000   9.029  -3.293
  194   HG23  ILE  24          3HG2      ILE  24  -2.761   9.122  -3.352
  195   HD11  ILE  24          3HD1      ILE  24   0.344   6.041  -5.904
  196   HD12  ILE  24          1HD1      ILE  24  -0.304   7.670  -5.716
  197   HD13  ILE  24          2HD1      ILE  24  -1.377   6.336  -6.143
  198    H    ARG  25           H        ARG  25  -4.582   6.503  -2.090
  199    HA   ARG  25           HA       ARG  25  -5.759   8.872  -1.317
  200    HB2  ARG  25           2HB      ARG  25  -6.934   6.964  -2.330
  201    HB3  ARG  25           3HB      ARG  25  -6.701   6.016  -0.870
  202    HG2  ARG  25           2HG      ARG  25  -8.193   7.592   0.356
  203    HG3  ARG  25           3HG      ARG  25  -8.468   8.463  -1.158
  204    HD2  ARG  25           2HD      ARG  25  -9.381   6.352  -2.160
  205    HD3  ARG  25           3HD      ARG  25  -9.182   5.559  -0.593
  206    HE   ARG  25           HE       ARG  25 -10.729   7.916  -0.306
  207   HH11  ARG  25          1HH1      ARG  25 -11.018   4.629  -1.551
  208   HH12  ARG  25          2HH1      ARG  25 -12.742   4.565  -1.310
  209   HH21  ARG  25          1HH2      ARG  25 -12.970   7.852  -0.054
  210   HH22  ARG  25          2HH2      ARG  25 -13.859   6.411  -0.461
  211    H    GLN  26           H        GLN  26  -4.679   6.197   0.754
  212    HA   GLN  26           HA       GLN  26  -5.573   7.294   3.239
  213    HB2  GLN  26           2HB      GLN  26  -3.445   5.183   2.702
  214    HB3  GLN  26           3HB      GLN  26  -4.110   5.563   4.287
  215    HG2  GLN  26           2HG      GLN  26  -5.598   4.356   1.946
  216    HG3  GLN  26           3HG      GLN  26  -5.104   3.530   3.416
  217   HE21  GLN  26          1HE2      GLN  26  -7.772   3.871   2.227
  218   HE22  GLN  26          2HE2      GLN  26  -8.743   4.634   3.433
  219    H    ALA  27           H        ALA  27  -2.343   7.101   1.698
  220    HA   ALA  27           HA       ALA  27  -0.903   8.493   3.666
  221    HB1  ALA  27           3HB      ALA  27   0.848   8.735   1.970
  222    HB2  ALA  27           1HB      ALA  27  -0.300   8.299   0.703
  223    HB3  ALA  27           2HB      ALA  27   0.147   7.115   1.932
  224    H    ARG  28           H        ARG  28  -2.947   9.705   1.095
  225    HA   ARG  28           HA       ARG  28  -2.036  12.451   1.237
  226    HB2  ARG  28           2HB      ARG  28  -4.535  11.263  -0.059
  227    HB3  ARG  28           3HB      ARG  28  -4.015  12.940  -0.215
  228    HG2  ARG  28           2HG      ARG  28  -1.894  12.115  -1.317
  229    HG3  ARG  28           3HG      ARG  28  -2.569  10.490  -1.255
  230    HD2  ARG  28           2HD      ARG  28  -2.928  11.503  -3.458
  231    HD3  ARG  28           3HD      ARG  28  -4.468  11.181  -2.655
  232    HE   ARG  28           HE       ARG  28  -3.444  13.872  -2.288
  233   HH11  ARG  28          1HH1      ARG  28  -5.447  11.825  -4.355
  234   HH12  ARG  28          2HH1      ARG  28  -6.322  13.167  -5.032
  235   HH21  ARG  28          1HH2      ARG  28  -4.569  15.622  -3.206
  236   HH22  ARG  28          2HH2      ARG  28  -5.822  15.329  -4.375
  237    H    LYS  29           H        LYS  29  -4.856  10.588   2.495
  238    HA   LYS  29           HA       LYS  29  -6.127  12.877   3.671
  239    HB2  LYS  29           2HB      LYS  29  -7.673  11.355   4.741
  240    HB3  LYS  29           3HB      LYS  29  -7.394  10.815   3.092
  241    HG2  LYS  29           2HG      LYS  29  -6.015   9.008   3.815
  242    HG3  LYS  29           3HG      LYS  29  -5.945   9.617   5.465
  243    HD2  LYS  29           2HD      LYS  29  -8.418   8.523   4.070
  244    HD3  LYS  29           3HD      LYS  29  -7.443   7.669   5.265
  245    HE2  LYS  29           2HE      LYS  29  -8.008   9.550   6.895
  246    HE3  LYS  29           3HE      LYS  29  -9.183  10.110   5.701
  247    HZ1  LYS  29           3HZ      LYS  29 -10.332   8.739   7.219
  248    HZ2  LYS  29           1HZ      LYS  29  -9.163   7.521   7.143
  249    HZ3  LYS  29           2HZ      LYS  29 -10.159   7.817   5.815
  250    H    PHE  30           H        PHE  30  -3.619  10.729   4.761
  251    HA   PHE  30           HA       PHE  30  -3.596  11.813   7.484
  252    HB2  PHE  30           2HB      PHE  30  -1.813   9.754   6.112
  253    HB3  PHE  30           3HB      PHE  30  -1.659  10.238   7.797
  254    HD1  PHE  30           HD1      PHE  30  -4.233  10.207   8.978
  255    HD2  PHE  30           HD2      PHE  30  -2.744   7.601   5.932
  256    HE1  PHE  30           HE1      PHE  30  -5.810   8.457   9.692
  257    HE2  PHE  30           HE2      PHE  30  -4.326   5.859   6.649
  258    HZ   PHE  30           HZ       PHE  30  -5.857   6.282   8.526
  259    H    ALA  31           H        ALA  31  -2.494  12.836   4.521
  260    HA   ALA  31           HA       ALA  31  -1.234  14.555   3.796
  261    HB1  ALA  31           3HB      ALA  31  -0.902  15.297   6.724
  262    HB2  ALA  31           1HB      ALA  31  -2.266  15.761   5.702
  263    HB3  ALA  31           2HB      ALA  31  -0.647  16.357   5.337
  264    H    GLY  32           H        GLY  32  -0.009  11.935   4.678
  265    HA2  GLY  32           2HA      GLY  32   2.809  12.537   5.099
  266    HA3  GLY  32           3HA      GLY  32   2.077  10.953   4.910
  267    H    THR  33           H        THR  33   4.251  10.984   3.579
  268    HA   THR  33           HA       THR  33   3.835  11.917   0.804
  269    HB   THR  33           HB       THR  33   6.426  11.006   2.196
  270    HG1  THR  33           HG1      THR  33   5.089  13.305   2.407
  271   HG21  THR  33          3HG2      THR  33   6.467  10.729  -0.285
  272   HG22  THR  33          1HG2      THR  33   7.567  12.002   0.248
  273   HG23  THR  33          2HG2      THR  33   6.017  12.428  -0.474
  274    H    VAL  34           H        VAL  34   3.971  10.356  -0.872
  275    HA   VAL  34           HA       VAL  34   4.253   7.526  -0.173
  276    HB   VAL  34           HB       VAL  34   1.854   7.926  -0.013
  277   HG11  VAL  34          1HG1      VAL  34   0.468   8.757  -1.884
  278   HG12  VAL  34          2HG1      VAL  34   1.931   9.094  -2.814
  279   HG13  VAL  34          3HG1      VAL  34   1.617   9.973  -1.319
  280   HG21  VAL  34          3HG2      VAL  34   2.487   6.476  -2.605
  281   HG22  VAL  34          1HG2      VAL  34   0.982   6.340  -1.690
  282   HG23  VAL  34          2HG2      VAL  34   2.498   5.775  -0.985
  283    H    THR  35           H        THR  35   5.357   6.452  -1.665
  284    HA   THR  35           HA       THR  35   5.734   7.525  -4.405
  285    HB   THR  35           HB       THR  35   7.908   6.327  -2.597
  286    HG1  THR  35           HG1      THR  35   7.116   8.923  -3.232
  287   HG21  THR  35          3HG2      THR  35   8.294   5.711  -4.963
  288   HG22  THR  35          1HG2      THR  35   9.477   6.907  -4.432
  289   HG23  THR  35          2HG2      THR  35   8.119   7.401  -5.444
  290    H    TYR  36           H        TYR  36   5.497   5.937  -5.957
  291    HA   TYR  36           HA       TYR  36   5.307   3.123  -5.032
  292    HB2  TYR  36           2HB      TYR  36   3.533   2.736  -6.635
  293    HB3  TYR  36           3HB      TYR  36   3.092   4.035  -5.549
  294    HD1  TYR  36           HD2      TYR  36   2.963   6.404  -6.413
  295    HD2  TYR  36           HD1      TYR  36   3.708   3.114  -9.047
  296    HE1  TYR  36           HE2      TYR  36   2.332   7.792  -8.344
  297    HE2  TYR  36           HE1      TYR  36   3.071   4.509 -10.965
  298    HH   TYR  36           HH       TYR  36   2.652   7.896 -10.721
  299    H    THR  37           H        THR  37   6.011   1.527  -6.389
  300    HA   THR  37           HA       THR  37   7.364   2.261  -8.917
  301    HB   THR  37           HB       THR  37   8.444   0.330  -6.811
  302    HG1  THR  37           HG1      THR  37   9.031   2.998  -7.505
  303   HG21  THR  37          3HG2      THR  37  10.469   0.209  -8.252
  304   HG22  THR  37          1HG2      THR  37   9.640   1.180  -9.483
  305   HG23  THR  37          2HG2      THR  37   9.051  -0.432  -9.077
  306    H    LEU  38           H        LEU  38   5.749   1.456 -10.235
  307    HA   LEU  38           HA       LEU  38   4.813  -1.286 -10.028
  308    HB2  LEU  38           2HB      LEU  38   4.707   0.709 -12.345
  309    HB3  LEU  38           3HB      LEU  38   3.886  -0.847 -12.319
  310    HG   LEU  38           HG       LEU  38   3.309   1.399 -10.342
  311   HD11  LEU  38          1HD1      LEU  38   2.674   2.117 -12.587
  312   HD12  LEU  38          2HD1      LEU  38   1.242   1.796 -11.614
  313   HD13  LEU  38          3HD1      LEU  38   1.755   0.628 -12.834
  314   HD21  LEU  38          3HD2      LEU  38   2.765  -0.804  -9.435
  315   HD22  LEU  38          1HD2      LEU  38   1.827  -1.203 -10.881
  316   HD23  LEU  38          2HD2      LEU  38   1.285   0.081  -9.798
  317    H    ASP  39           H        ASP  39   6.222  -2.903 -10.346
  318    HA   ASP  39           HA       ASP  39   8.358  -2.685 -12.389
  319    HB2  ASP  39           2HB      ASP  39   9.264  -2.256 -10.074
  320    HB3  ASP  39           3HB      ASP  39   8.668  -3.830  -9.562
  321    H    GLY  40           H        GLY  40   7.372  -4.019 -13.832
  322    HA2  GLY  40           2HA      GLY  40   6.841  -5.975 -14.880
  323    HA3  GLY  40           3HA      GLY  40   7.605  -6.824 -13.542
  324    H    ASN  41           H        ASN  41   6.307  -7.521 -11.778
  325    HA   ASN  41           HA       ASN  41   3.375  -7.275 -12.017
  326    HB2  ASN  41           2HB      ASN  41   4.975  -9.855 -12.101
  327    HB3  ASN  41           3HB      ASN  41   3.349  -9.854 -11.419
  328   HD21  ASN  41          1HD2      ASN  41   1.597  -9.329 -12.764
  329   HD22  ASN  41          2HD2      ASN  41   1.690  -9.483 -14.482
  330    H    ASP  42           H        ASP  42   5.508  -6.217 -10.191
  331    HA   ASP  42           HA       ASP  42   3.801  -6.587  -7.850
  332    HB2  ASP  42           2HB      ASP  42   5.610  -6.814  -6.249
  333    HB3  ASP  42           3HB      ASP  42   5.737  -8.105  -7.432
  334    H    LEU  43           H        LEU  43   4.049  -4.902  -6.304
  335    HA   LEU  43           HA       LEU  43   4.852  -2.280  -7.430
  336    HB2  LEU  43           2HB      LEU  43   2.463  -2.439  -7.625
  337    HB3  LEU  43           3HB      LEU  43   2.301  -3.167  -6.036
  338    HG   LEU  43           HG       LEU  43   2.932  -0.998  -4.991
  339   HD11  LEU  43          1HD1      LEU  43   2.858   0.136  -7.800
  340   HD12  LEU  43          2HD1      LEU  43   4.282   0.001  -6.769
  341   HD13  LEU  43          3HD1      LEU  43   2.961   1.071  -6.309
  342   HD21  LEU  43          3HD2      LEU  43   0.591  -1.634  -5.306
  343   HD22  LEU  43          1HD2      LEU  43   0.579  -0.845  -6.886
  344   HD23  LEU  43          2HD2      LEU  43   0.804   0.110  -5.418
  345    H    GLU  44           H        GLU  44   6.174  -1.149  -6.093
  346    HA   GLU  44           HA       GLU  44   6.380  -1.893  -3.226
  347    HB2  GLU  44           2HB      GLU  44   8.425  -2.295  -4.599
  348    HB3  GLU  44           3HB      GLU  44   8.454  -0.597  -5.067
  349    HG2  GLU  44           2HG      GLU  44   8.836   0.050  -2.726
  350    HG3  GLU  44           3HG      GLU  44   8.763  -1.640  -2.230
  351    H    ILE  45           H        ILE  45   5.051  -0.506  -2.203
  352    HA   ILE  45           HA       ILE  45   5.048   2.387  -2.802
  353    HB   ILE  45           HB       ILE  45   3.319   0.824  -0.802
  354   HG12  ILE  45          2HG1      ILE  45   2.558   1.749  -3.623
  355   HG13  ILE  45          3HG1      ILE  45   2.948   0.089  -3.187
  356   HG21  ILE  45          1HG2      ILE  45   3.505   3.223  -0.262
  357   HG22  ILE  45          2HG2      ILE  45   1.874   2.828  -0.794
  358   HG23  ILE  45          3HG2      ILE  45   2.981   3.652  -1.894
  359   HD11  ILE  45          3HD1      ILE  45   0.573   0.387  -3.348
  360   HD12  ILE  45          1HD1      ILE  45   0.615   1.695  -2.169
  361   HD13  ILE  45          2HD1      ILE  45   1.015   0.047  -1.675
  362    H    ARG  46           H        ARG  46   6.058   3.805  -1.437
  363    HA   ARG  46           HA       ARG  46   6.976   2.950   1.242
  364    HB2  ARG  46           2HB      ARG  46   8.432   4.638  -0.847
  365    HB3  ARG  46           3HB      ARG  46   8.965   4.480   0.825
  366    HG2  ARG  46           2HG      ARG  46   9.298   2.063   0.518
  367    HG3  ARG  46           3HG      ARG  46   8.695   2.179  -1.137
  368    HD2  ARG  46           2HD      ARG  46  11.162   3.625  -0.125
  369    HD3  ARG  46           3HD      ARG  46  11.190   2.067  -0.946
  370    HE   ARG  46           HE       ARG  46  10.242   3.189  -2.901
  371   HH11  ARG  46          1HH1      ARG  46  11.837   5.260  -0.543
  372   HH12  ARG  46          2HH1      ARG  46  12.195   6.492  -1.712
  373   HH21  ARG  46          1HH2      ARG  46  10.801   4.765  -4.412
  374   HH22  ARG  46          2HH2      ARG  46  11.613   6.209  -3.890
  375    H    ILE  47           H        ILE  47   5.795   4.012   2.657
  376    HA   ILE  47           HA       ILE  47   4.871   6.775   2.130
  377    HB   ILE  47           HB       ILE  47   3.649   4.692   4.016
  378   HG12  ILE  47          2HG1      ILE  47   2.664   5.739   1.308
  379   HG13  ILE  47          3HG1      ILE  47   3.299   4.129   1.611
  380   HG21  ILE  47          1HG2      ILE  47   2.642   7.483   3.294
  381   HG22  ILE  47          2HG2      ILE  47   3.308   6.997   4.855
  382   HG23  ILE  47          3HG2      ILE  47   1.783   6.308   4.298
  383   HD11  ILE  47          3HD1      ILE  47   1.368   3.663   3.056
  384   HD12  ILE  47          1HD1      ILE  47   0.908   4.086   1.407
  385   HD13  ILE  47          2HD1      ILE  47   0.735   5.272   2.698
  386    H    THR  48           H        THR  48   5.797   8.324   3.291
  387    HA   THR  48           HA       THR  48   7.106   7.747   5.894
  388    HB   THR  48           HB       THR  48   8.142   9.850   3.926
  389    HG1  THR  48           HG1      THR  48   8.440   7.084   3.751
  390   HG21  THR  48          3HG2      THR  48   9.038   9.967   6.218
  391   HG22  THR  48          1HG2      THR  48  10.299   9.467   5.092
  392   HG23  THR  48          2HG2      THR  48   9.527   8.272   6.138
  393    H    GLY  49           H        GLY  49   7.402   9.953   7.118
  394    HA2  GLY  49           2HA      GLY  49   6.795  12.168   7.587
  395    HA3  GLY  49           3HA      GLY  49   5.534  12.099   6.366
  396    H    VAL  50           H        VAL  50   4.091   9.942   7.074
  397    HA   VAL  50           HA       VAL  50   2.472  10.773   9.215
  398    HB   VAL  50           HB       VAL  50   1.320   8.557   8.978
  399   HG11  VAL  50          1HG1      VAL  50   0.478   8.879   6.702
  400   HG12  VAL  50          2HG1      VAL  50   1.852   9.913   6.318
  401   HG13  VAL  50          3HG1      VAL  50   0.670  10.429   7.520
  402   HG21  VAL  50          3HG2      VAL  50   2.001   6.966   7.219
  403   HG22  VAL  50          1HG2      VAL  50   3.249   7.127   8.452
  404   HG23  VAL  50          2HG2      VAL  50   3.447   7.928   6.893
  405    HA   PRO  51           HA       PRO  51   4.608   9.078  12.851
  406    HB2  PRO  51           2HB      PRO  51   1.821   8.670  13.929
  407    HB3  PRO  51           3HB      PRO  51   3.193   9.546  14.640
  408    HG2  PRO  51           2HG      PRO  51   1.128  10.849  13.594
  409    HG3  PRO  51           3HG      PRO  51   2.784  11.464  13.412
  410    HD2  PRO  51           2HD      PRO  51   1.063  10.045  11.401
  411    HD3  PRO  51           3HD      PRO  51   2.204  11.390  11.165
  412    H    GLU  52           H        GLU  52   4.720   7.083  14.116
  413    HA   GLU  52           HA       GLU  52   4.547   4.789  12.477
  414    HB2  GLU  52           2HB      GLU  52   6.278   5.078  14.205
  415    HB3  GLU  52           3HB      GLU  52   5.049   4.998  15.466
  416    HG2  GLU  52           2HG      GLU  52   4.552   2.656  14.839
  417    HG3  GLU  52           3HG      GLU  52   5.776   2.745  13.561
  418    H    GLN  53           H        GLN  53   2.510   6.043  15.074
  419    HA   GLN  53           HA       GLN  53   0.780   3.881  15.476
  420    HB2  GLN  53           2HB      GLN  53  -0.883   5.585  16.254
  421    HB3  GLN  53           3HB      GLN  53   0.718   5.816  16.947
  422    HG2  GLN  53           2HG      GLN  53   1.166   7.687  15.496
  423    HG3  GLN  53           3HG      GLN  53  -0.297   7.378  14.563
  424   HE21  GLN  53          1HE2      GLN  53  -2.293   8.043  15.378
  425   HE22  GLN  53          2HE2      GLN  53  -2.448   9.105  16.737
  426    H    VAL  54           H        VAL  54   0.767   6.400  13.021
  427    HA   VAL  54           HA       VAL  54  -1.690   5.620  11.752
  428    HB   VAL  54           HB       VAL  54   0.559   7.481  10.858
  429   HG11  VAL  54          1HG1      VAL  54  -0.654   6.692   8.888
  430   HG12  VAL  54          2HG1      VAL  54  -1.032   8.384   9.200
  431   HG13  VAL  54          3HG1      VAL  54  -2.198   7.127   9.628
  432   HG21  VAL  54          3HG2      VAL  54  -0.964   9.300  11.512
  433   HG22  VAL  54          1HG2      VAL  54  -0.596   8.252  12.884
  434   HG23  VAL  54          2HG2      VAL  54  -2.157   8.122  12.068
  435    H    ARG  55           H        ARG  55   1.777   5.033  11.155
  436    HA   ARG  55           HA       ARG  55   1.616   3.695   8.681
  437    HB2  ARG  55           2HB      ARG  55   3.621   3.417  10.960
  438    HB3  ARG  55           3HB      ARG  55   3.829   2.632   9.396
  439    HG2  ARG  55           2HG      ARG  55   4.061   4.726   8.263
  440    HG3  ARG  55           3HG      ARG  55   3.503   5.627   9.674
  441    HD2  ARG  55           2HD      ARG  55   5.923   5.853   9.388
  442    HD3  ARG  55           3HD      ARG  55   5.543   5.025  10.896
  443    HE   ARG  55           HE       ARG  55   6.498   3.671   8.443
  444   HH11  ARG  55          1HH1      ARG  55   6.488   3.944  11.948
  445   HH12  ARG  55          2HH1      ARG  55   7.594   2.627  12.174
  446   HH21  ARG  55          1HH2      ARG  55   7.940   1.939   8.760
  447   HH22  ARG  55          2HH2      ARG  55   8.412   1.495  10.368
  448    H    LYS  56           H        LYS  56   1.205   2.523  11.999
  449    HA   LYS  56           HA       LYS  56   0.941  -0.239  11.445
  450    HB2  LYS  56           2HB      LYS  56  -0.157   1.464  13.725
  451    HB3  LYS  56           3HB      LYS  56  -0.195  -0.298  13.707
  452    HG2  LYS  56           2HG      LYS  56   2.233  -0.418  13.772
  453    HG3  LYS  56           3HG      LYS  56   2.366   1.330  13.557
  454    HD2  LYS  56           2HD      LYS  56   2.758   0.800  15.899
  455    HD3  LYS  56           3HD      LYS  56   1.223   1.658  15.763
  456    HE2  LYS  56           2HE      LYS  56   0.025  -0.518  15.882
  457    HE3  LYS  56           3HE      LYS  56   1.574  -1.341  16.075
  458    HZ1  LYS  56           3HZ      LYS  56   1.918  -0.119  18.128
  459    HZ2  LYS  56           1HZ      LYS  56   0.483  -1.003  18.190
  460    HZ3  LYS  56           2HZ      LYS  56   0.438   0.672  17.944
  461    H    GLU  57           H        GLU  57  -1.302   2.440  11.094
  462    HA   GLU  57           HA       GLU  57  -3.668   0.781  10.769
  463    HB2  GLU  57           2HB      GLU  57  -3.321   3.731  10.091
  464    HB3  GLU  57           3HB      GLU  57  -4.843   2.864  10.285
  465    HG2  GLU  57           2HG      GLU  57  -2.809   3.413  12.458
  466    HG3  GLU  57           3HG      GLU  57  -4.348   4.236  12.253
  467    H    LEU  58           H        LEU  58  -1.277   2.357   8.718
  468    HA   LEU  58           HA       LEU  58  -2.421   1.804   6.185
  469    HB2  LEU  58           2HB      LEU  58   0.370   2.383   7.162
  470    HB3  LEU  58           3HB      LEU  58   0.194   1.730   5.548
  471    HG   LEU  58           HG       LEU  58   0.395   4.118   5.369
  472   HD11  LEU  58          1HD1      LEU  58  -1.127   3.109   3.763
  473   HD12  LEU  58          2HD1      LEU  58  -1.651   4.741   4.162
  474   HD13  LEU  58          3HD1      LEU  58  -2.496   3.353   4.853
  475   HD21  LEU  58          3HD2      LEU  58  -1.953   4.423   7.271
  476   HD22  LEU  58          1HD2      LEU  58  -1.160   5.731   6.386
  477   HD23  LEU  58          2HD2      LEU  58  -0.268   4.828   7.606
  478    H    ALA  59           H        ALA  59  -0.880  -0.261   8.521
  479    HA   ALA  59           HA       ALA  59  -0.361  -2.521   6.891
  480    HB1  ALA  59           3HB      ALA  59   0.560  -2.278   9.152
  481    HB2  ALA  59           1HB      ALA  59  -0.336  -3.787   8.996
  482    HB3  ALA  59           2HB      ALA  59  -1.055  -2.415   9.846
  483    H    LYS  60           H        LYS  60  -3.247  -1.556   8.803
  484    HA   LYS  60           HA       LYS  60  -4.803  -3.883   8.280
  485    HB2  LYS  60           2HB      LYS  60  -5.617  -1.068   9.115
  486    HB3  LYS  60           3HB      LYS  60  -6.799  -2.344   8.882
  487    HG2  LYS  60           2HG      LYS  60  -6.429  -2.162  11.221
  488    HG3  LYS  60           3HG      LYS  60  -5.624  -3.649  10.712
  489    HD2  LYS  60           2HD      LYS  60  -3.456  -2.580  10.814
  490    HD3  LYS  60           3HD      LYS  60  -4.190  -0.997  11.074
  491    HE2  LYS  60           2HE      LYS  60  -4.386  -3.320  13.018
  492    HE3  LYS  60           3HE      LYS  60  -3.227  -1.999  13.140
  493    HZ1  LYS  60           3HZ      LYS  60  -5.032  -0.443  13.392
  494    HZ2  LYS  60           1HZ      LYS  60  -5.160  -1.664  14.557
  495    HZ3  LYS  60           2HZ      LYS  60  -6.183  -1.672  13.208
  496    H    GLU  61           H        GLU  61  -4.470  -0.736   6.680
  497    HA   GLU  61           HA       GLU  61  -6.457  -1.086   4.684
  498    HB2  GLU  61           2HB      GLU  61  -3.982   0.683   4.718
  499    HB3  GLU  61           3HB      GLU  61  -5.261   0.797   3.514
  500    HG2  GLU  61           2HG      GLU  61  -5.498   1.332   6.486
  501    HG3  GLU  61           3HG      GLU  61  -5.553   2.527   5.194
  502    H    ALA  62           H        ALA  62  -2.975  -1.762   4.747
  503    HA   ALA  62           HA       ALA  62  -2.554  -2.604   2.119
  504    HB1  ALA  62           3HB      ALA  62  -0.767  -2.134   3.790
  505    HB2  ALA  62           1HB      ALA  62  -0.529  -3.665   2.960
  506    HB3  ALA  62           2HB      ALA  62  -1.153  -3.647   4.609
  507    H    GLU  63           H        GLU  63  -3.462  -4.507   4.979
  508    HA   GLU  63           HA       GLU  63  -3.476  -7.070   3.773
  509    HB2  GLU  63           2HB      GLU  63  -4.855  -6.037   6.288
  510    HB3  GLU  63           3HB      GLU  63  -4.698  -7.740   5.869
  511    HG2  GLU  63           2HG      GLU  63  -2.281  -7.631   6.081
  512    HG3  GLU  63           3HG      GLU  63  -2.335  -5.885   6.304
  513    H    ARG  64           H        ARG  64  -6.101  -4.691   4.369
  514    HA   ARG  64           HA       ARG  64  -8.222  -6.448   3.608
  515    HB2  ARG  64           2HB      ARG  64  -9.714  -4.568   3.792
  516    HB3  ARG  64           3HB      ARG  64  -8.532  -4.432   5.087
  517    HG2  ARG  64           2HG      ARG  64  -7.279  -2.785   3.627
  518    HG3  ARG  64           3HG      ARG  64  -8.654  -2.818   2.528
  519    HD2  ARG  64           2HD      ARG  64  -8.776  -1.992   5.444
  520    HD3  ARG  64           3HD      ARG  64  -8.674  -0.880   4.079
  521    HE   ARG  64           HE       ARG  64 -10.924  -2.683   3.928
  522   HH11  ARG  64          1HH1      ARG  64  -9.788   0.375   5.255
  523   HH12  ARG  64          2HH1      ARG  64 -11.388   1.036   5.420
  524   HH21  ARG  64          1HH2      ARG  64 -13.030  -1.808   4.114
  525   HH22  ARG  64          2HH2      ARG  64 -13.244  -0.210   4.766
  526    H    LEU  65           H        LEU  65  -6.224  -4.144   1.825
  527    HA   LEU  65           HA       LEU  65  -7.760  -4.240  -0.620
  528    HB2  LEU  65           2HB      LEU  65  -4.918  -3.305  -0.053
  529    HB3  LEU  65           3HB      LEU  65  -5.742  -3.090  -1.593
  530    HG   LEU  65           HG       LEU  65  -6.652  -1.877   1.050
  531   HD11  LEU  65          1HD1      LEU  65  -4.558  -0.885   0.256
  532   HD12  LEU  65          2HD1      LEU  65  -5.892   0.259   0.153
  533   HD13  LEU  65          3HD1      LEU  65  -5.299  -0.536  -1.308
  534   HD21  LEU  65          3HD2      LEU  65  -7.735  -1.462  -1.753
  535   HD22  LEU  65          1HD2      LEU  65  -8.232  -0.573  -0.311
  536   HD23  LEU  65          2HD2      LEU  65  -8.547  -2.302  -0.430
  537    H    ALA  66           H        ALA  66  -4.931  -5.912   0.648
  538    HA   ALA  66           HA       ALA  66  -4.086  -7.283  -1.639
  539    HB1  ALA  66           3HB      ALA  66  -2.783  -7.144   0.443
  540    HB2  ALA  66           1HB      ALA  66  -2.958  -8.815  -0.100
  541    HB3  ALA  66           2HB      ALA  66  -3.935  -8.214   1.243
  542    H    LYS  67           H        LYS  67  -6.435  -8.265   0.854
  543    HA   LYS  67           HA       LYS  67  -7.015 -10.819  -0.369
  544    HB2  LYS  67           2HB      LYS  67  -8.671 -11.083   1.432
  545    HB3  LYS  67           3HB      LYS  67  -7.132 -10.531   2.076
  546    HG2  LYS  67           2HG      LYS  67  -8.108  -8.176   2.061
  547    HG3  LYS  67           3HG      LYS  67  -9.670  -8.917   1.726
  548    HD2  LYS  67           2HD      LYS  67  -7.941  -9.458   4.173
  549    HD3  LYS  67           3HD      LYS  67  -9.362  -8.419   4.137
  550    HE2  LYS  67           2HE      LYS  67 -10.766 -10.390   3.568
  551    HE3  LYS  67           3HE      LYS  67  -9.331 -11.417   3.653
  552    HZ1  LYS  67           3HZ      LYS  67 -10.680 -11.432   5.699
  553    HZ2  LYS  67           1HZ      LYS  67 -10.365  -9.790   5.910
  554    HZ3  LYS  67           2HZ      LYS  67  -9.097 -10.908   5.973
  555    H    GLU  68           H        GLU  68  -8.263  -7.584  -0.581
  556    HA   GLU  68           HA       GLU  68 -10.835  -8.112  -1.677
  557    HB2  GLU  68           2HB      GLU  68 -10.143  -5.943  -0.647
  558    HB3  GLU  68           3HB      GLU  68  -9.068  -5.649  -2.007
  559    HG2  GLU  68           2HG      GLU  68 -11.076  -4.344  -2.289
  560    HG3  GLU  68           3HG      GLU  68 -11.037  -5.604  -3.519
  561    H    PHE  69           H        PHE  69  -7.719  -7.213  -3.164
  562    HA   PHE  69           HA       PHE  69  -8.742  -7.603  -5.897
  563    HB2  PHE  69           2HB      PHE  69  -6.044  -6.514  -4.937
  564    HB3  PHE  69           3HB      PHE  69  -6.626  -6.504  -6.601
  565    HD1  PHE  69           HD1      PHE  69  -9.038  -5.352  -6.904
  566    HD2  PHE  69           HD2      PHE  69  -6.334  -4.517  -3.708
  567    HE1  PHE  69           HE1      PHE  69 -10.182  -3.221  -6.490
  568    HE2  PHE  69           HE2      PHE  69  -7.472  -2.373  -3.311
  569    HZ   PHE  69           HZ       PHE  69  -9.401  -1.726  -4.695
  570    H    ASN  70           H        ASN  70  -7.546  -9.630  -3.653
  571    HA   ASN  70           HA       ASN  70  -6.880 -11.780  -3.656
  572    HB2  ASN  70           2HB      ASN  70  -8.475 -11.894  -5.644
  573    HB3  ASN  70           3HB      ASN  70  -7.085 -11.704  -6.703
  574   HD21  ASN  70          1HD2      ASN  70  -5.761 -13.494  -7.068
  575   HD22  ASN  70          2HD2      ASN  70  -6.129 -15.082  -6.497
  576    H    ILE  71           H        ILE  71  -4.994  -9.479  -4.079
  577    HA   ILE  71           HA       ILE  71  -2.596 -10.804  -5.198
  578    HB   ILE  71           HB       ILE  71  -1.559  -8.514  -5.111
  579   HG12  ILE  71          2HG1      ILE  71  -4.351  -7.633  -4.205
  580   HG13  ILE  71          3HG1      ILE  71  -2.871  -7.511  -3.266
  581   HG21  ILE  71          1HG2      ILE  71  -4.179  -8.657  -6.660
  582   HG22  ILE  71          2HG2      ILE  71  -2.627  -9.313  -7.188
  583   HG23  ILE  71          3HG2      ILE  71  -2.832  -7.571  -7.016
  584   HD11  ILE  71          3HD1      ILE  71  -2.016  -5.854  -4.884
  585   HD12  ILE  71          1HD1      ILE  71  -3.521  -5.355  -4.111
  586   HD13  ILE  71          2HD1      ILE  71  -3.543  -5.960  -5.765
  587    H    THR  72           H        THR  72  -0.559 -10.605  -3.944
  588    HA   THR  72           HA       THR  72  -0.984 -11.181  -1.109
  589    HB   THR  72           HB       THR  72   1.534 -11.731  -1.202
  590    HG1  THR  72           HG1      THR  72   2.118 -10.567  -3.015
  591   HG21  THR  72          3HG2      THR  72   1.217 -13.881  -2.403
  592   HG22  THR  72          1HG2      THR  72  -0.295 -13.273  -3.085
  593   HG23  THR  72          2HG2      THR  72  -0.151 -13.535  -1.346
  594    H    VAL  73           H        VAL  73   0.026 -10.025   0.601
  595    HA   VAL  73           HA       VAL  73   1.430  -7.524  -0.121
  596    HB   VAL  73           HB       VAL  73  -0.882  -7.011   0.712
  597   HG11  VAL  73          1HG1      VAL  73  -1.453  -7.263   3.097
  598   HG12  VAL  73          2HG1      VAL  73   0.044  -8.162   3.368
  599   HG13  VAL  73          3HG1      VAL  73  -1.206  -8.830   2.320
  600   HG21  VAL  73          3HG2      VAL  73  -0.199  -5.231   2.261
  601   HG22  VAL  73          1HG2      VAL  73   0.934  -5.366   0.918
  602   HG23  VAL  73          2HG2      VAL  73   1.362  -6.011   2.506
  603    H    THR  74           H        THR  74   3.207  -7.109   0.949
  604    HA   THR  74           HA       THR  74   3.887  -8.369   3.496
  605    HB   THR  74           HB       THR  74   5.152  -9.740   1.946
  606    HG1  THR  74           HG1      THR  74   7.380  -8.869   2.407
  607   HG21  THR  74          3HG2      THR  74   5.051  -8.383  -0.098
  608   HG22  THR  74          1HG2      THR  74   6.712  -8.841   0.246
  609   HG23  THR  74          2HG2      THR  74   6.159  -7.201   0.608
  610    H    TYR  75           H        TYR  75   4.531  -6.788   4.849
  611    HA   TYR  75           HA       TYR  75   5.378  -4.163   3.826
  612    HB2  TYR  75           2HB      TYR  75   3.741  -2.998   5.342
  613    HB3  TYR  75           3HB      TYR  75   2.962  -3.870   4.029
  614    HD1  TYR  75           HD1      TYR  75   3.532  -3.811   7.692
  615    HD2  TYR  75           HD2      TYR  75   1.508  -5.789   4.492
  616    HE1  TYR  75           HE1      TYR  75   2.110  -4.984   9.312
  617    HE2  TYR  75           HE2      TYR  75   0.089  -6.956   6.109
  618    HH   TYR  75           HH       TYR  75  -0.196  -6.095   9.300
  619    H    THR  76           H        THR  76   6.573  -2.940   5.376
  620    HA   THR  76           HA       THR  76   7.569  -4.544   7.662
  621    HB   THR  76           HB       THR  76   9.107  -2.300   6.269
  622    HG1  THR  76           HG1      THR  76   8.951  -3.766   4.666
  623   HG21  THR  76          3HG2      THR  76  10.023  -4.619   8.020
  624   HG22  THR  76          1HG2      THR  76   9.919  -2.932   8.516
  625   HG23  THR  76          2HG2      THR  76  11.070  -3.411   7.268
  626    H    ILE  77           H        ILE  77   6.972  -3.809   9.548
  627    HA   ILE  77           HA       ILE  77   7.434  -1.068  10.318
  628    HB   ILE  77           HB       ILE  77   5.213  -1.063  11.738
  629   HG12  ILE  77          2HG1      ILE  77   4.287  -2.866   9.455
  630   HG13  ILE  77          3HG1      ILE  77   4.497  -3.370  11.128
  631   HG21  ILE  77          1HG2      ILE  77   5.686   0.640  10.065
  632   HG22  ILE  77          2HG2      ILE  77   3.977   0.207  10.053
  633   HG23  ILE  77          3HG2      ILE  77   5.052  -0.403   8.793
  634   HD11  ILE  77          3HD1      ILE  77   2.171  -3.011  10.630
  635   HD12  ILE  77          1HD1      ILE  77   2.495  -1.358  10.107
  636   HD13  ILE  77          2HD1      ILE  77   2.716  -1.810  11.800
  637    H    ARG  78           H        ARG  78   8.472  -1.124  12.171
  638    HA   ARG  78           HA       ARG  78   7.851  -3.205  14.202
  639    HB2  ARG  78           2HB      ARG  78  10.541  -1.787  13.816
  640    HB3  ARG  78           3HB      ARG  78  10.177  -3.031  15.004
  641    HG2  ARG  78           2HG      ARG  78  10.274  -3.408  12.002
  642    HG3  ARG  78           3HG      ARG  78  11.505  -3.920  13.153
  643    HD2  ARG  78           2HD      ARG  78  10.024  -5.574  14.101
  644    HD3  ARG  78           3HD      ARG  78   8.648  -4.949  13.181
  645    HE   ARG  78           HE       ARG  78  11.007  -6.075  11.815
  646   HH11  ARG  78          1HH1      ARG  78   7.530  -6.157  12.360
  647   HH12  ARG  78          2HH1      ARG  78   7.253  -7.308  11.091
  648   HH21  ARG  78          1HH2      ARG  78  10.615  -7.566  10.178
  649   HH22  ARG  78          2HH2      ARG  78   8.995  -8.105   9.866
  650    H    GLY  79           H        GLY  79   8.274  -2.340  16.465
  651    HA2  GLY  79           2HA      GLY  79   8.510   0.488  16.879
  652    HA3  GLY  79           3HA      GLY  79   6.846  -0.064  17.061
  653    H    SER  80           H        SER  80   6.466  -1.827  18.605
  654    HA   SER  80           HA       SER  80   7.860  -1.193  21.093
  655    HB2  SER  80           2HB      SER  80   5.833  -2.387  22.092
  656    HB3  SER  80           3HB      SER  80   5.468  -0.944  21.142
  657    HG   SER  80           HG       SER  80   4.494  -3.354  20.789
  658    H    LEU  81           H        LEU  81   9.421  -2.800  19.396
  659    HA   LEU  81           HA       LEU  81   9.407  -5.568  20.056
  660    HB2  LEU  81           2HB      LEU  81  11.699  -3.749  19.204
  661    HB3  LEU  81           3HB      LEU  81  11.843  -5.493  19.344
  662    HG   LEU  81           HG       LEU  81   9.995  -4.055  17.391
  663   HD11  LEU  81          1HD1      LEU  81  12.339  -3.734  16.762
  664   HD12  LEU  81          2HD1      LEU  81  11.550  -4.828  15.632
  665   HD13  LEU  81          3HD1      LEU  81  12.639  -5.472  16.865
  666   HD21  LEU  81          3HD2      LEU  81   9.069  -6.220  18.050
  667   HD22  LEU  81          1HD2      LEU  81  10.601  -7.021  17.685
  668   HD23  LEU  81          2HD2      LEU  81   9.648  -6.293  16.388
  669    H    GLU  82           H        GLU  82  10.237  -2.825  21.878
  670    HA   GLU  82           HA       GLU  82  12.195  -3.701  23.670
  671    HB2  GLU  82           2HB      GLU  82  11.456  -1.833  25.090
  672    HB3  GLU  82           3HB      GLU  82  11.536  -1.340  23.405
  673    HG2  GLU  82           2HG      GLU  82   9.018  -1.716  23.285
  674    HG3  GLU  82           3HG      GLU  82   9.048  -1.929  25.035
  675    H    HIS  83           H        HIS  83  11.931  -4.176  25.975
  676    HA   HIS  83           HA       HIS  83   9.406  -5.286  26.903
  677    HB2  HIS  83           2HB      HIS  83  10.589  -7.199  25.751
  678    HB3  HIS  83           3HB      HIS  83  11.940  -7.006  26.866
  679    HD1  HIS  83           HD1      HIS  83  11.823  -8.620  28.770
  680    HD2  HIS  83           HD2      HIS  83   8.050  -7.663  27.332
  681    HE1  HIS  83           HE1      HIS  83  10.211  -9.934  30.180
  682    HE2  HIS  83           HE2      HIS  83   7.941  -9.162  29.426
  683    H    HIS  84           H        HIS  84   9.442  -3.552  28.333
  684    HA   HIS  84           HA       HIS  84  11.691  -3.101  30.119
  685    HB2  HIS  84           2HB      HIS  84  10.377  -1.172  29.304
  686    HB3  HIS  84           3HB      HIS  84   8.929  -1.804  30.080
  687    HD1  HIS  84           HD1      HIS  84   8.480  -0.279  32.026
  688    HD2  HIS  84           HD2      HIS  84  12.518  -1.211  31.728
  689    HE1  HIS  84           HE1      HIS  84   9.566   0.788  34.022
  690    HE2  HIS  84           HE2      HIS  84  12.021   0.353  33.720
  691    H    HIS  85           H        HIS  85  11.950  -4.791  31.458
  692    HA   HIS  85           HA       HIS  85   9.742  -5.792  33.100
  693    HB2  HIS  85           2HB      HIS  85  11.437  -7.415  33.950
  694    HB3  HIS  85           3HB      HIS  85  11.263  -7.466  32.201
  695    HD1  HIS  85           HD1      HIS  85  13.280  -6.588  30.785
  696    HD2  HIS  85           HD2      HIS  85  13.977  -6.716  34.877
  697    HE1  HIS  85           HE1      HIS  85  15.772  -6.420  31.047
  698    HE2  HIS  85           HE2      HIS  85  16.156  -6.351  33.527
  699    H    HIS  86           H        HIS  86  10.169  -5.982  35.488
  700    HA   HIS  86           HA       HIS  86  11.181  -3.406  36.565
  701    HB2  HIS  86           2HB      HIS  86   9.228  -5.427  37.786
  702    HB3  HIS  86           3HB      HIS  86   9.713  -3.903  38.524
  703    HD1  HIS  86           HD1      HIS  86   7.324  -2.973  38.575
  704    HD2  HIS  86           HD2      HIS  86   8.566  -3.982  34.739
  705    HE1  HIS  86           HE1      HIS  86   5.599  -2.005  37.024
  706    HE2  HIS  86           HE2      HIS  86   6.324  -2.708  34.725
  707    H    HIS  87           H        HIS  87  12.617  -3.409  38.379
  708    HA   HIS  87           HA       HIS  87  13.999  -5.861  39.135
  709    HB2  HIS  87           2HB      HIS  87  14.110  -3.047  40.334
  710    HB3  HIS  87           3HB      HIS  87  15.086  -4.392  40.912
  711    HD1  HIS  87           HD1      HIS  87  15.499  -1.530  38.973
  712    HD2  HIS  87           HD2      HIS  87  16.625  -5.490  38.435
  713    HE1  HIS  87           HE1      HIS  87  17.389  -1.464  37.319
  714    HE2  HIS  87           HE2      HIS  87  18.172  -3.852  37.164
  715    H    HIS  88           H        HIS  88  11.722  -3.587  40.578
  716    HA   HIS  88           HA       HIS  88  10.439  -5.675  42.164
  717    HB2  HIS  88           2HB      HIS  88  11.997  -4.635  43.768
  718    HB3  HIS  88           3HB      HIS  88  11.445  -3.025  43.329
  719    HD1  HIS  88           HD1      HIS  88  10.229  -6.136  45.114
  720    HD2  HIS  88           HD2      HIS  88   9.253  -2.113  44.772
  721    HE1  HIS  88           HE1      HIS  88   8.425  -5.737  46.817
  722    HE2  HIS  88           HE2      HIS  88   7.769  -3.328  46.509